USER MOD reduce.3.24.130724 H: found=0, std=0, add=997, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 994 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 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 122 HIS : no HD1:sc= -0.0833 X(o=-0.083,f=-0.51) USER MOD Set 2.1: A 93 SER OG : rot 180:sc= -0.543 USER MOD Set 2.2: A 95 ASN : amide:sc= -5.03! C(o=-5.6!,f=-19!) USER MOD Set 3.1: A 73 HIS : no HE2:sc= -0.787 K(o=0.33,f=-9.1!) USER MOD Set 3.2: A 85 SER OG : rot -104:sc= 1.12 USER MOD Set 4.1: A 55 LYS NZ :NH3+ 177:sc= 0.104! (180deg=0.0955!) USER MOD Set 4.2: A 82 TYR OH : rot 174:sc= -5.03! USER MOD Set 5.1: A 33 LYS NZ :NH3+ -159:sc= 0.0989 (180deg=0) USER MOD Set 5.2: A 151 TYR OH : rot 180:sc= 0.0932 USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 160:sc= -1.27 USER MOD Single : A 6 TYR OH : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= -0.417 K(o=-0.42,f=-2.8!) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 170:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 ASN : amide:sc= -0.0184 K(o=-0.018,f=-2!) USER MOD Single : A 37 GLN : amide:sc= -0.0132 K(o=-0.013,f=-1.6!) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 CYS SG : rot 180:sc= 0 USER MOD Single : A 53 THR OG1 : rot 0:sc= -3.9! USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 HIS : no HD1:sc= -9.92! C(o=-9.9!,f=-11!) USER MOD Single : A 71 LYS NZ :NH3+ -143:sc= 0 (180deg=-0.0236) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 ASN :FLIP amide:sc= -0.0111 F(o=-0.78,f=-0.011) USER MOD Single : A 80 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 81 THR OG1 : rot 55:sc= 0.54 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 TYR OH : rot 108:sc= 1.01 USER MOD Single : A 98 LYS NZ :NH3+ 165:sc= -3.61! (180deg=-4.28!) USER MOD Single : A 101 TYR OH : rot 30:sc= 0 USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 110 HIS : no HD1:sc= 0 X(o=0,f=-0.025) USER MOD Single : A 113 THR OG1 : rot 124:sc= 0.591 USER MOD Single : A 116 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0103) USER MOD Single : A 117 THR OG1 : rot 180:sc=-0.000522 USER MOD Single : A 118 THR OG1 : rot 180:sc=-0.000819 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 HIS : no HD1:sc= -0.0376 X(o=-0.038,f=0) USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 8 N VAL A 3 -8.077 -0.934 17.954 1.00 0.00 N ATOM 9 CA VAL A 3 -6.718 -1.309 17.472 1.00 0.00 C ATOM 10 C VAL A 3 -6.125 -0.152 16.665 1.00 0.00 C ATOM 11 O VAL A 3 -6.822 0.539 15.948 1.00 0.00 O ATOM 12 CB VAL A 3 -6.816 -2.551 16.585 1.00 0.00 C ATOM 13 CG1 VAL A 3 -7.585 -2.207 15.308 1.00 0.00 C ATOM 14 CG2 VAL A 3 -5.410 -3.030 16.220 1.00 0.00 C ATOM 0 HA VAL A 3 -6.076 -1.522 18.327 1.00 0.00 H new ATOM 0 HB VAL A 3 -7.340 -3.341 17.123 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -7.655 -3.092 14.676 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -8.587 -1.866 15.567 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -7.061 -1.417 14.770 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -5.480 -3.915 15.588 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -4.885 -2.241 15.682 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -4.862 -3.276 17.129 1.00 0.00 H new ATOM 24 N TYR A 4 -4.843 0.064 16.774 1.00 0.00 N ATOM 25 CA TYR A 4 -4.207 1.176 16.012 1.00 0.00 C ATOM 26 C TYR A 4 -3.280 0.596 14.942 1.00 0.00 C ATOM 27 O TYR A 4 -2.643 -0.419 15.142 1.00 0.00 O ATOM 28 CB TYR A 4 -3.394 2.051 16.967 1.00 0.00 C ATOM 29 CG TYR A 4 -4.288 2.549 18.078 1.00 0.00 C ATOM 30 CD1 TYR A 4 -5.102 3.670 17.873 1.00 0.00 C ATOM 31 CD2 TYR A 4 -4.300 1.892 19.314 1.00 0.00 C ATOM 32 CE1 TYR A 4 -5.929 4.132 18.902 1.00 0.00 C ATOM 33 CE2 TYR A 4 -5.128 2.354 20.344 1.00 0.00 C ATOM 34 CZ TYR A 4 -5.942 3.474 20.138 1.00 0.00 C ATOM 35 OH TYR A 4 -6.758 3.930 21.153 1.00 0.00 O ATOM 0 H TYR A 4 -4.208 -0.481 17.358 1.00 0.00 H new ATOM 0 HA TYR A 4 -4.981 1.778 15.537 1.00 0.00 H new ATOM 0 HB2 TYR A 4 -2.563 1.480 17.382 1.00 0.00 H new ATOM 0 HB3 TYR A 4 -2.963 2.894 16.427 1.00 0.00 H new ATOM 0 HD1 TYR A 4 -5.091 4.178 16.920 1.00 0.00 H new ATOM 0 HD2 TYR A 4 -3.671 1.029 19.473 1.00 0.00 H new ATOM 0 HE1 TYR A 4 -6.557 4.996 18.743 1.00 0.00 H new ATOM 0 HE2 TYR A 4 -5.139 1.846 21.297 1.00 0.00 H new ATOM 0 HH TYR A 4 -6.647 3.360 21.943 1.00 0.00 H new ATOM 45 N THR A 5 -3.198 1.234 13.806 1.00 0.00 N ATOM 46 CA THR A 5 -2.309 0.722 12.727 1.00 0.00 C ATOM 47 C THR A 5 -0.945 1.408 12.825 1.00 0.00 C ATOM 48 O THR A 5 -0.852 2.585 13.114 1.00 0.00 O ATOM 49 CB THR A 5 -2.937 1.024 11.363 1.00 0.00 C ATOM 50 OG1 THR A 5 -4.257 0.500 11.325 1.00 0.00 O ATOM 51 CG2 THR A 5 -2.099 0.378 10.259 1.00 0.00 C ATOM 0 H THR A 5 -3.709 2.087 13.580 1.00 0.00 H new ATOM 0 HA THR A 5 -2.183 -0.355 12.838 1.00 0.00 H new ATOM 0 HB THR A 5 -2.969 2.103 11.208 1.00 0.00 H new ATOM 0 HG1 THR A 5 -4.767 0.948 10.618 1.00 0.00 H new ATOM 0 HG21 THR A 5 -2.547 0.594 9.289 1.00 0.00 H new ATOM 0 HG22 THR A 5 -1.086 0.780 10.289 1.00 0.00 H new ATOM 0 HG23 THR A 5 -2.066 -0.701 10.412 1.00 0.00 H new ATOM 59 N TYR A 6 0.114 0.682 12.591 1.00 0.00 N ATOM 60 CA TYR A 6 1.469 1.296 12.677 1.00 0.00 C ATOM 61 C TYR A 6 2.149 1.232 11.308 1.00 0.00 C ATOM 62 O TYR A 6 2.169 0.205 10.660 1.00 0.00 O ATOM 63 CB TYR A 6 2.311 0.530 13.699 1.00 0.00 C ATOM 64 CG TYR A 6 3.652 1.204 13.855 1.00 0.00 C ATOM 65 CD1 TYR A 6 3.794 2.286 14.733 1.00 0.00 C ATOM 66 CD2 TYR A 6 4.754 0.749 13.122 1.00 0.00 C ATOM 67 CE1 TYR A 6 5.038 2.912 14.877 1.00 0.00 C ATOM 68 CE2 TYR A 6 5.998 1.374 13.266 1.00 0.00 C ATOM 69 CZ TYR A 6 6.140 2.455 14.144 1.00 0.00 C ATOM 70 OH TYR A 6 7.366 3.071 14.287 1.00 0.00 O ATOM 0 H TYR A 6 0.100 -0.308 12.345 1.00 0.00 H new ATOM 0 HA TYR A 6 1.376 2.337 12.987 1.00 0.00 H new ATOM 0 HB2 TYR A 6 1.795 0.497 14.659 1.00 0.00 H new ATOM 0 HB3 TYR A 6 2.446 -0.502 13.374 1.00 0.00 H new ATOM 0 HD1 TYR A 6 2.944 2.637 15.299 1.00 0.00 H new ATOM 0 HD2 TYR A 6 4.644 -0.085 12.445 1.00 0.00 H new ATOM 0 HE1 TYR A 6 5.148 3.747 15.553 1.00 0.00 H new ATOM 0 HE2 TYR A 6 6.848 1.022 12.700 1.00 0.00 H new ATOM 0 HH TYR A 6 8.023 2.631 13.708 1.00 0.00 H new ATOM 80 N GLU A 7 2.709 2.325 10.863 1.00 0.00 N ATOM 81 CA GLU A 7 3.390 2.329 9.538 1.00 0.00 C ATOM 82 C GLU A 7 4.903 2.423 9.745 1.00 0.00 C ATOM 83 O GLU A 7 5.380 3.178 10.568 1.00 0.00 O ATOM 84 CB GLU A 7 2.913 3.534 8.723 1.00 0.00 C ATOM 85 CG GLU A 7 3.585 3.518 7.350 1.00 0.00 C ATOM 86 CD GLU A 7 3.142 4.747 6.552 1.00 0.00 C ATOM 87 OE1 GLU A 7 2.419 5.559 7.105 1.00 0.00 O ATOM 88 OE2 GLU A 7 3.534 4.855 5.401 1.00 0.00 O ATOM 0 H GLU A 7 2.724 3.215 11.361 1.00 0.00 H new ATOM 0 HA GLU A 7 3.151 1.410 9.003 1.00 0.00 H new ATOM 0 HB2 GLU A 7 1.829 3.504 8.610 1.00 0.00 H new ATOM 0 HB3 GLU A 7 3.153 4.459 9.247 1.00 0.00 H new ATOM 0 HG2 GLU A 7 4.669 3.516 7.464 1.00 0.00 H new ATOM 0 HG3 GLU A 7 3.319 2.607 6.813 1.00 0.00 H new ATOM 95 N ASN A 8 5.662 1.661 9.006 1.00 0.00 N ATOM 96 CA ASN A 8 7.144 1.709 9.164 1.00 0.00 C ATOM 97 C ASN A 8 7.781 2.161 7.849 1.00 0.00 C ATOM 98 O ASN A 8 7.225 1.983 6.785 1.00 0.00 O ATOM 99 CB ASN A 8 7.663 0.317 9.531 1.00 0.00 C ATOM 100 CG ASN A 8 8.801 0.448 10.546 1.00 0.00 C ATOM 101 OD1 ASN A 8 8.886 1.429 11.258 1.00 0.00 O ATOM 102 ND2 ASN A 8 9.686 -0.505 10.642 1.00 0.00 N ATOM 0 H ASN A 8 5.321 1.008 8.300 1.00 0.00 H new ATOM 0 HA ASN A 8 7.403 2.413 9.955 1.00 0.00 H new ATOM 0 HB2 ASN A 8 6.856 -0.285 9.949 1.00 0.00 H new ATOM 0 HB3 ASN A 8 8.016 -0.199 8.638 1.00 0.00 H new ATOM 0 HD21 ASN A 8 10.449 -0.427 11.314 1.00 0.00 H new ATOM 0 HD22 ASN A 8 9.615 -1.329 10.045 1.00 0.00 H new ATOM 109 N GLU A 9 8.946 2.747 7.915 1.00 0.00 N ATOM 110 CA GLU A 9 9.618 3.209 6.668 1.00 0.00 C ATOM 111 C GLU A 9 11.088 2.785 6.693 1.00 0.00 C ATOM 112 O GLU A 9 11.879 3.299 7.458 1.00 0.00 O ATOM 113 CB GLU A 9 9.529 4.734 6.575 1.00 0.00 C ATOM 114 CG GLU A 9 9.887 5.180 5.156 1.00 0.00 C ATOM 115 CD GLU A 9 9.910 6.708 5.090 1.00 0.00 C ATOM 116 OE1 GLU A 9 9.562 7.329 6.082 1.00 0.00 O ATOM 117 OE2 GLU A 9 10.275 7.231 4.050 1.00 0.00 O ATOM 0 H GLU A 9 9.460 2.925 8.778 1.00 0.00 H new ATOM 0 HA GLU A 9 9.126 2.763 5.804 1.00 0.00 H new ATOM 0 HB2 GLU A 9 8.523 5.066 6.829 1.00 0.00 H new ATOM 0 HB3 GLU A 9 10.207 5.193 7.294 1.00 0.00 H new ATOM 0 HG2 GLU A 9 10.860 4.779 4.872 1.00 0.00 H new ATOM 0 HG3 GLU A 9 9.160 4.786 4.446 1.00 0.00 H new ATOM 124 N PHE A 10 11.460 1.849 5.863 1.00 0.00 N ATOM 125 CA PHE A 10 12.879 1.394 5.841 1.00 0.00 C ATOM 126 C PHE A 10 13.453 1.573 4.434 1.00 0.00 C ATOM 127 O PHE A 10 12.877 1.136 3.458 1.00 0.00 O ATOM 128 CB PHE A 10 12.948 -0.083 6.234 1.00 0.00 C ATOM 129 CG PHE A 10 14.362 -0.585 6.057 1.00 0.00 C ATOM 130 CD1 PHE A 10 14.781 -1.071 4.812 1.00 0.00 C ATOM 131 CD2 PHE A 10 15.253 -0.561 7.136 1.00 0.00 C ATOM 132 CE1 PHE A 10 16.092 -1.534 4.647 1.00 0.00 C ATOM 133 CE2 PHE A 10 16.564 -1.024 6.970 1.00 0.00 C ATOM 134 CZ PHE A 10 16.984 -1.511 5.726 1.00 0.00 C ATOM 0 H PHE A 10 10.843 1.380 5.200 1.00 0.00 H new ATOM 0 HA PHE A 10 13.459 1.987 6.548 1.00 0.00 H new ATOM 0 HB2 PHE A 10 12.632 -0.210 7.270 1.00 0.00 H new ATOM 0 HB3 PHE A 10 12.264 -0.667 5.618 1.00 0.00 H new ATOM 0 HD1 PHE A 10 14.093 -1.089 3.980 1.00 0.00 H new ATOM 0 HD2 PHE A 10 14.930 -0.186 8.096 1.00 0.00 H new ATOM 0 HE1 PHE A 10 16.415 -1.909 3.687 1.00 0.00 H new ATOM 0 HE2 PHE A 10 17.252 -1.006 7.802 1.00 0.00 H new ATOM 0 HZ PHE A 10 17.995 -1.869 5.599 1.00 0.00 H new ATOM 144 N THR A 11 14.586 2.212 4.322 1.00 0.00 N ATOM 145 CA THR A 11 15.197 2.415 2.978 1.00 0.00 C ATOM 146 C THR A 11 16.165 1.267 2.684 1.00 0.00 C ATOM 147 O THR A 11 16.765 0.705 3.578 1.00 0.00 O ATOM 148 CB THR A 11 15.960 3.741 2.959 1.00 0.00 C ATOM 149 OG1 THR A 11 17.154 3.609 3.718 1.00 0.00 O ATOM 150 CG2 THR A 11 15.088 4.842 3.563 1.00 0.00 C ATOM 0 H THR A 11 15.114 2.602 5.103 1.00 0.00 H new ATOM 0 HA THR A 11 14.413 2.436 2.221 1.00 0.00 H new ATOM 0 HB THR A 11 16.210 4.002 1.931 1.00 0.00 H new ATOM 0 HG1 THR A 11 17.645 4.457 3.706 1.00 0.00 H new ATOM 0 HG21 THR A 11 15.632 5.786 3.549 1.00 0.00 H new ATOM 0 HG22 THR A 11 14.173 4.942 2.980 1.00 0.00 H new ATOM 0 HG23 THR A 11 14.836 4.584 4.592 1.00 0.00 H new ATOM 158 N SER A 12 16.322 0.913 1.439 1.00 0.00 N ATOM 159 CA SER A 12 17.251 -0.198 1.095 1.00 0.00 C ATOM 160 C SER A 12 17.911 0.080 -0.256 1.00 0.00 C ATOM 161 O SER A 12 17.491 0.947 -0.997 1.00 0.00 O ATOM 162 CB SER A 12 16.467 -1.509 1.016 1.00 0.00 C ATOM 163 OG SER A 12 15.674 -1.514 -0.163 1.00 0.00 O ATOM 0 H SER A 12 15.848 1.345 0.646 1.00 0.00 H new ATOM 0 HA SER A 12 18.020 -0.276 1.863 1.00 0.00 H new ATOM 0 HB2 SER A 12 17.153 -2.356 1.010 1.00 0.00 H new ATOM 0 HB3 SER A 12 15.832 -1.619 1.895 1.00 0.00 H new ATOM 0 HG SER A 12 15.298 -2.409 -0.301 1.00 0.00 H new ATOM 169 N ASP A 13 18.941 -0.651 -0.582 1.00 0.00 N ATOM 170 CA ASP A 13 19.627 -0.434 -1.886 1.00 0.00 C ATOM 171 C ASP A 13 18.747 -0.975 -3.015 1.00 0.00 C ATOM 172 O ASP A 13 17.638 -1.416 -2.791 1.00 0.00 O ATOM 173 CB ASP A 13 20.966 -1.172 -1.882 1.00 0.00 C ATOM 174 CG ASP A 13 21.945 -0.444 -0.959 1.00 0.00 C ATOM 175 OD1 ASP A 13 21.650 0.678 -0.580 1.00 0.00 O ATOM 176 OD2 ASP A 13 22.972 -1.021 -0.644 1.00 0.00 O ATOM 0 H ASP A 13 19.337 -1.390 -0.001 1.00 0.00 H new ATOM 0 HA ASP A 13 19.800 0.631 -2.038 1.00 0.00 H new ATOM 0 HB2 ASP A 13 20.827 -2.199 -1.545 1.00 0.00 H new ATOM 0 HB3 ASP A 13 21.370 -1.220 -2.893 1.00 0.00 H new ATOM 181 N ILE A 14 19.230 -0.947 -4.228 1.00 0.00 N ATOM 182 CA ILE A 14 18.413 -1.462 -5.363 1.00 0.00 C ATOM 183 C ILE A 14 17.181 -0.570 -5.539 1.00 0.00 C ATOM 184 O ILE A 14 16.604 -0.102 -4.577 1.00 0.00 O ATOM 185 CB ILE A 14 17.971 -2.895 -5.057 1.00 0.00 C ATOM 186 CG1 ILE A 14 19.126 -3.658 -4.401 1.00 0.00 C ATOM 187 CG2 ILE A 14 17.574 -3.598 -6.355 1.00 0.00 C ATOM 188 CD1 ILE A 14 18.700 -4.134 -3.011 1.00 0.00 C ATOM 0 H ILE A 14 20.152 -0.591 -4.481 1.00 0.00 H new ATOM 0 HA ILE A 14 19.003 -1.453 -6.279 1.00 0.00 H new ATOM 0 HB ILE A 14 17.117 -2.871 -4.380 1.00 0.00 H new ATOM 0 HG12 ILE A 14 19.409 -4.511 -5.018 1.00 0.00 H new ATOM 0 HG13 ILE A 14 20.003 -3.015 -4.324 1.00 0.00 H new ATOM 0 HG21 ILE A 14 17.260 -4.618 -6.135 1.00 0.00 H new ATOM 0 HG22 ILE A 14 16.752 -3.058 -6.824 1.00 0.00 H new ATOM 0 HG23 ILE A 14 18.427 -3.620 -7.033 1.00 0.00 H new ATOM 0 HD11 ILE A 14 19.522 -4.677 -2.545 1.00 0.00 H new ATOM 0 HD12 ILE A 14 18.438 -3.273 -2.396 1.00 0.00 H new ATOM 0 HD13 ILE A 14 17.836 -4.792 -3.101 1.00 0.00 H new ATOM 200 N PRO A 15 16.774 -0.327 -6.795 1.00 0.00 N ATOM 201 CA PRO A 15 15.610 0.516 -7.096 1.00 0.00 C ATOM 202 C PRO A 15 14.295 -0.145 -6.668 1.00 0.00 C ATOM 203 O PRO A 15 14.145 -1.350 -6.711 1.00 0.00 O ATOM 204 CB PRO A 15 15.664 0.675 -8.616 1.00 0.00 C ATOM 205 CG PRO A 15 16.414 -0.521 -9.093 1.00 0.00 C ATOM 206 CD PRO A 15 17.410 -0.851 -8.016 1.00 0.00 C ATOM 0 HA PRO A 15 15.641 1.464 -6.560 1.00 0.00 H new ATOM 0 HB2 PRO A 15 14.663 0.713 -9.046 1.00 0.00 H new ATOM 0 HB3 PRO A 15 16.168 1.599 -8.900 1.00 0.00 H new ATOM 0 HG2 PRO A 15 15.739 -1.359 -9.269 1.00 0.00 H new ATOM 0 HG3 PRO A 15 16.917 -0.314 -10.038 1.00 0.00 H new ATOM 0 HD2 PRO A 15 17.588 -1.924 -7.948 1.00 0.00 H new ATOM 0 HD3 PRO A 15 18.375 -0.379 -8.202 1.00 0.00 H new ATOM 214 N ALA A 16 13.347 0.645 -6.247 1.00 0.00 N ATOM 215 CA ALA A 16 12.034 0.096 -5.800 1.00 0.00 C ATOM 216 C ALA A 16 11.509 -0.967 -6.777 1.00 0.00 C ATOM 217 O ALA A 16 11.080 -2.025 -6.362 1.00 0.00 O ATOM 218 CB ALA A 16 11.019 1.237 -5.706 1.00 0.00 C ATOM 0 H ALA A 16 13.426 1.660 -6.193 1.00 0.00 H new ATOM 0 HA ALA A 16 12.173 -0.374 -4.826 1.00 0.00 H new ATOM 0 HB1 ALA A 16 10.057 0.842 -5.380 1.00 0.00 H new ATOM 0 HB2 ALA A 16 11.370 1.978 -4.987 1.00 0.00 H new ATOM 0 HB3 ALA A 16 10.906 1.705 -6.684 1.00 0.00 H new ATOM 224 N PRO A 17 11.514 -0.684 -8.093 1.00 0.00 N ATOM 225 CA PRO A 17 11.004 -1.629 -9.102 1.00 0.00 C ATOM 226 C PRO A 17 11.810 -2.933 -9.167 1.00 0.00 C ATOM 227 O PRO A 17 11.253 -4.002 -9.313 1.00 0.00 O ATOM 228 CB PRO A 17 11.127 -0.854 -10.415 1.00 0.00 C ATOM 229 CG PRO A 17 12.193 0.151 -10.151 1.00 0.00 C ATOM 230 CD PRO A 17 12.013 0.558 -8.717 1.00 0.00 C ATOM 0 HA PRO A 17 9.987 -1.947 -8.871 1.00 0.00 H new ATOM 0 HB2 PRO A 17 11.396 -1.512 -11.241 1.00 0.00 H new ATOM 0 HB3 PRO A 17 10.186 -0.374 -10.683 1.00 0.00 H new ATOM 0 HG2 PRO A 17 13.183 -0.274 -10.317 1.00 0.00 H new ATOM 0 HG3 PRO A 17 12.098 1.008 -10.817 1.00 0.00 H new ATOM 0 HD2 PRO A 17 12.950 0.890 -8.269 1.00 0.00 H new ATOM 0 HD3 PRO A 17 11.302 1.378 -8.614 1.00 0.00 H new ATOM 238 N LYS A 18 13.107 -2.864 -9.063 1.00 0.00 N ATOM 239 CA LYS A 18 13.915 -4.116 -9.124 1.00 0.00 C ATOM 240 C LYS A 18 13.640 -4.964 -7.880 1.00 0.00 C ATOM 241 O LYS A 18 13.584 -6.176 -7.944 1.00 0.00 O ATOM 242 CB LYS A 18 15.403 -3.770 -9.187 1.00 0.00 C ATOM 243 CG LYS A 18 15.747 -3.255 -10.586 1.00 0.00 C ATOM 244 CD LYS A 18 17.257 -3.047 -10.695 1.00 0.00 C ATOM 245 CE LYS A 18 17.574 -2.258 -11.968 1.00 0.00 C ATOM 246 NZ LYS A 18 17.978 -3.201 -13.049 1.00 0.00 N ATOM 0 H LYS A 18 13.640 -2.003 -8.939 1.00 0.00 H new ATOM 0 HA LYS A 18 13.639 -4.678 -10.016 1.00 0.00 H new ATOM 0 HB2 LYS A 18 15.644 -3.014 -8.440 1.00 0.00 H new ATOM 0 HB3 LYS A 18 16.002 -4.650 -8.954 1.00 0.00 H new ATOM 0 HG2 LYS A 18 15.412 -3.967 -11.340 1.00 0.00 H new ATOM 0 HG3 LYS A 18 15.225 -2.318 -10.779 1.00 0.00 H new ATOM 0 HD2 LYS A 18 17.625 -2.510 -9.821 1.00 0.00 H new ATOM 0 HD3 LYS A 18 17.767 -4.010 -10.715 1.00 0.00 H new ATOM 0 HE2 LYS A 18 16.702 -1.683 -12.279 1.00 0.00 H new ATOM 0 HE3 LYS A 18 18.374 -1.543 -11.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 18.194 -2.666 -13.914 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 18.822 -3.731 -12.750 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 17.201 -3.866 -13.238 1.00 0.00 H new ATOM 260 N LEU A 19 13.471 -4.338 -6.748 1.00 0.00 N ATOM 261 CA LEU A 19 13.202 -5.111 -5.501 1.00 0.00 C ATOM 262 C LEU A 19 11.723 -5.501 -5.444 1.00 0.00 C ATOM 263 O LEU A 19 11.357 -6.495 -4.848 1.00 0.00 O ATOM 264 CB LEU A 19 13.549 -4.253 -4.283 1.00 0.00 C ATOM 265 CG LEU A 19 13.218 -5.024 -3.005 1.00 0.00 C ATOM 266 CD1 LEU A 19 14.505 -5.296 -2.224 1.00 0.00 C ATOM 267 CD2 LEU A 19 12.263 -4.197 -2.143 1.00 0.00 C ATOM 0 H LEU A 19 13.507 -3.325 -6.632 1.00 0.00 H new ATOM 0 HA LEU A 19 13.814 -6.013 -5.498 1.00 0.00 H new ATOM 0 HB2 LEU A 19 14.607 -3.991 -4.299 1.00 0.00 H new ATOM 0 HB3 LEU A 19 12.989 -3.318 -4.312 1.00 0.00 H new ATOM 0 HG LEU A 19 12.745 -5.971 -3.265 1.00 0.00 H new ATOM 0 HD11 LEU A 19 14.268 -5.846 -1.313 1.00 0.00 H new ATOM 0 HD12 LEU A 19 15.185 -5.886 -2.838 1.00 0.00 H new ATOM 0 HD13 LEU A 19 14.980 -4.350 -1.964 1.00 0.00 H new ATOM 0 HD21 LEU A 19 12.027 -4.747 -1.232 1.00 0.00 H new ATOM 0 HD22 LEU A 19 12.735 -3.250 -1.883 1.00 0.00 H new ATOM 0 HD23 LEU A 19 11.345 -4.005 -2.699 1.00 0.00 H new ATOM 279 N PHE A 20 10.867 -4.725 -6.052 1.00 0.00 N ATOM 280 CA PHE A 20 9.413 -5.053 -6.025 1.00 0.00 C ATOM 281 C PHE A 20 9.160 -6.352 -6.792 1.00 0.00 C ATOM 282 O PHE A 20 8.287 -7.125 -6.449 1.00 0.00 O ATOM 283 CB PHE A 20 8.618 -3.918 -6.673 1.00 0.00 C ATOM 284 CG PHE A 20 7.147 -4.258 -6.647 1.00 0.00 C ATOM 285 CD1 PHE A 20 6.365 -3.896 -5.543 1.00 0.00 C ATOM 286 CD2 PHE A 20 6.564 -4.937 -7.723 1.00 0.00 C ATOM 287 CE1 PHE A 20 5.001 -4.212 -5.517 1.00 0.00 C ATOM 288 CE2 PHE A 20 5.201 -5.254 -7.697 1.00 0.00 C ATOM 289 CZ PHE A 20 4.420 -4.891 -6.594 1.00 0.00 C ATOM 0 H PHE A 20 11.112 -3.879 -6.566 1.00 0.00 H new ATOM 0 HA PHE A 20 9.094 -5.177 -4.990 1.00 0.00 H new ATOM 0 HB2 PHE A 20 8.796 -2.984 -6.140 1.00 0.00 H new ATOM 0 HB3 PHE A 20 8.950 -3.767 -7.700 1.00 0.00 H new ATOM 0 HD1 PHE A 20 6.814 -3.373 -4.712 1.00 0.00 H new ATOM 0 HD2 PHE A 20 7.167 -5.217 -8.574 1.00 0.00 H new ATOM 0 HE1 PHE A 20 4.398 -3.932 -4.666 1.00 0.00 H new ATOM 0 HE2 PHE A 20 4.752 -5.778 -8.528 1.00 0.00 H new ATOM 0 HZ PHE A 20 3.368 -5.135 -6.574 1.00 0.00 H new ATOM 299 N LYS A 21 9.911 -6.600 -7.829 1.00 0.00 N ATOM 300 CA LYS A 21 9.704 -7.849 -8.616 1.00 0.00 C ATOM 301 C LYS A 21 10.074 -9.063 -7.760 1.00 0.00 C ATOM 302 O LYS A 21 9.355 -10.039 -7.706 1.00 0.00 O ATOM 303 CB LYS A 21 10.584 -7.822 -9.866 1.00 0.00 C ATOM 304 CG LYS A 21 10.319 -9.077 -10.701 1.00 0.00 C ATOM 305 CD LYS A 21 11.293 -9.123 -11.881 1.00 0.00 C ATOM 306 CE LYS A 21 10.932 -10.301 -12.790 1.00 0.00 C ATOM 307 NZ LYS A 21 11.520 -10.082 -14.143 1.00 0.00 N ATOM 0 H LYS A 21 10.658 -5.993 -8.166 1.00 0.00 H new ATOM 0 HA LYS A 21 8.657 -7.917 -8.911 1.00 0.00 H new ATOM 0 HB2 LYS A 21 10.372 -6.929 -10.454 1.00 0.00 H new ATOM 0 HB3 LYS A 21 11.636 -7.775 -9.583 1.00 0.00 H new ATOM 0 HG2 LYS A 21 10.437 -9.968 -10.084 1.00 0.00 H new ATOM 0 HG3 LYS A 21 9.291 -9.074 -11.064 1.00 0.00 H new ATOM 0 HD2 LYS A 21 11.248 -8.189 -12.441 1.00 0.00 H new ATOM 0 HD3 LYS A 21 12.316 -9.228 -11.519 1.00 0.00 H new ATOM 0 HE2 LYS A 21 11.308 -11.231 -12.364 1.00 0.00 H new ATOM 0 HE3 LYS A 21 9.849 -10.399 -12.864 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 11.275 -10.882 -14.761 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 11.141 -9.202 -14.548 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 12.554 -10.009 -14.064 1.00 0.00 H new ATOM 321 N ALA A 22 11.194 -9.010 -7.093 1.00 0.00 N ATOM 322 CA ALA A 22 11.611 -10.162 -6.244 1.00 0.00 C ATOM 323 C ALA A 22 10.878 -10.106 -4.903 1.00 0.00 C ATOM 324 O ALA A 22 10.739 -11.101 -4.219 1.00 0.00 O ATOM 325 CB ALA A 22 13.121 -10.095 -6.003 1.00 0.00 C ATOM 0 H ALA A 22 11.838 -8.219 -7.099 1.00 0.00 H new ATOM 0 HA ALA A 22 11.363 -11.094 -6.752 1.00 0.00 H new ATOM 0 HB1 ALA A 22 13.428 -10.937 -5.382 1.00 0.00 H new ATOM 0 HB2 ALA A 22 13.644 -10.139 -6.958 1.00 0.00 H new ATOM 0 HB3 ALA A 22 13.368 -9.162 -5.497 1.00 0.00 H new ATOM 331 N PHE A 23 10.408 -8.952 -4.518 1.00 0.00 N ATOM 332 CA PHE A 23 9.686 -8.840 -3.219 1.00 0.00 C ATOM 333 C PHE A 23 8.241 -9.314 -3.391 1.00 0.00 C ATOM 334 O PHE A 23 7.571 -9.653 -2.436 1.00 0.00 O ATOM 335 CB PHE A 23 9.692 -7.381 -2.756 1.00 0.00 C ATOM 336 CG PHE A 23 8.995 -7.276 -1.422 1.00 0.00 C ATOM 337 CD1 PHE A 23 9.727 -7.418 -0.236 1.00 0.00 C ATOM 338 CD2 PHE A 23 7.617 -7.037 -1.369 1.00 0.00 C ATOM 339 CE1 PHE A 23 9.080 -7.320 1.002 1.00 0.00 C ATOM 340 CE2 PHE A 23 6.971 -6.940 -0.130 1.00 0.00 C ATOM 341 CZ PHE A 23 7.702 -7.082 1.055 1.00 0.00 C ATOM 0 H PHE A 23 10.492 -8.083 -5.045 1.00 0.00 H new ATOM 0 HA PHE A 23 10.184 -9.461 -2.474 1.00 0.00 H new ATOM 0 HB2 PHE A 23 10.717 -7.018 -2.673 1.00 0.00 H new ATOM 0 HB3 PHE A 23 9.190 -6.752 -3.492 1.00 0.00 H new ATOM 0 HD1 PHE A 23 10.790 -7.603 -0.277 1.00 0.00 H new ATOM 0 HD2 PHE A 23 7.052 -6.927 -2.283 1.00 0.00 H new ATOM 0 HE1 PHE A 23 9.645 -7.428 1.916 1.00 0.00 H new ATOM 0 HE2 PHE A 23 5.908 -6.755 -0.089 1.00 0.00 H new ATOM 0 HZ PHE A 23 7.203 -7.008 2.010 1.00 0.00 H new ATOM 351 N VAL A 24 7.753 -9.340 -4.602 1.00 0.00 N ATOM 352 CA VAL A 24 6.351 -9.792 -4.830 1.00 0.00 C ATOM 353 C VAL A 24 6.354 -11.055 -5.695 1.00 0.00 C ATOM 354 O VAL A 24 5.939 -12.113 -5.266 1.00 0.00 O ATOM 355 CB VAL A 24 5.568 -8.687 -5.543 1.00 0.00 C ATOM 356 CG1 VAL A 24 4.174 -9.201 -5.905 1.00 0.00 C ATOM 357 CG2 VAL A 24 5.440 -7.474 -4.618 1.00 0.00 C ATOM 0 H VAL A 24 8.264 -9.068 -5.442 1.00 0.00 H new ATOM 0 HA VAL A 24 5.880 -10.011 -3.871 1.00 0.00 H new ATOM 0 HB VAL A 24 6.095 -8.397 -6.452 1.00 0.00 H new ATOM 0 HG11 VAL A 24 3.617 -8.414 -6.413 1.00 0.00 H new ATOM 0 HG12 VAL A 24 4.264 -10.065 -6.564 1.00 0.00 H new ATOM 0 HG13 VAL A 24 3.646 -9.491 -4.997 1.00 0.00 H new ATOM 0 HG21 VAL A 24 4.882 -6.687 -5.125 1.00 0.00 H new ATOM 0 HG22 VAL A 24 4.913 -7.764 -3.709 1.00 0.00 H new ATOM 0 HG23 VAL A 24 6.433 -7.107 -4.360 1.00 0.00 H new ATOM 367 N LEU A 25 6.816 -10.951 -6.910 1.00 0.00 N ATOM 368 CA LEU A 25 6.842 -12.147 -7.802 1.00 0.00 C ATOM 369 C LEU A 25 7.644 -13.267 -7.135 1.00 0.00 C ATOM 370 O LEU A 25 7.275 -14.423 -7.190 1.00 0.00 O ATOM 371 CB LEU A 25 7.496 -11.774 -9.134 1.00 0.00 C ATOM 372 CG LEU A 25 6.758 -10.582 -9.747 1.00 0.00 C ATOM 373 CD1 LEU A 25 7.257 -10.350 -11.175 1.00 0.00 C ATOM 374 CD2 LEU A 25 5.255 -10.871 -9.772 1.00 0.00 C ATOM 0 H LEU A 25 7.176 -10.092 -7.325 1.00 0.00 H new ATOM 0 HA LEU A 25 5.823 -12.489 -7.980 1.00 0.00 H new ATOM 0 HB2 LEU A 25 8.546 -11.525 -8.979 1.00 0.00 H new ATOM 0 HB3 LEU A 25 7.467 -12.624 -9.816 1.00 0.00 H new ATOM 0 HG LEU A 25 6.947 -9.691 -9.148 1.00 0.00 H new ATOM 0 HD11 LEU A 25 6.731 -9.501 -11.611 1.00 0.00 H new ATOM 0 HD12 LEU A 25 8.327 -10.144 -11.157 1.00 0.00 H new ATOM 0 HD13 LEU A 25 7.069 -11.240 -11.775 1.00 0.00 H new ATOM 0 HD21 LEU A 25 4.729 -10.022 -10.209 1.00 0.00 H new ATOM 0 HD22 LEU A 25 5.066 -11.762 -10.370 1.00 0.00 H new ATOM 0 HD23 LEU A 25 4.899 -11.035 -8.755 1.00 0.00 H new ATOM 386 N ASP A 26 8.738 -12.936 -6.506 1.00 0.00 N ATOM 387 CA ASP A 26 9.560 -13.984 -5.839 1.00 0.00 C ATOM 388 C ASP A 26 9.268 -13.983 -4.337 1.00 0.00 C ATOM 389 O ASP A 26 10.004 -14.547 -3.552 1.00 0.00 O ATOM 390 CB ASP A 26 11.043 -13.693 -6.071 1.00 0.00 C ATOM 391 CG ASP A 26 11.323 -13.632 -7.573 1.00 0.00 C ATOM 392 OD1 ASP A 26 10.484 -14.090 -8.331 1.00 0.00 O ATOM 393 OD2 ASP A 26 12.371 -13.127 -7.941 1.00 0.00 O ATOM 0 H ASP A 26 9.098 -11.985 -6.425 1.00 0.00 H new ATOM 0 HA ASP A 26 9.312 -14.960 -6.256 1.00 0.00 H new ATOM 0 HB2 ASP A 26 11.317 -12.749 -5.601 1.00 0.00 H new ATOM 0 HB3 ASP A 26 11.653 -14.468 -5.608 1.00 0.00 H new ATOM 398 N ALA A 27 8.200 -13.352 -3.931 1.00 0.00 N ATOM 399 CA ALA A 27 7.863 -13.315 -2.480 1.00 0.00 C ATOM 400 C ALA A 27 7.429 -14.707 -2.016 1.00 0.00 C ATOM 401 O ALA A 27 7.793 -15.157 -0.947 1.00 0.00 O ATOM 402 CB ALA A 27 6.723 -12.322 -2.249 1.00 0.00 C ATOM 0 H ALA A 27 7.547 -12.861 -4.541 1.00 0.00 H new ATOM 0 HA ALA A 27 8.740 -13.003 -1.913 1.00 0.00 H new ATOM 0 HB1 ALA A 27 6.475 -12.293 -1.188 1.00 0.00 H new ATOM 0 HB2 ALA A 27 7.033 -11.330 -2.576 1.00 0.00 H new ATOM 0 HB3 ALA A 27 5.847 -12.634 -2.818 1.00 0.00 H new ATOM 408 N ASP A 28 6.649 -15.392 -2.808 1.00 0.00 N ATOM 409 CA ASP A 28 6.188 -16.753 -2.408 1.00 0.00 C ATOM 410 C ASP A 28 7.383 -17.707 -2.352 1.00 0.00 C ATOM 411 O ASP A 28 7.402 -18.648 -1.583 1.00 0.00 O ATOM 412 CB ASP A 28 5.172 -17.267 -3.430 1.00 0.00 C ATOM 413 CG ASP A 28 3.908 -16.408 -3.371 1.00 0.00 C ATOM 414 OD1 ASP A 28 3.758 -15.675 -2.408 1.00 0.00 O ATOM 415 OD2 ASP A 28 3.111 -16.498 -4.291 1.00 0.00 O ATOM 0 H ASP A 28 6.311 -15.068 -3.714 1.00 0.00 H new ATOM 0 HA ASP A 28 5.722 -16.702 -1.424 1.00 0.00 H new ATOM 0 HB2 ASP A 28 5.600 -17.234 -4.432 1.00 0.00 H new ATOM 0 HB3 ASP A 28 4.927 -18.308 -3.222 1.00 0.00 H new ATOM 420 N ASN A 29 8.379 -17.477 -3.163 1.00 0.00 N ATOM 421 CA ASN A 29 9.567 -18.377 -3.155 1.00 0.00 C ATOM 422 C ASN A 29 10.672 -17.761 -2.292 1.00 0.00 C ATOM 423 O ASN A 29 11.445 -18.459 -1.667 1.00 0.00 O ATOM 424 CB ASN A 29 10.078 -18.556 -4.585 1.00 0.00 C ATOM 425 CG ASN A 29 9.066 -19.373 -5.390 1.00 0.00 C ATOM 426 OD1 ASN A 29 8.178 -19.984 -4.829 1.00 0.00 O ATOM 427 ND2 ASN A 29 9.161 -19.409 -6.691 1.00 0.00 N ATOM 0 H ASN A 29 8.422 -16.706 -3.830 1.00 0.00 H new ATOM 0 HA ASN A 29 9.285 -19.346 -2.744 1.00 0.00 H new ATOM 0 HB2 ASN A 29 10.230 -17.583 -5.053 1.00 0.00 H new ATOM 0 HB3 ASN A 29 11.044 -19.060 -4.577 1.00 0.00 H new ATOM 0 HD21 ASN A 29 8.490 -19.950 -7.237 1.00 0.00 H new ATOM 0 HD22 ASN A 29 9.906 -18.896 -7.162 1.00 0.00 H new ATOM 434 N LEU A 30 10.754 -16.459 -2.256 1.00 0.00 N ATOM 435 CA LEU A 30 11.812 -15.801 -1.436 1.00 0.00 C ATOM 436 C LEU A 30 11.506 -15.995 0.051 1.00 0.00 C ATOM 437 O LEU A 30 12.370 -16.343 0.831 1.00 0.00 O ATOM 438 CB LEU A 30 11.847 -14.305 -1.756 1.00 0.00 C ATOM 439 CG LEU A 30 13.034 -13.660 -1.038 1.00 0.00 C ATOM 440 CD1 LEU A 30 14.337 -14.118 -1.696 1.00 0.00 C ATOM 441 CD2 LEU A 30 12.923 -12.136 -1.136 1.00 0.00 C ATOM 0 H LEU A 30 10.135 -15.823 -2.758 1.00 0.00 H new ATOM 0 HA LEU A 30 12.779 -16.248 -1.668 1.00 0.00 H new ATOM 0 HB2 LEU A 30 11.933 -14.154 -2.832 1.00 0.00 H new ATOM 0 HB3 LEU A 30 10.917 -13.832 -1.441 1.00 0.00 H new ATOM 0 HG LEU A 30 13.030 -13.959 0.010 1.00 0.00 H new ATOM 0 HD11 LEU A 30 15.183 -13.659 -1.185 1.00 0.00 H new ATOM 0 HD12 LEU A 30 14.417 -15.203 -1.628 1.00 0.00 H new ATOM 0 HD13 LEU A 30 14.340 -13.819 -2.744 1.00 0.00 H new ATOM 0 HD21 LEU A 30 13.769 -11.676 -0.625 1.00 0.00 H new ATOM 0 HD22 LEU A 30 12.927 -11.838 -2.184 1.00 0.00 H new ATOM 0 HD23 LEU A 30 11.994 -11.808 -0.669 1.00 0.00 H new ATOM 453 N ILE A 31 10.285 -15.769 0.452 1.00 0.00 N ATOM 454 CA ILE A 31 9.931 -15.937 1.890 1.00 0.00 C ATOM 455 C ILE A 31 10.494 -17.269 2.401 1.00 0.00 C ATOM 456 O ILE A 31 11.257 -17.303 3.346 1.00 0.00 O ATOM 457 CB ILE A 31 8.406 -15.915 2.046 1.00 0.00 C ATOM 458 CG1 ILE A 31 7.909 -14.470 1.957 1.00 0.00 C ATOM 459 CG2 ILE A 31 8.012 -16.501 3.404 1.00 0.00 C ATOM 460 CD1 ILE A 31 6.578 -14.434 1.205 1.00 0.00 C ATOM 0 H ILE A 31 9.518 -15.476 -0.153 1.00 0.00 H new ATOM 0 HA ILE A 31 10.360 -15.122 2.473 1.00 0.00 H new ATOM 0 HB ILE A 31 7.956 -16.512 1.253 1.00 0.00 H new ATOM 0 HG12 ILE A 31 7.785 -14.055 2.957 1.00 0.00 H new ATOM 0 HG13 ILE A 31 8.646 -13.852 1.444 1.00 0.00 H new ATOM 0 HG21 ILE A 31 6.927 -16.482 3.508 1.00 0.00 H new ATOM 0 HG22 ILE A 31 8.365 -17.530 3.473 1.00 0.00 H new ATOM 0 HG23 ILE A 31 8.463 -15.909 4.200 1.00 0.00 H new ATOM 0 HD11 ILE A 31 6.224 -13.405 1.141 1.00 0.00 H new ATOM 0 HD12 ILE A 31 6.717 -14.833 0.200 1.00 0.00 H new ATOM 0 HD13 ILE A 31 5.843 -15.039 1.737 1.00 0.00 H new ATOM 472 N PRO A 32 10.114 -18.386 1.761 1.00 0.00 N ATOM 473 CA PRO A 32 10.588 -19.722 2.153 1.00 0.00 C ATOM 474 C PRO A 32 12.079 -19.907 1.859 1.00 0.00 C ATOM 475 O PRO A 32 12.752 -20.698 2.487 1.00 0.00 O ATOM 476 CB PRO A 32 9.763 -20.665 1.276 1.00 0.00 C ATOM 477 CG PRO A 32 9.389 -19.838 0.093 1.00 0.00 C ATOM 478 CD PRO A 32 9.195 -18.441 0.610 1.00 0.00 C ATOM 0 HA PRO A 32 10.472 -19.899 3.222 1.00 0.00 H new ATOM 0 HB2 PRO A 32 10.341 -21.541 0.982 1.00 0.00 H new ATOM 0 HB3 PRO A 32 8.880 -21.027 1.803 1.00 0.00 H new ATOM 0 HG2 PRO A 32 10.170 -19.868 -0.667 1.00 0.00 H new ATOM 0 HG3 PRO A 32 8.477 -20.212 -0.372 1.00 0.00 H new ATOM 0 HD2 PRO A 32 9.445 -17.693 -0.143 1.00 0.00 H new ATOM 0 HD3 PRO A 32 8.162 -18.260 0.908 1.00 0.00 H new ATOM 486 N LYS A 33 12.598 -19.184 0.905 1.00 0.00 N ATOM 487 CA LYS A 33 14.044 -19.320 0.569 1.00 0.00 C ATOM 488 C LYS A 33 14.886 -18.618 1.636 1.00 0.00 C ATOM 489 O LYS A 33 15.885 -19.136 2.092 1.00 0.00 O ATOM 490 CB LYS A 33 14.310 -18.681 -0.796 1.00 0.00 C ATOM 491 CG LYS A 33 15.649 -19.178 -1.343 1.00 0.00 C ATOM 492 CD LYS A 33 15.714 -18.916 -2.848 1.00 0.00 C ATOM 493 CE LYS A 33 17.114 -19.249 -3.365 1.00 0.00 C ATOM 494 NZ LYS A 33 17.080 -19.367 -4.851 1.00 0.00 N ATOM 0 H LYS A 33 12.084 -18.505 0.344 1.00 0.00 H new ATOM 0 HA LYS A 33 14.312 -20.376 0.535 1.00 0.00 H new ATOM 0 HB2 LYS A 33 13.507 -18.932 -1.489 1.00 0.00 H new ATOM 0 HB3 LYS A 33 14.324 -17.595 -0.704 1.00 0.00 H new ATOM 0 HG2 LYS A 33 16.471 -18.670 -0.839 1.00 0.00 H new ATOM 0 HG3 LYS A 33 15.763 -20.244 -1.143 1.00 0.00 H new ATOM 0 HD2 LYS A 33 14.970 -19.522 -3.366 1.00 0.00 H new ATOM 0 HD3 LYS A 33 15.477 -17.873 -3.057 1.00 0.00 H new ATOM 0 HE2 LYS A 33 17.818 -18.472 -3.067 1.00 0.00 H new ATOM 0 HE3 LYS A 33 17.464 -20.182 -2.923 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 17.897 -19.923 -5.174 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 16.202 -19.842 -5.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 17.117 -18.418 -5.276 1.00 0.00 H new ATOM 508 N ILE A 34 14.493 -17.440 2.036 1.00 0.00 N ATOM 509 CA ILE A 34 15.272 -16.703 3.071 1.00 0.00 C ATOM 510 C ILE A 34 15.163 -17.431 4.414 1.00 0.00 C ATOM 511 O ILE A 34 16.091 -17.448 5.197 1.00 0.00 O ATOM 512 CB ILE A 34 14.716 -15.285 3.213 1.00 0.00 C ATOM 513 CG1 ILE A 34 14.839 -14.552 1.875 1.00 0.00 C ATOM 514 CG2 ILE A 34 15.509 -14.530 4.283 1.00 0.00 C ATOM 515 CD1 ILE A 34 14.286 -13.133 2.016 1.00 0.00 C ATOM 0 H ILE A 34 13.665 -16.955 1.690 1.00 0.00 H new ATOM 0 HA ILE A 34 16.319 -16.656 2.770 1.00 0.00 H new ATOM 0 HB ILE A 34 13.667 -15.334 3.505 1.00 0.00 H new ATOM 0 HG12 ILE A 34 15.883 -14.517 1.562 1.00 0.00 H new ATOM 0 HG13 ILE A 34 14.292 -15.091 1.102 1.00 0.00 H new ATOM 0 HG21 ILE A 34 15.113 -13.520 4.384 1.00 0.00 H new ATOM 0 HG22 ILE A 34 15.421 -15.051 5.236 1.00 0.00 H new ATOM 0 HG23 ILE A 34 16.558 -14.481 3.991 1.00 0.00 H new ATOM 0 HD11 ILE A 34 14.374 -12.612 1.063 1.00 0.00 H new ATOM 0 HD12 ILE A 34 13.237 -13.179 2.309 1.00 0.00 H new ATOM 0 HD13 ILE A 34 14.852 -12.596 2.777 1.00 0.00 H new ATOM 527 N ALA A 35 14.037 -18.033 4.685 1.00 0.00 N ATOM 528 CA ALA A 35 13.873 -18.758 5.977 1.00 0.00 C ATOM 529 C ALA A 35 13.102 -20.058 5.739 1.00 0.00 C ATOM 530 O ALA A 35 11.950 -20.182 6.105 1.00 0.00 O ATOM 531 CB ALA A 35 13.099 -17.878 6.961 1.00 0.00 C ATOM 0 H ALA A 35 13.225 -18.054 4.069 1.00 0.00 H new ATOM 0 HA ALA A 35 14.855 -18.989 6.391 1.00 0.00 H new ATOM 0 HB1 ALA A 35 12.979 -18.408 7.906 1.00 0.00 H new ATOM 0 HB2 ALA A 35 13.649 -16.952 7.131 1.00 0.00 H new ATOM 0 HB3 ALA A 35 12.117 -17.646 6.548 1.00 0.00 H new ATOM 537 N PRO A 36 13.757 -21.046 5.114 1.00 0.00 N ATOM 538 CA PRO A 36 13.140 -22.345 4.820 1.00 0.00 C ATOM 539 C PRO A 36 12.920 -23.171 6.092 1.00 0.00 C ATOM 540 O PRO A 36 11.958 -23.904 6.208 1.00 0.00 O ATOM 541 CB PRO A 36 14.166 -23.035 3.921 1.00 0.00 C ATOM 542 CG PRO A 36 15.466 -22.395 4.274 1.00 0.00 C ATOM 543 CD PRO A 36 15.151 -20.972 4.641 1.00 0.00 C ATOM 0 HA PRO A 36 12.157 -22.236 4.362 1.00 0.00 H new ATOM 0 HB2 PRO A 36 14.191 -24.110 4.101 1.00 0.00 H new ATOM 0 HB3 PRO A 36 13.928 -22.894 2.867 1.00 0.00 H new ATOM 0 HG2 PRO A 36 15.942 -22.915 5.106 1.00 0.00 H new ATOM 0 HG3 PRO A 36 16.160 -22.435 3.434 1.00 0.00 H new ATOM 0 HD2 PRO A 36 15.820 -20.599 5.416 1.00 0.00 H new ATOM 0 HD3 PRO A 36 15.251 -20.304 3.785 1.00 0.00 H new ATOM 551 N GLN A 37 13.804 -23.058 7.046 1.00 0.00 N ATOM 552 CA GLN A 37 13.641 -23.835 8.306 1.00 0.00 C ATOM 553 C GLN A 37 12.475 -23.259 9.112 1.00 0.00 C ATOM 554 O GLN A 37 11.835 -23.952 9.877 1.00 0.00 O ATOM 555 CB GLN A 37 14.926 -23.744 9.133 1.00 0.00 C ATOM 556 CG GLN A 37 16.075 -24.402 8.367 1.00 0.00 C ATOM 557 CD GLN A 37 17.381 -24.202 9.138 1.00 0.00 C ATOM 558 OE1 GLN A 37 17.470 -23.345 9.994 1.00 0.00 O ATOM 559 NE2 GLN A 37 18.406 -24.964 8.868 1.00 0.00 N ATOM 0 H GLN A 37 14.631 -22.462 7.007 1.00 0.00 H new ATOM 0 HA GLN A 37 13.437 -24.878 8.065 1.00 0.00 H new ATOM 0 HB2 GLN A 37 15.164 -22.701 9.341 1.00 0.00 H new ATOM 0 HB3 GLN A 37 14.787 -24.237 10.095 1.00 0.00 H new ATOM 0 HG2 GLN A 37 15.877 -25.466 8.236 1.00 0.00 H new ATOM 0 HG3 GLN A 37 16.158 -23.968 7.371 1.00 0.00 H new ATOM 0 HE21 GLN A 37 18.331 -25.684 8.149 1.00 0.00 H new ATOM 0 HE22 GLN A 37 19.282 -24.840 9.376 1.00 0.00 H new ATOM 568 N ALA A 38 12.194 -21.997 8.944 1.00 0.00 N ATOM 569 CA ALA A 38 11.069 -21.376 9.700 1.00 0.00 C ATOM 570 C ALA A 38 9.753 -22.037 9.288 1.00 0.00 C ATOM 571 O ALA A 38 8.954 -22.425 10.118 1.00 0.00 O ATOM 572 CB ALA A 38 11.008 -19.880 9.387 1.00 0.00 C ATOM 0 H ALA A 38 12.694 -21.368 8.316 1.00 0.00 H new ATOM 0 HA ALA A 38 11.228 -21.517 10.769 1.00 0.00 H new ATOM 0 HB1 ALA A 38 10.186 -19.426 9.940 1.00 0.00 H new ATOM 0 HB2 ALA A 38 11.946 -19.408 9.680 1.00 0.00 H new ATOM 0 HB3 ALA A 38 10.849 -19.738 8.318 1.00 0.00 H new ATOM 578 N VAL A 39 9.520 -22.170 8.010 1.00 0.00 N ATOM 579 CA VAL A 39 8.255 -22.806 7.546 1.00 0.00 C ATOM 580 C VAL A 39 8.585 -23.970 6.607 1.00 0.00 C ATOM 581 O VAL A 39 9.634 -24.007 5.994 1.00 0.00 O ATOM 582 CB VAL A 39 7.409 -21.772 6.799 1.00 0.00 C ATOM 583 CG1 VAL A 39 7.132 -20.581 7.718 1.00 0.00 C ATOM 584 CG2 VAL A 39 8.166 -21.294 5.558 1.00 0.00 C ATOM 0 H VAL A 39 10.151 -21.866 7.268 1.00 0.00 H new ATOM 0 HA VAL A 39 7.698 -23.179 8.406 1.00 0.00 H new ATOM 0 HB VAL A 39 6.465 -22.225 6.496 1.00 0.00 H new ATOM 0 HG11 VAL A 39 6.530 -19.844 7.187 1.00 0.00 H new ATOM 0 HG12 VAL A 39 6.593 -20.921 8.602 1.00 0.00 H new ATOM 0 HG13 VAL A 39 8.076 -20.128 8.021 1.00 0.00 H new ATOM 0 HG21 VAL A 39 7.564 -20.558 5.026 1.00 0.00 H new ATOM 0 HG22 VAL A 39 9.110 -20.841 5.860 1.00 0.00 H new ATOM 0 HG23 VAL A 39 8.364 -22.143 4.903 1.00 0.00 H new ATOM 594 N LYS A 40 7.698 -24.920 6.492 1.00 0.00 N ATOM 595 CA LYS A 40 7.960 -26.081 5.595 1.00 0.00 C ATOM 596 C LYS A 40 7.829 -25.636 4.136 1.00 0.00 C ATOM 597 O LYS A 40 8.644 -25.972 3.299 1.00 0.00 O ATOM 598 CB LYS A 40 6.945 -27.188 5.884 1.00 0.00 C ATOM 599 CG LYS A 40 7.293 -28.428 5.058 1.00 0.00 C ATOM 600 CD LYS A 40 6.272 -29.531 5.338 1.00 0.00 C ATOM 601 CE LYS A 40 6.696 -30.812 4.617 1.00 0.00 C ATOM 602 NZ LYS A 40 5.944 -30.933 3.336 1.00 0.00 N ATOM 0 H LYS A 40 6.803 -24.942 6.981 1.00 0.00 H new ATOM 0 HA LYS A 40 8.967 -26.458 5.772 1.00 0.00 H new ATOM 0 HB2 LYS A 40 6.950 -27.432 6.946 1.00 0.00 H new ATOM 0 HB3 LYS A 40 5.939 -26.846 5.640 1.00 0.00 H new ATOM 0 HG2 LYS A 40 7.296 -28.182 3.996 1.00 0.00 H new ATOM 0 HG3 LYS A 40 8.296 -28.774 5.308 1.00 0.00 H new ATOM 0 HD2 LYS A 40 6.200 -29.711 6.411 1.00 0.00 H new ATOM 0 HD3 LYS A 40 5.283 -29.221 5.000 1.00 0.00 H new ATOM 0 HE2 LYS A 40 7.768 -30.794 4.421 1.00 0.00 H new ATOM 0 HE3 LYS A 40 6.502 -31.679 5.249 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 6.232 -31.804 2.845 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 4.924 -30.969 3.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 6.151 -30.111 2.733 1.00 0.00 H new ATOM 616 N CYS A 41 6.808 -24.885 3.824 1.00 0.00 N ATOM 617 CA CYS A 41 6.628 -24.422 2.419 1.00 0.00 C ATOM 618 C CYS A 41 5.335 -23.609 2.310 1.00 0.00 C ATOM 619 O CYS A 41 4.284 -24.036 2.745 1.00 0.00 O ATOM 620 CB CYS A 41 6.546 -25.635 1.491 1.00 0.00 C ATOM 621 SG CYS A 41 7.499 -25.309 -0.014 1.00 0.00 S ATOM 0 H CYS A 41 6.092 -24.573 4.480 1.00 0.00 H new ATOM 0 HA CYS A 41 7.474 -23.798 2.131 1.00 0.00 H new ATOM 0 HB2 CYS A 41 6.935 -26.519 1.996 1.00 0.00 H new ATOM 0 HB3 CYS A 41 5.506 -25.843 1.238 1.00 0.00 H new ATOM 0 HG CYS A 41 7.432 -26.341 -0.802 1.00 0.00 H new ATOM 627 N ALA A 42 5.406 -22.441 1.732 1.00 0.00 N ATOM 628 CA ALA A 42 4.181 -21.603 1.594 1.00 0.00 C ATOM 629 C ALA A 42 3.448 -21.982 0.306 1.00 0.00 C ATOM 630 O ALA A 42 4.018 -21.983 -0.767 1.00 0.00 O ATOM 631 CB ALA A 42 4.577 -20.125 1.541 1.00 0.00 C ATOM 0 H ALA A 42 6.258 -22.031 1.350 1.00 0.00 H new ATOM 0 HA ALA A 42 3.526 -21.772 2.448 1.00 0.00 H new ATOM 0 HB1 ALA A 42 3.682 -19.512 1.440 1.00 0.00 H new ATOM 0 HB2 ALA A 42 5.100 -19.855 2.459 1.00 0.00 H new ATOM 0 HB3 ALA A 42 5.232 -19.954 0.687 1.00 0.00 H new ATOM 637 N GLU A 43 2.187 -22.306 0.402 1.00 0.00 N ATOM 638 CA GLU A 43 1.421 -22.685 -0.818 1.00 0.00 C ATOM 639 C GLU A 43 0.212 -21.759 -0.972 1.00 0.00 C ATOM 640 O GLU A 43 -0.333 -21.268 -0.003 1.00 0.00 O ATOM 641 CB GLU A 43 0.941 -24.132 -0.691 1.00 0.00 C ATOM 642 CG GLU A 43 2.149 -25.059 -0.532 1.00 0.00 C ATOM 643 CD GLU A 43 1.676 -26.513 -0.496 1.00 0.00 C ATOM 644 OE1 GLU A 43 0.476 -26.723 -0.416 1.00 0.00 O ATOM 645 OE2 GLU A 43 2.520 -27.391 -0.549 1.00 0.00 O ATOM 0 H GLU A 43 1.655 -22.324 1.272 1.00 0.00 H new ATOM 0 HA GLU A 43 2.064 -22.591 -1.693 1.00 0.00 H new ATOM 0 HB2 GLU A 43 0.277 -24.232 0.168 1.00 0.00 H new ATOM 0 HB3 GLU A 43 0.366 -24.414 -1.573 1.00 0.00 H new ATOM 0 HG2 GLU A 43 2.845 -24.912 -1.358 1.00 0.00 H new ATOM 0 HG3 GLU A 43 2.687 -24.818 0.385 1.00 0.00 H new ATOM 652 N ILE A 44 -0.212 -21.518 -2.183 1.00 0.00 N ATOM 653 CA ILE A 44 -1.385 -20.626 -2.398 1.00 0.00 C ATOM 654 C ILE A 44 -2.599 -21.468 -2.794 1.00 0.00 C ATOM 655 O ILE A 44 -2.577 -22.181 -3.778 1.00 0.00 O ATOM 656 CB ILE A 44 -1.071 -19.628 -3.515 1.00 0.00 C ATOM 657 CG1 ILE A 44 0.215 -18.871 -3.177 1.00 0.00 C ATOM 658 CG2 ILE A 44 -2.226 -18.635 -3.651 1.00 0.00 C ATOM 659 CD1 ILE A 44 0.599 -17.969 -4.352 1.00 0.00 C ATOM 0 H ILE A 44 0.204 -21.901 -3.032 1.00 0.00 H new ATOM 0 HA ILE A 44 -1.602 -20.084 -1.478 1.00 0.00 H new ATOM 0 HB ILE A 44 -0.940 -20.164 -4.455 1.00 0.00 H new ATOM 0 HG12 ILE A 44 0.072 -18.273 -2.277 1.00 0.00 H new ATOM 0 HG13 ILE A 44 1.020 -19.575 -2.967 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -2.003 -17.924 -4.446 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -3.142 -19.174 -3.892 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -2.357 -18.099 -2.711 1.00 0.00 H new ATOM 0 HD11 ILE A 44 1.515 -17.429 -4.112 1.00 0.00 H new ATOM 0 HD12 ILE A 44 0.759 -18.578 -5.241 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -0.203 -17.256 -4.541 1.00 0.00 H new ATOM 671 N LEU A 45 -3.658 -21.393 -2.037 1.00 0.00 N ATOM 672 CA LEU A 45 -4.871 -22.190 -2.372 1.00 0.00 C ATOM 673 C LEU A 45 -5.460 -21.689 -3.692 1.00 0.00 C ATOM 674 O LEU A 45 -5.837 -22.464 -4.548 1.00 0.00 O ATOM 675 CB LEU A 45 -5.908 -22.034 -1.257 1.00 0.00 C ATOM 676 CG LEU A 45 -5.420 -22.761 -0.002 1.00 0.00 C ATOM 677 CD1 LEU A 45 -4.369 -21.903 0.707 1.00 0.00 C ATOM 678 CD2 LEU A 45 -6.601 -23.000 0.940 1.00 0.00 C ATOM 0 H LEU A 45 -3.736 -20.814 -1.201 1.00 0.00 H new ATOM 0 HA LEU A 45 -4.600 -23.241 -2.471 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -6.068 -20.978 -1.040 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -6.867 -22.442 -1.577 1.00 0.00 H new ATOM 0 HG LEU A 45 -4.980 -23.718 -0.284 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -4.020 -22.420 1.601 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -3.527 -21.731 0.036 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -4.810 -20.947 0.989 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -6.254 -23.518 1.834 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -7.041 -22.043 1.222 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -7.351 -23.609 0.436 1.00 0.00 H new ATOM 690 N GLU A 46 -5.542 -20.398 -3.863 1.00 0.00 N ATOM 691 CA GLU A 46 -6.106 -19.846 -5.128 1.00 0.00 C ATOM 692 C GLU A 46 -5.635 -18.402 -5.311 1.00 0.00 C ATOM 693 O GLU A 46 -5.312 -17.719 -4.360 1.00 0.00 O ATOM 694 CB GLU A 46 -7.634 -19.880 -5.062 1.00 0.00 C ATOM 695 CG GLU A 46 -8.110 -21.330 -4.955 1.00 0.00 C ATOM 696 CD GLU A 46 -9.635 -21.376 -5.068 1.00 0.00 C ATOM 697 OE1 GLU A 46 -10.241 -20.318 -5.080 1.00 0.00 O ATOM 698 OE2 GLU A 46 -10.171 -22.470 -5.139 1.00 0.00 O ATOM 0 H GLU A 46 -5.243 -19.701 -3.181 1.00 0.00 H new ATOM 0 HA GLU A 46 -5.765 -20.448 -5.970 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -7.984 -19.307 -4.203 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -8.057 -19.412 -5.951 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -7.658 -21.931 -5.744 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -7.792 -21.759 -4.005 1.00 0.00 H new ATOM 705 N GLY A 47 -5.594 -17.932 -6.528 1.00 0.00 N ATOM 706 CA GLY A 47 -5.145 -16.532 -6.771 1.00 0.00 C ATOM 707 C GLY A 47 -3.716 -16.542 -7.316 1.00 0.00 C ATOM 708 O GLY A 47 -3.379 -15.797 -8.215 1.00 0.00 O ATOM 0 H GLY A 47 -5.852 -18.457 -7.364 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -5.813 -16.043 -7.480 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -5.188 -15.959 -5.845 1.00 0.00 H new ATOM 712 N ASP A 48 -2.874 -17.383 -6.780 1.00 0.00 N ATOM 713 CA ASP A 48 -1.467 -17.442 -7.270 1.00 0.00 C ATOM 714 C ASP A 48 -0.798 -16.083 -7.064 1.00 0.00 C ATOM 715 O ASP A 48 -0.057 -15.611 -7.904 1.00 0.00 O ATOM 716 CB ASP A 48 -1.458 -17.795 -8.758 1.00 0.00 C ATOM 717 CG ASP A 48 -1.977 -19.223 -8.946 1.00 0.00 C ATOM 718 OD1 ASP A 48 -2.090 -19.926 -7.956 1.00 0.00 O ATOM 719 OD2 ASP A 48 -2.253 -19.588 -10.078 1.00 0.00 O ATOM 0 H ASP A 48 -3.099 -18.031 -6.025 1.00 0.00 H new ATOM 0 HA ASP A 48 -0.921 -18.204 -6.714 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -2.081 -17.094 -9.313 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -0.448 -17.708 -9.157 1.00 0.00 H new ATOM 724 N GLY A 49 -1.051 -15.449 -5.951 1.00 0.00 N ATOM 725 CA GLY A 49 -0.427 -14.121 -5.692 1.00 0.00 C ATOM 726 C GLY A 49 -1.272 -13.024 -6.344 1.00 0.00 C ATOM 727 O GLY A 49 -0.754 -12.044 -6.844 1.00 0.00 O ATOM 0 H GLY A 49 -1.662 -15.793 -5.211 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -0.351 -13.946 -4.619 1.00 0.00 H new ATOM 0 HA3 GLY A 49 0.587 -14.100 -6.091 1.00 0.00 H new ATOM 731 N GLY A 50 -2.567 -13.179 -6.344 1.00 0.00 N ATOM 732 CA GLY A 50 -3.441 -12.144 -6.964 1.00 0.00 C ATOM 733 C GLY A 50 -4.409 -11.597 -5.912 1.00 0.00 C ATOM 734 O GLY A 50 -4.245 -11.820 -4.730 1.00 0.00 O ATOM 0 H GLY A 50 -3.058 -13.977 -5.942 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -2.833 -11.335 -7.370 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -3.997 -12.574 -7.797 1.00 0.00 H new ATOM 738 N PRO A 51 -5.440 -10.864 -6.359 1.00 0.00 N ATOM 739 CA PRO A 51 -6.445 -10.278 -5.462 1.00 0.00 C ATOM 740 C PRO A 51 -7.338 -11.351 -4.834 1.00 0.00 C ATOM 741 O PRO A 51 -7.899 -12.184 -5.517 1.00 0.00 O ATOM 742 CB PRO A 51 -7.271 -9.385 -6.387 1.00 0.00 C ATOM 743 CG PRO A 51 -7.098 -9.983 -7.742 1.00 0.00 C ATOM 744 CD PRO A 51 -5.707 -10.551 -7.773 1.00 0.00 C ATOM 0 HA PRO A 51 -5.990 -9.744 -4.628 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -8.320 -9.371 -6.091 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -6.918 -8.354 -6.361 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -7.840 -10.760 -7.922 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -7.229 -9.230 -8.520 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -5.649 -11.441 -8.400 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -4.988 -9.834 -8.169 1.00 0.00 H new ATOM 752 N GLY A 52 -7.471 -11.338 -3.535 1.00 0.00 N ATOM 753 CA GLY A 52 -8.326 -12.359 -2.865 1.00 0.00 C ATOM 754 C GLY A 52 -7.616 -13.714 -2.897 1.00 0.00 C ATOM 755 O GLY A 52 -8.240 -14.755 -2.836 1.00 0.00 O ATOM 0 H GLY A 52 -7.026 -10.666 -2.910 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -8.525 -12.064 -1.835 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -9.290 -12.429 -3.368 1.00 0.00 H new ATOM 759 N THR A 53 -6.314 -13.708 -2.996 1.00 0.00 N ATOM 760 CA THR A 53 -5.565 -14.995 -3.034 1.00 0.00 C ATOM 761 C THR A 53 -5.392 -15.530 -1.611 1.00 0.00 C ATOM 762 O THR A 53 -5.195 -14.780 -0.675 1.00 0.00 O ATOM 763 CB THR A 53 -4.187 -14.764 -3.660 1.00 0.00 C ATOM 764 OG1 THR A 53 -4.347 -14.251 -4.976 1.00 0.00 O ATOM 765 CG2 THR A 53 -3.420 -16.086 -3.716 1.00 0.00 C ATOM 0 H THR A 53 -5.738 -12.868 -3.052 1.00 0.00 H new ATOM 0 HA THR A 53 -6.121 -15.719 -3.629 1.00 0.00 H new ATOM 0 HB THR A 53 -3.629 -14.049 -3.055 1.00 0.00 H new ATOM 0 HG1 THR A 53 -5.302 -14.165 -5.180 1.00 0.00 H new ATOM 0 HG21 THR A 53 -2.439 -15.919 -4.162 1.00 0.00 H new ATOM 0 HG22 THR A 53 -3.297 -16.479 -2.707 1.00 0.00 H new ATOM 0 HG23 THR A 53 -3.976 -16.804 -4.319 1.00 0.00 H new ATOM 773 N ILE A 54 -5.462 -16.822 -1.440 1.00 0.00 N ATOM 774 CA ILE A 54 -5.299 -17.404 -0.077 1.00 0.00 C ATOM 775 C ILE A 54 -3.969 -18.157 -0.004 1.00 0.00 C ATOM 776 O ILE A 54 -3.644 -18.948 -0.867 1.00 0.00 O ATOM 777 CB ILE A 54 -6.449 -18.371 0.207 1.00 0.00 C ATOM 778 CG1 ILE A 54 -7.784 -17.648 0.017 1.00 0.00 C ATOM 779 CG2 ILE A 54 -6.344 -18.877 1.648 1.00 0.00 C ATOM 780 CD1 ILE A 54 -8.933 -18.643 0.197 1.00 0.00 C ATOM 0 H ILE A 54 -5.625 -17.500 -2.185 1.00 0.00 H new ATOM 0 HA ILE A 54 -5.308 -16.605 0.664 1.00 0.00 H new ATOM 0 HB ILE A 54 -6.392 -19.215 -0.481 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -7.876 -16.836 0.738 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -7.829 -17.200 -0.976 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -7.163 -19.567 1.852 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -5.393 -19.392 1.784 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -6.401 -18.033 2.335 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -9.884 -18.129 0.062 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -8.843 -19.440 -0.541 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -8.891 -19.070 1.199 1.00 0.00 H new ATOM 792 N LYS A 55 -3.195 -17.916 1.019 1.00 0.00 N ATOM 793 CA LYS A 55 -1.887 -18.619 1.143 1.00 0.00 C ATOM 794 C LYS A 55 -1.893 -19.502 2.392 1.00 0.00 C ATOM 795 O LYS A 55 -2.552 -19.210 3.370 1.00 0.00 O ATOM 796 CB LYS A 55 -0.763 -17.586 1.257 1.00 0.00 C ATOM 797 CG LYS A 55 -0.769 -16.684 0.022 1.00 0.00 C ATOM 798 CD LYS A 55 0.425 -15.730 0.084 1.00 0.00 C ATOM 799 CE LYS A 55 0.392 -14.791 -1.124 1.00 0.00 C ATOM 800 NZ LYS A 55 1.786 -14.502 -1.566 1.00 0.00 N ATOM 0 H LYS A 55 -3.412 -17.264 1.773 1.00 0.00 H new ATOM 0 HA LYS A 55 -1.726 -19.240 0.262 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -0.896 -16.987 2.158 1.00 0.00 H new ATOM 0 HB3 LYS A 55 0.200 -18.089 1.348 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -0.719 -17.288 -0.884 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -1.699 -16.118 -0.024 1.00 0.00 H new ATOM 0 HD2 LYS A 55 0.395 -15.152 1.008 1.00 0.00 H new ATOM 0 HD3 LYS A 55 1.356 -16.296 0.092 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -0.172 -15.247 -1.938 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -0.118 -13.864 -0.864 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 1.764 -13.905 -2.417 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 2.295 -14.004 -0.808 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 2.274 -15.395 -1.782 1.00 0.00 H new ATOM 814 N LYS A 56 -1.159 -20.581 2.367 1.00 0.00 N ATOM 815 CA LYS A 56 -1.117 -21.484 3.552 1.00 0.00 C ATOM 816 C LYS A 56 0.342 -21.770 3.915 1.00 0.00 C ATOM 817 O LYS A 56 1.122 -22.206 3.091 1.00 0.00 O ATOM 818 CB LYS A 56 -1.828 -22.798 3.221 1.00 0.00 C ATOM 819 CG LYS A 56 -1.909 -23.664 4.481 1.00 0.00 C ATOM 820 CD LYS A 56 -2.527 -25.018 4.130 1.00 0.00 C ATOM 821 CE LYS A 56 -2.744 -25.826 5.411 1.00 0.00 C ATOM 822 NZ LYS A 56 -1.703 -26.887 5.512 1.00 0.00 N ATOM 0 H LYS A 56 -0.586 -20.876 1.576 1.00 0.00 H new ATOM 0 HA LYS A 56 -1.618 -21.006 4.394 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -2.829 -22.597 2.840 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -1.289 -23.328 2.436 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -0.914 -23.805 4.903 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -2.510 -23.164 5.241 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -3.476 -24.874 3.613 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -1.873 -25.563 3.450 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -2.695 -25.170 6.280 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -3.737 -26.275 5.406 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -1.850 -27.436 6.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -1.770 -27.519 4.689 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -0.761 -26.448 5.535 1.00 0.00 H new ATOM 836 N ILE A 57 0.718 -21.528 5.141 1.00 0.00 N ATOM 837 CA ILE A 57 2.127 -21.785 5.550 1.00 0.00 C ATOM 838 C ILE A 57 2.157 -22.861 6.637 1.00 0.00 C ATOM 839 O ILE A 57 1.357 -22.860 7.550 1.00 0.00 O ATOM 840 CB ILE A 57 2.741 -20.494 6.096 1.00 0.00 C ATOM 841 CG1 ILE A 57 2.569 -19.373 5.070 1.00 0.00 C ATOM 842 CG2 ILE A 57 4.231 -20.713 6.368 1.00 0.00 C ATOM 843 CD1 ILE A 57 2.729 -18.017 5.761 1.00 0.00 C ATOM 0 H ILE A 57 0.111 -21.164 5.876 1.00 0.00 H new ATOM 0 HA ILE A 57 2.699 -22.126 4.687 1.00 0.00 H new ATOM 0 HB ILE A 57 2.239 -20.217 7.023 1.00 0.00 H new ATOM 0 HG12 ILE A 57 3.308 -19.477 4.275 1.00 0.00 H new ATOM 0 HG13 ILE A 57 1.586 -19.441 4.603 1.00 0.00 H new ATOM 0 HG21 ILE A 57 4.669 -19.794 6.757 1.00 0.00 H new ATOM 0 HG22 ILE A 57 4.354 -21.511 7.100 1.00 0.00 H new ATOM 0 HG23 ILE A 57 4.733 -20.990 5.441 1.00 0.00 H new ATOM 0 HD11 ILE A 57 2.606 -17.219 5.029 1.00 0.00 H new ATOM 0 HD12 ILE A 57 1.974 -17.914 6.540 1.00 0.00 H new ATOM 0 HD13 ILE A 57 3.721 -17.951 6.207 1.00 0.00 H new ATOM 855 N THR A 58 3.080 -23.780 6.545 1.00 0.00 N ATOM 856 CA THR A 58 3.168 -24.855 7.572 1.00 0.00 C ATOM 857 C THR A 58 4.481 -24.709 8.343 1.00 0.00 C ATOM 858 O THR A 58 5.534 -24.532 7.765 1.00 0.00 O ATOM 859 CB THR A 58 3.126 -26.222 6.887 1.00 0.00 C ATOM 860 OG1 THR A 58 1.961 -26.309 6.077 1.00 0.00 O ATOM 861 CG2 THR A 58 3.096 -27.326 7.945 1.00 0.00 C ATOM 0 H THR A 58 3.777 -23.832 5.802 1.00 0.00 H new ATOM 0 HA THR A 58 2.328 -24.772 8.261 1.00 0.00 H new ATOM 0 HB THR A 58 4.013 -26.343 6.265 1.00 0.00 H new ATOM 0 HG1 THR A 58 1.934 -27.184 5.636 1.00 0.00 H new ATOM 0 HG21 THR A 58 3.066 -28.299 7.455 1.00 0.00 H new ATOM 0 HG22 THR A 58 3.990 -27.260 8.566 1.00 0.00 H new ATOM 0 HG23 THR A 58 2.211 -27.207 8.570 1.00 0.00 H new ATOM 869 N PHE A 59 4.429 -24.781 9.645 1.00 0.00 N ATOM 870 CA PHE A 59 5.677 -24.643 10.447 1.00 0.00 C ATOM 871 C PHE A 59 6.127 -26.022 10.939 1.00 0.00 C ATOM 872 O PHE A 59 5.352 -26.776 11.494 1.00 0.00 O ATOM 873 CB PHE A 59 5.414 -23.734 11.648 1.00 0.00 C ATOM 874 CG PHE A 59 5.189 -22.319 11.170 1.00 0.00 C ATOM 875 CD1 PHE A 59 6.278 -21.451 11.019 1.00 0.00 C ATOM 876 CD2 PHE A 59 3.894 -21.876 10.875 1.00 0.00 C ATOM 877 CE1 PHE A 59 6.071 -20.139 10.575 1.00 0.00 C ATOM 878 CE2 PHE A 59 3.688 -20.564 10.431 1.00 0.00 C ATOM 879 CZ PHE A 59 4.776 -19.695 10.281 1.00 0.00 C ATOM 0 H PHE A 59 3.578 -24.929 10.187 1.00 0.00 H new ATOM 0 HA PHE A 59 6.460 -24.207 9.826 1.00 0.00 H new ATOM 0 HB2 PHE A 59 4.542 -24.086 12.200 1.00 0.00 H new ATOM 0 HB3 PHE A 59 6.260 -23.767 12.335 1.00 0.00 H new ATOM 0 HD1 PHE A 59 7.277 -21.793 11.245 1.00 0.00 H new ATOM 0 HD2 PHE A 59 3.055 -22.546 10.990 1.00 0.00 H new ATOM 0 HE1 PHE A 59 6.910 -19.469 10.459 1.00 0.00 H new ATOM 0 HE2 PHE A 59 2.689 -20.222 10.204 1.00 0.00 H new ATOM 0 HZ PHE A 59 4.616 -18.683 9.939 1.00 0.00 H new ATOM 974 N TYR A 67 0.382 -23.708 11.948 1.00 0.00 N ATOM 975 CA TYR A 67 0.397 -23.233 10.535 1.00 0.00 C ATOM 976 C TYR A 67 -0.422 -21.945 10.423 1.00 0.00 C ATOM 977 O TYR A 67 -1.400 -21.758 11.119 1.00 0.00 O ATOM 978 CB TYR A 67 -0.214 -24.306 9.631 1.00 0.00 C ATOM 979 CG TYR A 67 -1.696 -24.401 9.897 1.00 0.00 C ATOM 980 CD1 TYR A 67 -2.174 -25.238 10.913 1.00 0.00 C ATOM 981 CD2 TYR A 67 -2.594 -23.651 9.129 1.00 0.00 C ATOM 982 CE1 TYR A 67 -3.548 -25.324 11.160 1.00 0.00 C ATOM 983 CE2 TYR A 67 -3.970 -23.738 9.377 1.00 0.00 C ATOM 984 CZ TYR A 67 -4.446 -24.574 10.392 1.00 0.00 C ATOM 985 OH TYR A 67 -5.801 -24.659 10.637 1.00 0.00 O ATOM 0 HA TYR A 67 1.424 -23.039 10.226 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -0.036 -24.060 8.584 1.00 0.00 H new ATOM 0 HB3 TYR A 67 0.262 -25.268 9.817 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -1.482 -25.817 11.506 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -2.226 -23.005 8.345 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -3.916 -25.969 11.944 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -4.663 -23.159 8.784 1.00 0.00 H new ATOM 0 HH TYR A 67 -6.283 -24.074 10.016 1.00 0.00 H new ATOM 995 N VAL A 68 -0.030 -21.056 9.552 1.00 0.00 N ATOM 996 CA VAL A 68 -0.789 -19.782 9.398 1.00 0.00 C ATOM 997 C VAL A 68 -1.098 -19.545 7.919 1.00 0.00 C ATOM 998 O VAL A 68 -0.385 -19.997 7.046 1.00 0.00 O ATOM 999 CB VAL A 68 0.051 -18.622 9.938 1.00 0.00 C ATOM 1000 CG1 VAL A 68 0.525 -18.951 11.354 1.00 0.00 C ATOM 1001 CG2 VAL A 68 1.264 -18.405 9.032 1.00 0.00 C ATOM 0 H VAL A 68 0.781 -21.156 8.942 1.00 0.00 H new ATOM 0 HA VAL A 68 -1.723 -19.846 9.956 1.00 0.00 H new ATOM 0 HB VAL A 68 -0.554 -17.715 9.959 1.00 0.00 H new ATOM 0 HG11 VAL A 68 1.123 -18.125 11.739 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -0.339 -19.105 12.000 1.00 0.00 H new ATOM 0 HG13 VAL A 68 1.129 -19.858 11.334 1.00 0.00 H new ATOM 0 HG21 VAL A 68 1.862 -17.579 9.417 1.00 0.00 H new ATOM 0 HG22 VAL A 68 1.869 -19.312 9.010 1.00 0.00 H new ATOM 0 HG23 VAL A 68 0.927 -18.170 8.023 1.00 0.00 H new ATOM 1011 N LYS A 69 -2.158 -18.841 7.632 1.00 0.00 N ATOM 1012 CA LYS A 69 -2.514 -18.577 6.210 1.00 0.00 C ATOM 1013 C LYS A 69 -2.514 -17.069 5.952 1.00 0.00 C ATOM 1014 O LYS A 69 -2.833 -16.280 6.819 1.00 0.00 O ATOM 1015 CB LYS A 69 -3.906 -19.143 5.921 1.00 0.00 C ATOM 1016 CG LYS A 69 -3.894 -20.658 6.135 1.00 0.00 C ATOM 1017 CD LYS A 69 -5.255 -21.239 5.748 1.00 0.00 C ATOM 1018 CE LYS A 69 -5.269 -22.742 6.036 1.00 0.00 C ATOM 1019 NZ LYS A 69 -6.358 -23.388 5.249 1.00 0.00 N ATOM 0 H LYS A 69 -2.793 -18.437 8.321 1.00 0.00 H new ATOM 0 HA LYS A 69 -1.783 -19.055 5.559 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -4.643 -18.678 6.576 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -4.199 -18.912 4.897 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -3.108 -21.115 5.534 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -3.672 -20.887 7.177 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -6.047 -20.743 6.309 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -5.452 -21.059 4.691 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -4.307 -23.182 5.775 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -5.422 -22.918 7.101 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -6.368 -24.409 5.444 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -7.273 -22.975 5.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -6.193 -23.231 4.234 1.00 0.00 H new ATOM 1033 N HIS A 70 -2.161 -16.664 4.762 1.00 0.00 N ATOM 1034 CA HIS A 70 -2.141 -15.207 4.445 1.00 0.00 C ATOM 1035 C HIS A 70 -3.179 -14.913 3.360 1.00 0.00 C ATOM 1036 O HIS A 70 -3.693 -15.810 2.721 1.00 0.00 O ATOM 1037 CB HIS A 70 -0.751 -14.812 3.943 1.00 0.00 C ATOM 1038 CG HIS A 70 0.198 -14.732 5.105 1.00 0.00 C ATOM 1039 ND1 HIS A 70 0.775 -15.860 5.667 1.00 0.00 N ATOM 1040 CD2 HIS A 70 0.685 -13.666 5.822 1.00 0.00 C ATOM 1041 CE1 HIS A 70 1.567 -15.452 6.674 1.00 0.00 C ATOM 1042 NE2 HIS A 70 1.548 -14.124 6.813 1.00 0.00 N ATOM 0 H HIS A 70 -1.886 -17.279 3.996 1.00 0.00 H new ATOM 0 HA HIS A 70 -2.377 -14.634 5.342 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -0.394 -15.543 3.218 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -0.797 -13.851 3.431 1.00 0.00 H new ATOM 0 HD2 HIS A 70 0.436 -12.630 5.644 1.00 0.00 H new ATOM 0 HE1 HIS A 70 2.148 -16.118 7.295 1.00 0.00 H new ATOM 0 HE2 HIS A 70 2.057 -13.565 7.498 1.00 0.00 H new ATOM 1050 N LYS A 71 -3.493 -13.665 3.145 1.00 0.00 N ATOM 1051 CA LYS A 71 -4.499 -13.321 2.100 1.00 0.00 C ATOM 1052 C LYS A 71 -4.093 -12.018 1.411 1.00 0.00 C ATOM 1053 O LYS A 71 -3.621 -11.093 2.039 1.00 0.00 O ATOM 1054 CB LYS A 71 -5.873 -13.148 2.752 1.00 0.00 C ATOM 1055 CG LYS A 71 -6.928 -12.929 1.665 1.00 0.00 C ATOM 1056 CD LYS A 71 -8.284 -12.654 2.317 1.00 0.00 C ATOM 1057 CE LYS A 71 -9.371 -12.633 1.242 1.00 0.00 C ATOM 1058 NZ LYS A 71 -9.750 -14.031 0.891 1.00 0.00 N ATOM 0 H LYS A 71 -3.097 -12.870 3.647 1.00 0.00 H new ATOM 0 HA LYS A 71 -4.546 -14.122 1.362 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -6.121 -14.030 3.343 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -5.859 -12.300 3.436 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -6.642 -12.091 1.029 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -6.993 -13.808 1.024 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -8.505 -13.422 3.058 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -8.260 -11.700 2.844 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -10.243 -12.088 1.603 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -9.011 -12.109 0.356 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -9.943 -14.093 -0.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -8.970 -14.674 1.135 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -10.602 -14.303 1.422 1.00 0.00 H new ATOM 1072 N ILE A 72 -4.275 -11.937 0.122 1.00 0.00 N ATOM 1073 CA ILE A 72 -3.898 -10.693 -0.605 1.00 0.00 C ATOM 1074 C ILE A 72 -5.162 -9.909 -0.960 1.00 0.00 C ATOM 1075 O ILE A 72 -6.088 -10.437 -1.546 1.00 0.00 O ATOM 1076 CB ILE A 72 -3.144 -11.060 -1.883 1.00 0.00 C ATOM 1077 CG1 ILE A 72 -1.971 -11.978 -1.535 1.00 0.00 C ATOM 1078 CG2 ILE A 72 -2.617 -9.787 -2.549 1.00 0.00 C ATOM 1079 CD1 ILE A 72 -1.266 -12.416 -2.821 1.00 0.00 C ATOM 0 H ILE A 72 -4.668 -12.678 -0.459 1.00 0.00 H new ATOM 0 HA ILE A 72 -3.258 -10.079 0.028 1.00 0.00 H new ATOM 0 HB ILE A 72 -3.818 -11.574 -2.568 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -1.270 -11.458 -0.882 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -2.328 -12.851 -0.988 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -2.079 -10.049 -3.460 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -3.453 -9.133 -2.796 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -1.943 -9.271 -1.865 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -0.430 -13.070 -2.573 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -1.970 -12.952 -3.457 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -0.895 -11.538 -3.350 1.00 0.00 H new ATOM 1091 N HIS A 73 -5.212 -8.653 -0.609 1.00 0.00 N ATOM 1092 CA HIS A 73 -6.418 -7.840 -0.927 1.00 0.00 C ATOM 1093 C HIS A 73 -6.257 -7.210 -2.311 1.00 0.00 C ATOM 1094 O HIS A 73 -7.221 -6.979 -3.013 1.00 0.00 O ATOM 1095 CB HIS A 73 -6.580 -6.736 0.122 1.00 0.00 C ATOM 1096 CG HIS A 73 -6.763 -7.357 1.479 1.00 0.00 C ATOM 1097 ND1 HIS A 73 -7.946 -7.974 1.856 1.00 0.00 N ATOM 1098 CD2 HIS A 73 -5.923 -7.465 2.559 1.00 0.00 C ATOM 1099 CE1 HIS A 73 -7.787 -8.421 3.115 1.00 0.00 C ATOM 1100 NE2 HIS A 73 -6.572 -8.136 3.592 1.00 0.00 N ATOM 0 H HIS A 73 -4.470 -8.156 -0.116 1.00 0.00 H new ATOM 0 HA HIS A 73 -7.301 -8.480 -0.920 1.00 0.00 H new ATOM 0 HB2 HIS A 73 -5.703 -6.088 0.122 1.00 0.00 H new ATOM 0 HB3 HIS A 73 -7.439 -6.111 -0.122 1.00 0.00 H new ATOM 0 HD1 HIS A 73 -8.784 -8.071 1.283 1.00 0.00 H new ATOM 0 HD2 HIS A 73 -4.912 -7.087 2.601 1.00 0.00 H new ATOM 0 HE1 HIS A 73 -8.549 -8.946 3.672 1.00 0.00 H new ATOM 1108 N SER A 74 -5.046 -6.932 -2.712 1.00 0.00 N ATOM 1109 CA SER A 74 -4.829 -6.319 -4.052 1.00 0.00 C ATOM 1110 C SER A 74 -3.338 -6.050 -4.263 1.00 0.00 C ATOM 1111 O SER A 74 -2.587 -5.877 -3.323 1.00 0.00 O ATOM 1112 CB SER A 74 -5.599 -4.999 -4.141 1.00 0.00 C ATOM 1113 OG SER A 74 -5.055 -4.071 -3.214 1.00 0.00 O ATOM 0 H SER A 74 -4.199 -7.103 -2.170 1.00 0.00 H new ATOM 0 HA SER A 74 -5.185 -7.004 -4.821 1.00 0.00 H new ATOM 0 HB2 SER A 74 -5.538 -4.597 -5.152 1.00 0.00 H new ATOM 0 HB3 SER A 74 -6.655 -5.166 -3.928 1.00 0.00 H new ATOM 0 HG SER A 74 -5.546 -3.225 -3.272 1.00 0.00 H new ATOM 1119 N ILE A 75 -2.905 -6.010 -5.494 1.00 0.00 N ATOM 1120 CA ILE A 75 -1.465 -5.749 -5.774 1.00 0.00 C ATOM 1121 C ILE A 75 -1.352 -4.726 -6.906 1.00 0.00 C ATOM 1122 O ILE A 75 -2.092 -4.768 -7.867 1.00 0.00 O ATOM 1123 CB ILE A 75 -0.779 -7.050 -6.193 1.00 0.00 C ATOM 1124 CG1 ILE A 75 -1.344 -7.516 -7.537 1.00 0.00 C ATOM 1125 CG2 ILE A 75 -1.031 -8.126 -5.134 1.00 0.00 C ATOM 1126 CD1 ILE A 75 -0.508 -8.683 -8.065 1.00 0.00 C ATOM 0 H ILE A 75 -3.488 -6.147 -6.319 1.00 0.00 H new ATOM 0 HA ILE A 75 -0.983 -5.361 -4.877 1.00 0.00 H new ATOM 0 HB ILE A 75 0.293 -6.879 -6.289 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -2.383 -7.823 -7.420 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -1.333 -6.694 -8.253 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -0.542 -9.053 -5.433 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -0.628 -7.796 -4.177 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -2.103 -8.297 -5.037 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -0.910 -9.015 -9.022 1.00 0.00 H new ATOM 0 HD12 ILE A 75 0.525 -8.360 -8.198 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -0.542 -9.507 -7.352 1.00 0.00 H new ATOM 1138 N ASP A 76 -0.433 -3.806 -6.800 1.00 0.00 N ATOM 1139 CA ASP A 76 -0.282 -2.783 -7.873 1.00 0.00 C ATOM 1140 C ASP A 76 1.144 -2.825 -8.424 1.00 0.00 C ATOM 1141 O ASP A 76 2.038 -2.183 -7.908 1.00 0.00 O ATOM 1142 CB ASP A 76 -0.566 -1.395 -7.297 1.00 0.00 C ATOM 1143 CG ASP A 76 -2.028 -1.317 -6.853 1.00 0.00 C ATOM 1144 OD1 ASP A 76 -2.787 -2.197 -7.222 1.00 0.00 O ATOM 1145 OD2 ASP A 76 -2.364 -0.376 -6.151 1.00 0.00 O ATOM 0 H ASP A 76 0.218 -3.718 -6.020 1.00 0.00 H new ATOM 0 HA ASP A 76 -0.987 -2.994 -8.677 1.00 0.00 H new ATOM 0 HB2 ASP A 76 0.093 -1.199 -6.451 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -0.361 -0.630 -8.046 1.00 0.00 H new ATOM 1150 N LYS A 77 1.364 -3.571 -9.472 1.00 0.00 N ATOM 1151 CA LYS A 77 2.732 -3.648 -10.056 1.00 0.00 C ATOM 1152 C LYS A 77 3.141 -2.266 -10.567 1.00 0.00 C ATOM 1153 O LYS A 77 4.282 -1.863 -10.453 1.00 0.00 O ATOM 1154 CB LYS A 77 2.737 -4.645 -11.216 1.00 0.00 C ATOM 1155 CG LYS A 77 2.486 -6.056 -10.681 1.00 0.00 C ATOM 1156 CD LYS A 77 2.651 -7.068 -11.817 1.00 0.00 C ATOM 1157 CE LYS A 77 2.246 -8.460 -11.324 1.00 0.00 C ATOM 1158 NZ LYS A 77 1.919 -9.324 -12.493 1.00 0.00 N ATOM 0 H LYS A 77 0.656 -4.130 -9.948 1.00 0.00 H new ATOM 0 HA LYS A 77 3.437 -3.979 -9.293 1.00 0.00 H new ATOM 0 HB2 LYS A 77 1.968 -4.378 -11.941 1.00 0.00 H new ATOM 0 HB3 LYS A 77 3.694 -4.608 -11.737 1.00 0.00 H new ATOM 0 HG2 LYS A 77 3.185 -6.281 -9.875 1.00 0.00 H new ATOM 0 HG3 LYS A 77 1.482 -6.124 -10.261 1.00 0.00 H new ATOM 0 HD2 LYS A 77 2.035 -6.779 -12.668 1.00 0.00 H new ATOM 0 HD3 LYS A 77 3.685 -7.079 -12.161 1.00 0.00 H new ATOM 0 HE2 LYS A 77 3.057 -8.903 -10.746 1.00 0.00 H new ATOM 0 HE3 LYS A 77 1.385 -8.386 -10.660 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 1.644 -10.270 -12.159 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 1.132 -8.903 -13.027 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 2.753 -9.404 -13.110 1.00 0.00 H new ATOM 1172 N VAL A 78 2.218 -1.536 -11.131 1.00 0.00 N ATOM 1173 CA VAL A 78 2.552 -0.180 -11.649 1.00 0.00 C ATOM 1174 C VAL A 78 2.820 0.760 -10.472 1.00 0.00 C ATOM 1175 O VAL A 78 3.729 1.565 -10.503 1.00 0.00 O ATOM 1176 CB VAL A 78 1.378 0.355 -12.473 1.00 0.00 C ATOM 1177 CG1 VAL A 78 1.632 1.819 -12.831 1.00 0.00 C ATOM 1178 CG2 VAL A 78 1.238 -0.470 -13.755 1.00 0.00 C ATOM 0 H VAL A 78 1.246 -1.821 -11.255 1.00 0.00 H new ATOM 0 HA VAL A 78 3.440 -0.238 -12.279 1.00 0.00 H new ATOM 0 HB VAL A 78 0.460 0.279 -11.891 1.00 0.00 H new ATOM 0 HG11 VAL A 78 0.796 2.200 -13.418 1.00 0.00 H new ATOM 0 HG12 VAL A 78 1.731 2.405 -11.917 1.00 0.00 H new ATOM 0 HG13 VAL A 78 2.550 1.897 -13.414 1.00 0.00 H new ATOM 0 HG21 VAL A 78 0.402 -0.090 -14.343 1.00 0.00 H new ATOM 0 HG22 VAL A 78 2.156 -0.395 -14.338 1.00 0.00 H new ATOM 0 HG23 VAL A 78 1.056 -1.514 -13.498 1.00 0.00 H new ATOM 1188 N ASN A 79 2.034 0.666 -9.435 1.00 0.00 N ATOM 1189 CA ASN A 79 2.245 1.554 -8.256 1.00 0.00 C ATOM 1190 C ASN A 79 3.228 0.894 -7.287 1.00 0.00 C ATOM 1191 O ASN A 79 3.467 1.382 -6.201 1.00 0.00 O ATOM 1192 CB ASN A 79 0.909 1.786 -7.546 1.00 0.00 C ATOM 1193 CG ASN A 79 -0.113 2.333 -8.545 1.00 0.00 C ATOM 1194 OD1 ASN A 79 -1.256 1.721 -8.691 1.00 0.00 O flip ATOM 1195 ND2 ASN A 79 0.132 3.328 -9.199 1.00 0.00 N flip ATOM 0 H ASN A 79 1.255 0.013 -9.353 1.00 0.00 H new ATOM 0 HA ASN A 79 2.651 2.509 -8.590 1.00 0.00 H new ATOM 0 HB2 ASN A 79 0.548 0.853 -7.115 1.00 0.00 H new ATOM 0 HB3 ASN A 79 1.040 2.488 -6.723 1.00 0.00 H new ATOM 0 HD21 ASN A 79 1.026 3.806 -9.085 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -0.556 3.685 -9.862 1.00 0.00 H new ATOM 1202 N HIS A 80 3.801 -0.216 -7.671 1.00 0.00 N ATOM 1203 CA HIS A 80 4.766 -0.904 -6.768 1.00 0.00 C ATOM 1204 C HIS A 80 4.180 -0.982 -5.358 1.00 0.00 C ATOM 1205 O HIS A 80 4.817 -0.618 -4.390 1.00 0.00 O ATOM 1206 CB HIS A 80 6.079 -0.120 -6.732 1.00 0.00 C ATOM 1207 CG HIS A 80 6.539 0.154 -8.138 1.00 0.00 C ATOM 1208 ND1 HIS A 80 6.502 1.424 -8.694 1.00 0.00 N ATOM 1209 CD2 HIS A 80 7.047 -0.669 -9.113 1.00 0.00 C ATOM 1210 CE1 HIS A 80 6.976 1.329 -9.950 1.00 0.00 C ATOM 1211 NE2 HIS A 80 7.322 0.076 -10.256 1.00 0.00 N ATOM 0 H HIS A 80 3.642 -0.674 -8.569 1.00 0.00 H new ATOM 0 HA HIS A 80 4.954 -1.912 -7.139 1.00 0.00 H new ATOM 0 HB2 HIS A 80 5.940 0.818 -6.194 1.00 0.00 H new ATOM 0 HB3 HIS A 80 6.839 -0.687 -6.194 1.00 0.00 H new ATOM 0 HD2 HIS A 80 7.208 -1.732 -9.009 1.00 0.00 H new ATOM 0 HE1 HIS A 80 7.066 2.165 -10.628 1.00 0.00 H new ATOM 0 HE2 HIS A 80 7.706 -0.263 -11.138 1.00 0.00 H new ATOM 1219 N THR A 81 2.969 -1.453 -5.234 1.00 0.00 N ATOM 1220 CA THR A 81 2.344 -1.550 -3.885 1.00 0.00 C ATOM 1221 C THR A 81 1.774 -2.957 -3.684 1.00 0.00 C ATOM 1222 O THR A 81 1.091 -3.487 -4.537 1.00 0.00 O ATOM 1223 CB THR A 81 1.217 -0.523 -3.770 1.00 0.00 C ATOM 1224 OG1 THR A 81 1.728 0.773 -4.050 1.00 0.00 O ATOM 1225 CG2 THR A 81 0.641 -0.552 -2.353 1.00 0.00 C ATOM 0 H THR A 81 2.387 -1.774 -6.007 1.00 0.00 H new ATOM 0 HA THR A 81 3.097 -1.351 -3.122 1.00 0.00 H new ATOM 0 HB THR A 81 0.430 -0.765 -4.484 1.00 0.00 H new ATOM 0 HG1 THR A 81 2.173 0.767 -4.923 1.00 0.00 H new ATOM 0 HG21 THR A 81 -0.162 0.180 -2.272 1.00 0.00 H new ATOM 0 HG22 THR A 81 0.248 -1.546 -2.140 1.00 0.00 H new ATOM 0 HG23 THR A 81 1.426 -0.311 -1.636 1.00 0.00 H new ATOM 1233 N TYR A 82 2.050 -3.561 -2.561 1.00 0.00 N ATOM 1234 CA TYR A 82 1.524 -4.931 -2.302 1.00 0.00 C ATOM 1235 C TYR A 82 0.750 -4.934 -0.983 1.00 0.00 C ATOM 1236 O TYR A 82 1.239 -4.481 0.034 1.00 0.00 O ATOM 1237 CB TYR A 82 2.692 -5.915 -2.211 1.00 0.00 C ATOM 1238 CG TYR A 82 2.158 -7.319 -2.063 1.00 0.00 C ATOM 1239 CD1 TYR A 82 1.806 -8.057 -3.199 1.00 0.00 C ATOM 1240 CD2 TYR A 82 2.013 -7.881 -0.790 1.00 0.00 C ATOM 1241 CE1 TYR A 82 1.311 -9.360 -3.061 1.00 0.00 C ATOM 1242 CE2 TYR A 82 1.518 -9.183 -0.652 1.00 0.00 C ATOM 1243 CZ TYR A 82 1.167 -9.922 -1.787 1.00 0.00 C ATOM 1244 OH TYR A 82 0.680 -11.206 -1.652 1.00 0.00 O ATOM 0 H TYR A 82 2.617 -3.165 -1.811 1.00 0.00 H new ATOM 0 HA TYR A 82 0.861 -5.229 -3.114 1.00 0.00 H new ATOM 0 HB2 TYR A 82 3.312 -5.843 -3.104 1.00 0.00 H new ATOM 0 HB3 TYR A 82 3.327 -5.665 -1.361 1.00 0.00 H new ATOM 0 HD1 TYR A 82 1.916 -7.622 -4.181 1.00 0.00 H new ATOM 0 HD2 TYR A 82 2.283 -7.310 0.086 1.00 0.00 H new ATOM 0 HE1 TYR A 82 1.041 -9.931 -3.937 1.00 0.00 H new ATOM 0 HE2 TYR A 82 1.407 -9.617 0.331 1.00 0.00 H new ATOM 0 HH TYR A 82 0.733 -11.479 -0.712 1.00 0.00 H new ATOM 1254 N SER A 83 -0.455 -5.435 -0.988 1.00 0.00 N ATOM 1255 CA SER A 83 -1.254 -5.456 0.270 1.00 0.00 C ATOM 1256 C SER A 83 -1.770 -6.873 0.536 1.00 0.00 C ATOM 1257 O SER A 83 -2.194 -7.570 -0.364 1.00 0.00 O ATOM 1258 CB SER A 83 -2.441 -4.501 0.134 1.00 0.00 C ATOM 1259 OG SER A 83 -1.966 -3.189 -0.128 1.00 0.00 O ATOM 0 H SER A 83 -0.920 -5.829 -1.806 1.00 0.00 H new ATOM 0 HA SER A 83 -0.622 -5.142 1.101 1.00 0.00 H new ATOM 0 HB2 SER A 83 -3.095 -4.830 -0.673 1.00 0.00 H new ATOM 0 HB3 SER A 83 -3.034 -4.509 1.048 1.00 0.00 H new ATOM 0 HG SER A 83 -2.727 -2.577 -0.217 1.00 0.00 H new ATOM 1265 N TYR A 84 -1.740 -7.298 1.770 1.00 0.00 N ATOM 1266 CA TYR A 84 -2.233 -8.665 2.104 1.00 0.00 C ATOM 1267 C TYR A 84 -2.593 -8.718 3.591 1.00 0.00 C ATOM 1268 O TYR A 84 -2.424 -7.757 4.314 1.00 0.00 O ATOM 1269 CB TYR A 84 -1.140 -9.693 1.804 1.00 0.00 C ATOM 1270 CG TYR A 84 -0.016 -9.540 2.801 1.00 0.00 C ATOM 1271 CD1 TYR A 84 0.987 -8.587 2.584 1.00 0.00 C ATOM 1272 CD2 TYR A 84 0.024 -10.353 3.941 1.00 0.00 C ATOM 1273 CE1 TYR A 84 2.030 -8.447 3.507 1.00 0.00 C ATOM 1274 CE2 TYR A 84 1.068 -10.211 4.864 1.00 0.00 C ATOM 1275 CZ TYR A 84 2.070 -9.259 4.647 1.00 0.00 C ATOM 1276 OH TYR A 84 3.099 -9.120 5.557 1.00 0.00 O ATOM 0 H TYR A 84 -1.395 -6.757 2.563 1.00 0.00 H new ATOM 0 HA TYR A 84 -3.114 -8.894 1.504 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -1.551 -10.701 1.855 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -0.763 -9.553 0.791 1.00 0.00 H new ATOM 0 HD1 TYR A 84 0.956 -7.960 1.705 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -0.749 -11.088 4.108 1.00 0.00 H new ATOM 0 HE1 TYR A 84 2.804 -7.713 3.340 1.00 0.00 H new ATOM 0 HE2 TYR A 84 1.099 -10.837 5.744 1.00 0.00 H new ATOM 0 HH TYR A 84 2.758 -8.703 6.375 1.00 0.00 H new ATOM 1286 N SER A 85 -3.093 -9.831 4.055 1.00 0.00 N ATOM 1287 CA SER A 85 -3.464 -9.932 5.495 1.00 0.00 C ATOM 1288 C SER A 85 -3.343 -11.385 5.961 1.00 0.00 C ATOM 1289 O SER A 85 -3.448 -12.309 5.180 1.00 0.00 O ATOM 1290 CB SER A 85 -4.905 -9.458 5.682 1.00 0.00 C ATOM 1291 OG SER A 85 -5.787 -10.345 5.011 1.00 0.00 O ATOM 0 H SER A 85 -3.260 -10.671 3.502 1.00 0.00 H new ATOM 0 HA SER A 85 -2.792 -9.308 6.084 1.00 0.00 H new ATOM 0 HB2 SER A 85 -5.151 -9.418 6.743 1.00 0.00 H new ATOM 0 HB3 SER A 85 -5.020 -8.448 5.290 1.00 0.00 H new ATOM 0 HG SER A 85 -6.099 -9.930 4.180 1.00 0.00 H new ATOM 1297 N LEU A 86 -3.132 -11.592 7.233 1.00 0.00 N ATOM 1298 CA LEU A 86 -3.015 -12.984 7.751 1.00 0.00 C ATOM 1299 C LEU A 86 -4.408 -13.504 8.107 1.00 0.00 C ATOM 1300 O LEU A 86 -5.127 -12.902 8.880 1.00 0.00 O ATOM 1301 CB LEU A 86 -2.131 -12.995 9.000 1.00 0.00 C ATOM 1302 CG LEU A 86 -1.810 -14.442 9.380 1.00 0.00 C ATOM 1303 CD1 LEU A 86 -0.890 -15.055 8.323 1.00 0.00 C ATOM 1304 CD2 LEU A 86 -1.110 -14.470 10.741 1.00 0.00 C ATOM 0 H LEU A 86 -3.036 -10.858 7.934 1.00 0.00 H new ATOM 0 HA LEU A 86 -2.567 -13.622 6.989 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -1.210 -12.443 8.812 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -2.640 -12.495 9.824 1.00 0.00 H new ATOM 0 HG LEU A 86 -2.735 -15.016 9.435 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -0.661 -16.086 8.593 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -1.387 -15.036 7.353 1.00 0.00 H new ATOM 0 HD13 LEU A 86 0.035 -14.480 8.268 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -0.881 -15.501 11.011 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -0.185 -13.896 10.686 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -1.764 -14.033 11.496 1.00 0.00 H new ATOM 1316 N ILE A 87 -4.800 -14.613 7.542 1.00 0.00 N ATOM 1317 CA ILE A 87 -6.152 -15.165 7.842 1.00 0.00 C ATOM 1318 C ILE A 87 -6.121 -15.922 9.172 1.00 0.00 C ATOM 1319 O ILE A 87 -6.604 -15.443 10.179 1.00 0.00 O ATOM 1320 CB ILE A 87 -6.571 -16.117 6.720 1.00 0.00 C ATOM 1321 CG1 ILE A 87 -6.636 -15.349 5.398 1.00 0.00 C ATOM 1322 CG2 ILE A 87 -7.948 -16.703 7.039 1.00 0.00 C ATOM 1323 CD1 ILE A 87 -6.902 -16.325 4.252 1.00 0.00 C ATOM 0 H ILE A 87 -4.243 -15.161 6.886 1.00 0.00 H new ATOM 0 HA ILE A 87 -6.868 -14.347 7.914 1.00 0.00 H new ATOM 0 HB ILE A 87 -5.843 -16.924 6.635 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -7.425 -14.598 5.440 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -5.699 -14.818 5.227 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -8.248 -17.382 6.241 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -7.902 -17.249 7.981 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -8.676 -15.896 7.123 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -6.948 -15.777 3.311 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -6.098 -17.059 4.205 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -7.850 -16.836 4.422 1.00 0.00 H new ATOM 1335 N GLU A 88 -5.563 -17.101 9.186 1.00 0.00 N ATOM 1336 CA GLU A 88 -5.513 -17.882 10.455 1.00 0.00 C ATOM 1337 C GLU A 88 -4.072 -18.303 10.749 1.00 0.00 C ATOM 1338 O GLU A 88 -3.239 -18.359 9.867 1.00 0.00 O ATOM 1339 CB GLU A 88 -6.389 -19.129 10.318 1.00 0.00 C ATOM 1340 CG GLU A 88 -7.840 -18.707 10.075 1.00 0.00 C ATOM 1341 CD GLU A 88 -8.702 -19.950 9.845 1.00 0.00 C ATOM 1342 OE1 GLU A 88 -8.137 -21.026 9.736 1.00 0.00 O ATOM 1343 OE2 GLU A 88 -9.912 -19.805 9.783 1.00 0.00 O ATOM 0 H GLU A 88 -5.141 -17.557 8.377 1.00 0.00 H new ATOM 0 HA GLU A 88 -5.880 -17.263 11.273 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -6.035 -19.746 9.492 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -6.321 -19.735 11.221 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -8.215 -18.145 10.931 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -7.898 -18.046 9.210 1.00 0.00 H new ATOM 1350 N GLY A 89 -3.772 -18.598 11.986 1.00 0.00 N ATOM 1351 CA GLY A 89 -2.385 -19.015 12.337 1.00 0.00 C ATOM 1352 C GLY A 89 -2.314 -19.349 13.829 1.00 0.00 C ATOM 1353 O GLY A 89 -2.819 -18.624 14.662 1.00 0.00 O ATOM 0 H GLY A 89 -4.427 -18.568 12.767 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -2.094 -19.883 11.745 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -1.683 -18.216 12.098 1.00 0.00 H new ATOM 1357 N ASP A 90 -1.688 -20.442 14.173 1.00 0.00 N ATOM 1358 CA ASP A 90 -1.582 -20.819 15.609 1.00 0.00 C ATOM 1359 C ASP A 90 -1.060 -19.626 16.409 1.00 0.00 C ATOM 1360 O ASP A 90 -1.481 -19.380 17.523 1.00 0.00 O ATOM 1361 CB ASP A 90 -0.616 -21.996 15.759 1.00 0.00 C ATOM 1362 CG ASP A 90 -1.302 -23.282 15.293 1.00 0.00 C ATOM 1363 OD1 ASP A 90 -2.409 -23.189 14.789 1.00 0.00 O ATOM 1364 OD2 ASP A 90 -0.708 -24.336 15.448 1.00 0.00 O ATOM 0 H ASP A 90 -1.246 -21.089 13.520 1.00 0.00 H new ATOM 0 HA ASP A 90 -2.564 -21.107 15.983 1.00 0.00 H new ATOM 0 HB2 ASP A 90 0.285 -21.818 15.171 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -0.304 -22.094 16.799 1.00 0.00 H new ATOM 1369 N ALA A 91 -0.149 -18.878 15.849 1.00 0.00 N ATOM 1370 CA ALA A 91 0.395 -17.698 16.577 1.00 0.00 C ATOM 1371 C ALA A 91 -0.725 -16.681 16.791 1.00 0.00 C ATOM 1372 O ALA A 91 -0.626 -15.794 17.615 1.00 0.00 O ATOM 1373 CB ALA A 91 1.513 -17.060 15.751 1.00 0.00 C ATOM 0 H ALA A 91 0.242 -19.033 14.920 1.00 0.00 H new ATOM 0 HA ALA A 91 0.794 -18.013 17.541 1.00 0.00 H new ATOM 0 HB1 ALA A 91 1.911 -16.196 16.284 1.00 0.00 H new ATOM 0 HB2 ALA A 91 2.309 -17.788 15.593 1.00 0.00 H new ATOM 0 HB3 ALA A 91 1.116 -16.741 14.787 1.00 0.00 H new ATOM 1379 N LEU A 92 -1.795 -16.805 16.054 1.00 0.00 N ATOM 1380 CA LEU A 92 -2.925 -15.849 16.213 1.00 0.00 C ATOM 1381 C LEU A 92 -3.797 -16.289 17.390 1.00 0.00 C ATOM 1382 O LEU A 92 -4.235 -15.483 18.186 1.00 0.00 O ATOM 1383 CB LEU A 92 -3.768 -15.836 14.935 1.00 0.00 C ATOM 1384 CG LEU A 92 -3.029 -15.069 13.839 1.00 0.00 C ATOM 1385 CD1 LEU A 92 -1.976 -15.977 13.199 1.00 0.00 C ATOM 1386 CD2 LEU A 92 -4.030 -14.622 12.771 1.00 0.00 C ATOM 0 H LEU A 92 -1.935 -17.528 15.348 1.00 0.00 H new ATOM 0 HA LEU A 92 -2.533 -14.849 16.400 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -3.966 -16.857 14.608 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -4.734 -15.371 15.130 1.00 0.00 H new ATOM 0 HG LEU A 92 -2.540 -14.196 14.272 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -1.450 -15.429 12.418 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -1.264 -16.300 13.958 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -2.464 -16.850 12.765 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -3.506 -14.074 11.988 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -4.516 -15.497 12.339 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -4.782 -13.976 13.225 1.00 0.00 H new ATOM 1398 N SER A 93 -4.052 -17.563 17.506 1.00 0.00 N ATOM 1399 CA SER A 93 -4.898 -18.052 18.630 1.00 0.00 C ATOM 1400 C SER A 93 -6.279 -17.403 18.540 1.00 0.00 C ATOM 1401 O SER A 93 -6.536 -16.583 17.681 1.00 0.00 O ATOM 1402 CB SER A 93 -4.243 -17.680 19.962 1.00 0.00 C ATOM 1403 OG SER A 93 -5.225 -17.676 20.987 1.00 0.00 O ATOM 0 H SER A 93 -3.711 -18.286 16.872 1.00 0.00 H new ATOM 0 HA SER A 93 -4.999 -19.136 18.568 1.00 0.00 H new ATOM 0 HB2 SER A 93 -3.454 -18.392 20.203 1.00 0.00 H new ATOM 0 HB3 SER A 93 -3.775 -16.698 19.888 1.00 0.00 H new ATOM 0 HG SER A 93 -4.806 -17.439 21.841 1.00 0.00 H new ATOM 1409 N GLU A 94 -7.172 -17.763 19.419 1.00 0.00 N ATOM 1410 CA GLU A 94 -8.537 -17.165 19.381 1.00 0.00 C ATOM 1411 C GLU A 94 -8.504 -15.770 20.009 1.00 0.00 C ATOM 1412 O GLU A 94 -9.496 -15.070 20.038 1.00 0.00 O ATOM 1413 CB GLU A 94 -9.504 -18.055 20.164 1.00 0.00 C ATOM 1414 CG GLU A 94 -9.555 -19.442 19.520 1.00 0.00 C ATOM 1415 CD GLU A 94 -10.512 -20.338 20.309 1.00 0.00 C ATOM 1416 OE1 GLU A 94 -10.922 -19.930 21.384 1.00 0.00 O ATOM 1417 OE2 GLU A 94 -10.820 -21.414 19.826 1.00 0.00 O ATOM 0 H GLU A 94 -7.017 -18.445 20.162 1.00 0.00 H new ATOM 0 HA GLU A 94 -8.870 -17.087 18.346 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -9.181 -18.136 21.202 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -10.499 -17.610 20.173 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -9.886 -19.362 18.485 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -8.558 -19.883 19.503 1.00 0.00 H new ATOM 1424 N ASN A 95 -7.372 -15.358 20.514 1.00 0.00 N ATOM 1425 CA ASN A 95 -7.285 -14.009 21.140 1.00 0.00 C ATOM 1426 C ASN A 95 -6.875 -12.977 20.088 1.00 0.00 C ATOM 1427 O ASN A 95 -7.101 -11.794 20.246 1.00 0.00 O ATOM 1428 CB ASN A 95 -6.244 -14.036 22.261 1.00 0.00 C ATOM 1429 CG ASN A 95 -4.873 -14.380 21.676 1.00 0.00 C ATOM 1430 OD1 ASN A 95 -4.782 -14.975 20.621 1.00 0.00 O ATOM 1431 ND2 ASN A 95 -3.795 -14.028 22.321 1.00 0.00 N ATOM 0 H ASN A 95 -6.506 -15.897 20.520 1.00 0.00 H new ATOM 0 HA ASN A 95 -8.258 -13.737 21.550 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -6.206 -13.067 22.760 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -6.525 -14.772 23.015 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -2.876 -14.252 21.939 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -3.871 -13.528 23.207 1.00 0.00 H new ATOM 1438 N ILE A 96 -6.270 -13.410 19.015 1.00 0.00 N ATOM 1439 CA ILE A 96 -5.848 -12.444 17.962 1.00 0.00 C ATOM 1440 C ILE A 96 -6.674 -12.666 16.693 1.00 0.00 C ATOM 1441 O ILE A 96 -6.844 -13.779 16.235 1.00 0.00 O ATOM 1442 CB ILE A 96 -4.364 -12.644 17.644 1.00 0.00 C ATOM 1443 CG1 ILE A 96 -3.544 -12.518 18.929 1.00 0.00 C ATOM 1444 CG2 ILE A 96 -3.911 -11.580 16.643 1.00 0.00 C ATOM 1445 CD1 ILE A 96 -2.055 -12.644 18.598 1.00 0.00 C ATOM 0 H ILE A 96 -6.051 -14.387 18.823 1.00 0.00 H new ATOM 0 HA ILE A 96 -6.009 -11.429 18.325 1.00 0.00 H new ATOM 0 HB ILE A 96 -4.214 -13.635 17.215 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -3.741 -11.558 19.407 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -3.837 -13.293 19.638 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -2.854 -11.721 16.415 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -4.495 -11.670 15.727 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -4.061 -10.589 17.072 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -1.470 -12.554 19.513 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -1.865 -13.614 18.140 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -1.768 -11.853 17.905 1.00 0.00 H new ATOM 1457 N GLU A 97 -7.183 -11.611 16.119 1.00 0.00 N ATOM 1458 CA GLU A 97 -7.993 -11.744 14.877 1.00 0.00 C ATOM 1459 C GLU A 97 -7.071 -11.629 13.662 1.00 0.00 C ATOM 1460 O GLU A 97 -5.871 -11.488 13.794 1.00 0.00 O ATOM 1461 CB GLU A 97 -9.046 -10.637 14.827 1.00 0.00 C ATOM 1462 CG GLU A 97 -10.041 -10.827 15.973 1.00 0.00 C ATOM 1463 CD GLU A 97 -11.185 -9.822 15.829 1.00 0.00 C ATOM 1464 OE1 GLU A 97 -11.105 -8.987 14.942 1.00 0.00 O ATOM 1465 OE2 GLU A 97 -12.121 -9.904 16.607 1.00 0.00 O ATOM 0 H GLU A 97 -7.071 -10.656 16.460 1.00 0.00 H new ATOM 0 HA GLU A 97 -8.492 -12.713 14.869 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -8.567 -9.661 14.905 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -9.568 -10.660 13.870 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -10.433 -11.844 15.963 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -9.539 -10.688 16.931 1.00 0.00 H new ATOM 1472 N LYS A 98 -7.616 -11.694 12.479 1.00 0.00 N ATOM 1473 CA LYS A 98 -6.761 -11.594 11.263 1.00 0.00 C ATOM 1474 C LYS A 98 -5.958 -10.292 11.313 1.00 0.00 C ATOM 1475 O LYS A 98 -6.330 -9.345 11.978 1.00 0.00 O ATOM 1476 CB LYS A 98 -7.647 -11.597 10.016 1.00 0.00 C ATOM 1477 CG LYS A 98 -8.474 -12.883 9.978 1.00 0.00 C ATOM 1478 CD LYS A 98 -9.242 -12.956 8.656 1.00 0.00 C ATOM 1479 CE LYS A 98 -9.987 -14.289 8.571 1.00 0.00 C ATOM 1480 NZ LYS A 98 -10.258 -14.616 7.143 1.00 0.00 N ATOM 0 H LYS A 98 -8.614 -11.812 12.302 1.00 0.00 H new ATOM 0 HA LYS A 98 -6.078 -12.443 11.226 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -8.306 -10.729 10.024 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -7.031 -11.522 9.120 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -7.822 -13.751 10.081 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -9.170 -12.906 10.817 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -9.948 -12.128 8.587 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -8.553 -12.858 7.817 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -9.393 -15.080 9.030 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -10.923 -14.231 9.126 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -10.528 -15.617 7.061 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -11.033 -14.019 6.791 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -9.402 -14.441 6.578 1.00 0.00 H new ATOM 1494 N ILE A 99 -4.852 -10.242 10.620 1.00 0.00 N ATOM 1495 CA ILE A 99 -4.019 -9.007 10.632 1.00 0.00 C ATOM 1496 C ILE A 99 -3.927 -8.434 9.216 1.00 0.00 C ATOM 1497 O ILE A 99 -3.727 -9.153 8.258 1.00 0.00 O ATOM 1498 CB ILE A 99 -2.614 -9.350 11.133 1.00 0.00 C ATOM 1499 CG1 ILE A 99 -2.713 -10.067 12.480 1.00 0.00 C ATOM 1500 CG2 ILE A 99 -1.803 -8.062 11.298 1.00 0.00 C ATOM 1501 CD1 ILE A 99 -1.313 -10.479 12.942 1.00 0.00 C ATOM 0 H ILE A 99 -4.490 -11.004 10.046 1.00 0.00 H new ATOM 0 HA ILE A 99 -4.475 -8.268 11.291 1.00 0.00 H new ATOM 0 HB ILE A 99 -2.120 -10.001 10.412 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -3.174 -9.412 13.220 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -3.351 -10.946 12.390 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -0.802 -8.305 11.655 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -1.732 -7.551 10.338 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -2.297 -7.411 12.019 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -1.382 -10.990 13.902 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -0.869 -11.149 12.206 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -0.689 -9.592 13.048 1.00 0.00 H new ATOM 1513 N ASP A 100 -4.068 -7.143 9.078 1.00 0.00 N ATOM 1514 CA ASP A 100 -3.984 -6.525 7.726 1.00 0.00 C ATOM 1515 C ASP A 100 -2.542 -6.092 7.454 1.00 0.00 C ATOM 1516 O ASP A 100 -1.958 -5.339 8.207 1.00 0.00 O ATOM 1517 CB ASP A 100 -4.903 -5.303 7.666 1.00 0.00 C ATOM 1518 CG ASP A 100 -6.360 -5.754 7.780 1.00 0.00 C ATOM 1519 OD1 ASP A 100 -6.609 -6.936 7.610 1.00 0.00 O ATOM 1520 OD2 ASP A 100 -7.204 -4.909 8.036 1.00 0.00 O ATOM 0 H ASP A 100 -4.238 -6.491 9.844 1.00 0.00 H new ATOM 0 HA ASP A 100 -4.295 -7.250 6.974 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -4.661 -4.613 8.474 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -4.750 -4.765 6.730 1.00 0.00 H new ATOM 1525 N TYR A 101 -1.962 -6.564 6.384 1.00 0.00 N ATOM 1526 CA TYR A 101 -0.556 -6.181 6.069 1.00 0.00 C ATOM 1527 C TYR A 101 -0.529 -5.344 4.788 1.00 0.00 C ATOM 1528 O TYR A 101 -1.225 -5.628 3.834 1.00 0.00 O ATOM 1529 CB TYR A 101 0.283 -7.444 5.870 1.00 0.00 C ATOM 1530 CG TYR A 101 0.516 -8.107 7.207 1.00 0.00 C ATOM 1531 CD1 TYR A 101 1.580 -7.695 8.016 1.00 0.00 C ATOM 1532 CD2 TYR A 101 -0.334 -9.134 7.637 1.00 0.00 C ATOM 1533 CE1 TYR A 101 1.797 -8.309 9.255 1.00 0.00 C ATOM 1534 CE2 TYR A 101 -0.118 -9.748 8.876 1.00 0.00 C ATOM 1535 CZ TYR A 101 0.948 -9.335 9.686 1.00 0.00 C ATOM 1536 OH TYR A 101 1.161 -9.940 10.907 1.00 0.00 O ATOM 0 H TYR A 101 -2.400 -7.197 5.715 1.00 0.00 H new ATOM 0 HA TYR A 101 -0.145 -5.597 6.893 1.00 0.00 H new ATOM 0 HB2 TYR A 101 -0.228 -8.131 5.195 1.00 0.00 H new ATOM 0 HB3 TYR A 101 1.236 -7.191 5.406 1.00 0.00 H new ATOM 0 HD1 TYR A 101 2.235 -6.903 7.684 1.00 0.00 H new ATOM 0 HD2 TYR A 101 -1.156 -9.452 7.013 1.00 0.00 H new ATOM 0 HE1 TYR A 101 2.620 -7.991 9.878 1.00 0.00 H new ATOM 0 HE2 TYR A 101 -0.773 -10.540 9.208 1.00 0.00 H new ATOM 0 HH TYR A 101 1.570 -9.297 11.524 1.00 0.00 H new ATOM 1546 N GLU A 102 0.274 -4.315 4.761 1.00 0.00 N ATOM 1547 CA GLU A 102 0.350 -3.461 3.542 1.00 0.00 C ATOM 1548 C GLU A 102 1.817 -3.184 3.206 1.00 0.00 C ATOM 1549 O GLU A 102 2.626 -2.937 4.077 1.00 0.00 O ATOM 1550 CB GLU A 102 -0.373 -2.137 3.801 1.00 0.00 C ATOM 1551 CG GLU A 102 -1.849 -2.411 4.100 1.00 0.00 C ATOM 1552 CD GLU A 102 -2.600 -1.084 4.221 1.00 0.00 C ATOM 1553 OE1 GLU A 102 -1.947 -0.054 4.218 1.00 0.00 O ATOM 1554 OE2 GLU A 102 -3.815 -1.120 4.315 1.00 0.00 O ATOM 0 H GLU A 102 0.880 -4.029 5.530 1.00 0.00 H new ATOM 0 HA GLU A 102 -0.124 -3.976 2.706 1.00 0.00 H new ATOM 0 HB2 GLU A 102 0.088 -1.617 4.640 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -0.282 -1.485 2.932 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -2.285 -3.017 3.306 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -1.944 -2.981 5.025 1.00 0.00 H new ATOM 1561 N THR A 103 2.166 -3.225 1.949 1.00 0.00 N ATOM 1562 CA THR A 103 3.581 -2.966 1.562 1.00 0.00 C ATOM 1563 C THR A 103 3.625 -1.889 0.476 1.00 0.00 C ATOM 1564 O THR A 103 2.836 -1.892 -0.448 1.00 0.00 O ATOM 1565 CB THR A 103 4.207 -4.256 1.027 1.00 0.00 C ATOM 1566 OG1 THR A 103 4.007 -5.303 1.968 1.00 0.00 O ATOM 1567 CG2 THR A 103 5.705 -4.046 0.805 1.00 0.00 C ATOM 0 H THR A 103 1.533 -3.426 1.175 1.00 0.00 H new ATOM 0 HA THR A 103 4.139 -2.625 2.434 1.00 0.00 H new ATOM 0 HB THR A 103 3.737 -4.523 0.080 1.00 0.00 H new ATOM 0 HG1 THR A 103 4.406 -6.130 1.626 1.00 0.00 H new ATOM 0 HG21 THR A 103 6.149 -4.966 0.424 1.00 0.00 H new ATOM 0 HG22 THR A 103 5.857 -3.244 0.083 1.00 0.00 H new ATOM 0 HG23 THR A 103 6.179 -3.779 1.750 1.00 0.00 H new ATOM 1575 N LYS A 104 4.543 -0.967 0.580 1.00 0.00 N ATOM 1576 CA LYS A 104 4.639 0.109 -0.446 1.00 0.00 C ATOM 1577 C LYS A 104 6.110 0.378 -0.766 1.00 0.00 C ATOM 1578 O LYS A 104 6.907 0.647 0.111 1.00 0.00 O ATOM 1579 CB LYS A 104 3.992 1.387 0.093 1.00 0.00 C ATOM 1580 CG LYS A 104 4.018 2.467 -0.991 1.00 0.00 C ATOM 1581 CD LYS A 104 3.445 3.768 -0.427 1.00 0.00 C ATOM 1582 CE LYS A 104 3.336 4.806 -1.546 1.00 0.00 C ATOM 1583 NZ LYS A 104 2.201 5.729 -1.260 1.00 0.00 N ATOM 0 H LYS A 104 5.231 -0.913 1.331 1.00 0.00 H new ATOM 0 HA LYS A 104 4.122 -0.206 -1.352 1.00 0.00 H new ATOM 0 HB2 LYS A 104 2.965 1.187 0.398 1.00 0.00 H new ATOM 0 HB3 LYS A 104 4.526 1.732 0.979 1.00 0.00 H new ATOM 0 HG2 LYS A 104 5.039 2.626 -1.336 1.00 0.00 H new ATOM 0 HG3 LYS A 104 3.436 2.145 -1.855 1.00 0.00 H new ATOM 0 HD2 LYS A 104 2.464 3.586 0.011 1.00 0.00 H new ATOM 0 HD3 LYS A 104 4.085 4.144 0.371 1.00 0.00 H new ATOM 0 HE2 LYS A 104 4.266 5.370 -1.625 1.00 0.00 H new ATOM 0 HE3 LYS A 104 3.182 4.309 -2.504 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 2.127 6.434 -2.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 1.316 5.185 -1.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 2.367 6.213 -0.354 1.00 0.00 H new ATOM 1597 N LEU A 105 6.478 0.305 -2.015 1.00 0.00 N ATOM 1598 CA LEU A 105 7.899 0.556 -2.389 1.00 0.00 C ATOM 1599 C LEU A 105 8.037 1.969 -2.958 1.00 0.00 C ATOM 1600 O LEU A 105 7.301 2.367 -3.841 1.00 0.00 O ATOM 1601 CB LEU A 105 8.336 -0.463 -3.442 1.00 0.00 C ATOM 1602 CG LEU A 105 8.314 -1.867 -2.834 1.00 0.00 C ATOM 1603 CD1 LEU A 105 9.041 -1.851 -1.489 1.00 0.00 C ATOM 1604 CD2 LEU A 105 6.865 -2.310 -2.625 1.00 0.00 C ATOM 0 H LEU A 105 5.857 0.083 -2.793 1.00 0.00 H new ATOM 0 HA LEU A 105 8.529 0.459 -1.505 1.00 0.00 H new ATOM 0 HB2 LEU A 105 7.671 -0.418 -4.305 1.00 0.00 H new ATOM 0 HB3 LEU A 105 9.338 -0.226 -3.799 1.00 0.00 H new ATOM 0 HG LEU A 105 8.813 -2.563 -3.509 1.00 0.00 H new ATOM 0 HD11 LEU A 105 9.026 -2.851 -1.055 1.00 0.00 H new ATOM 0 HD12 LEU A 105 10.074 -1.536 -1.637 1.00 0.00 H new ATOM 0 HD13 LEU A 105 8.542 -1.155 -0.814 1.00 0.00 H new ATOM 0 HD21 LEU A 105 6.849 -3.310 -2.192 1.00 0.00 H new ATOM 0 HD22 LEU A 105 6.366 -1.615 -1.950 1.00 0.00 H new ATOM 0 HD23 LEU A 105 6.346 -2.321 -3.584 1.00 0.00 H new ATOM 1616 N VAL A 106 8.973 2.730 -2.462 1.00 0.00 N ATOM 1617 CA VAL A 106 9.156 4.117 -2.975 1.00 0.00 C ATOM 1618 C VAL A 106 10.637 4.357 -3.278 1.00 0.00 C ATOM 1619 O VAL A 106 11.509 3.868 -2.587 1.00 0.00 O ATOM 1620 CB VAL A 106 8.682 5.119 -1.919 1.00 0.00 C ATOM 1621 CG1 VAL A 106 8.815 6.540 -2.469 1.00 0.00 C ATOM 1622 CG2 VAL A 106 7.218 4.840 -1.573 1.00 0.00 C ATOM 0 H VAL A 106 9.619 2.451 -1.724 1.00 0.00 H new ATOM 0 HA VAL A 106 8.573 4.247 -3.886 1.00 0.00 H new ATOM 0 HB VAL A 106 9.293 5.019 -1.022 1.00 0.00 H new ATOM 0 HG11 VAL A 106 8.478 7.254 -1.718 1.00 0.00 H new ATOM 0 HG12 VAL A 106 9.858 6.738 -2.716 1.00 0.00 H new ATOM 0 HG13 VAL A 106 8.204 6.642 -3.366 1.00 0.00 H new ATOM 0 HG21 VAL A 106 6.880 5.553 -0.821 1.00 0.00 H new ATOM 0 HG22 VAL A 106 6.607 4.941 -2.470 1.00 0.00 H new ATOM 0 HG23 VAL A 106 7.123 3.827 -1.181 1.00 0.00 H new ATOM 1632 N SER A 107 10.928 5.106 -4.305 1.00 0.00 N ATOM 1633 CA SER A 107 12.351 5.376 -4.651 1.00 0.00 C ATOM 1634 C SER A 107 12.682 6.839 -4.348 1.00 0.00 C ATOM 1635 O SER A 107 11.824 7.700 -4.387 1.00 0.00 O ATOM 1636 CB SER A 107 12.576 5.099 -6.139 1.00 0.00 C ATOM 1637 OG SER A 107 11.842 6.038 -6.910 1.00 0.00 O ATOM 0 H SER A 107 10.241 5.543 -4.920 1.00 0.00 H new ATOM 0 HA SER A 107 12.997 4.728 -4.059 1.00 0.00 H new ATOM 0 HB2 SER A 107 13.638 5.168 -6.376 1.00 0.00 H new ATOM 0 HB3 SER A 107 12.260 4.085 -6.383 1.00 0.00 H new ATOM 0 HG SER A 107 11.987 5.863 -7.863 1.00 0.00 H new ATOM 1643 N ALA A 108 13.918 7.129 -4.048 1.00 0.00 N ATOM 1644 CA ALA A 108 14.299 8.536 -3.744 1.00 0.00 C ATOM 1645 C ALA A 108 15.188 9.077 -4.866 1.00 0.00 C ATOM 1646 O ALA A 108 15.768 8.328 -5.626 1.00 0.00 O ATOM 1647 CB ALA A 108 15.065 8.583 -2.420 1.00 0.00 C ATOM 0 H ALA A 108 14.680 6.453 -4.000 1.00 0.00 H new ATOM 0 HA ALA A 108 13.400 9.147 -3.665 1.00 0.00 H new ATOM 0 HB1 ALA A 108 15.344 9.613 -2.197 1.00 0.00 H new ATOM 0 HB2 ALA A 108 14.433 8.197 -1.620 1.00 0.00 H new ATOM 0 HB3 ALA A 108 15.964 7.972 -2.498 1.00 0.00 H new ATOM 1653 N PRO A 109 15.293 10.411 -4.965 1.00 0.00 N ATOM 1654 CA PRO A 109 16.110 11.067 -5.994 1.00 0.00 C ATOM 1655 C PRO A 109 17.607 10.864 -5.748 1.00 0.00 C ATOM 1656 O PRO A 109 18.422 11.057 -6.628 1.00 0.00 O ATOM 1657 CB PRO A 109 15.753 12.546 -5.843 1.00 0.00 C ATOM 1658 CG PRO A 109 15.295 12.680 -4.429 1.00 0.00 C ATOM 1659 CD PRO A 109 14.622 11.381 -4.083 1.00 0.00 C ATOM 0 HA PRO A 109 15.915 10.665 -6.988 1.00 0.00 H new ATOM 0 HB2 PRO A 109 16.614 13.184 -6.043 1.00 0.00 H new ATOM 0 HB3 PRO A 109 14.970 12.838 -6.543 1.00 0.00 H new ATOM 0 HG2 PRO A 109 16.137 12.872 -3.763 1.00 0.00 H new ATOM 0 HG3 PRO A 109 14.605 13.517 -4.321 1.00 0.00 H new ATOM 0 HD2 PRO A 109 14.753 11.127 -3.031 1.00 0.00 H new ATOM 0 HD3 PRO A 109 13.549 11.421 -4.270 1.00 0.00 H new ATOM 1667 N HIS A 110 17.975 10.475 -4.558 1.00 0.00 N ATOM 1668 CA HIS A 110 19.419 10.260 -4.258 1.00 0.00 C ATOM 1669 C HIS A 110 19.872 8.922 -4.849 1.00 0.00 C ATOM 1670 O HIS A 110 21.048 8.633 -4.925 1.00 0.00 O ATOM 1671 CB HIS A 110 19.629 10.243 -2.743 1.00 0.00 C ATOM 1672 CG HIS A 110 19.136 11.538 -2.155 1.00 0.00 C ATOM 1673 ND1 HIS A 110 19.667 12.765 -2.521 1.00 0.00 N ATOM 1674 CD2 HIS A 110 18.163 11.812 -1.226 1.00 0.00 C ATOM 1675 CE1 HIS A 110 19.015 13.712 -1.822 1.00 0.00 C ATOM 1676 NE2 HIS A 110 18.089 13.186 -1.018 1.00 0.00 N ATOM 0 H HIS A 110 17.339 10.297 -3.781 1.00 0.00 H new ATOM 0 HA HIS A 110 20.003 11.068 -4.698 1.00 0.00 H new ATOM 0 HB2 HIS A 110 19.094 9.403 -2.300 1.00 0.00 H new ATOM 0 HB3 HIS A 110 20.685 10.105 -2.513 1.00 0.00 H new ATOM 0 HD2 HIS A 110 17.549 11.074 -0.732 1.00 0.00 H new ATOM 0 HE1 HIS A 110 19.217 14.770 -1.902 1.00 0.00 H new ATOM 0 HE2 HIS A 110 17.462 13.684 -0.387 1.00 0.00 H new ATOM 1684 N GLY A 111 18.945 8.104 -5.268 1.00 0.00 N ATOM 1685 CA GLY A 111 19.323 6.787 -5.852 1.00 0.00 C ATOM 1686 C GLY A 111 18.924 5.667 -4.888 1.00 0.00 C ATOM 1687 O GLY A 111 18.838 4.515 -5.263 1.00 0.00 O ATOM 0 H GLY A 111 17.943 8.291 -5.231 1.00 0.00 H new ATOM 0 HA2 GLY A 111 18.828 6.648 -6.813 1.00 0.00 H new ATOM 0 HA3 GLY A 111 20.396 6.755 -6.039 1.00 0.00 H new ATOM 1691 N GLY A 112 18.680 5.997 -3.649 1.00 0.00 N ATOM 1692 CA GLY A 112 18.288 4.951 -2.663 1.00 0.00 C ATOM 1693 C GLY A 112 16.806 4.614 -2.836 1.00 0.00 C ATOM 1694 O GLY A 112 16.096 5.262 -3.580 1.00 0.00 O ATOM 0 H GLY A 112 18.735 6.945 -3.277 1.00 0.00 H new ATOM 0 HA2 GLY A 112 18.894 4.056 -2.806 1.00 0.00 H new ATOM 0 HA3 GLY A 112 18.475 5.304 -1.649 1.00 0.00 H new ATOM 1698 N THR A 113 16.333 3.606 -2.155 1.00 0.00 N ATOM 1699 CA THR A 113 14.896 3.230 -2.282 1.00 0.00 C ATOM 1700 C THR A 113 14.244 3.221 -0.897 1.00 0.00 C ATOM 1701 O THR A 113 14.732 2.599 0.025 1.00 0.00 O ATOM 1702 CB THR A 113 14.789 1.836 -2.905 1.00 0.00 C ATOM 1703 OG1 THR A 113 15.364 1.854 -4.203 1.00 0.00 O ATOM 1704 CG2 THR A 113 13.316 1.431 -3.002 1.00 0.00 C ATOM 0 H THR A 113 16.879 3.027 -1.517 1.00 0.00 H new ATOM 0 HA THR A 113 14.386 3.954 -2.917 1.00 0.00 H new ATOM 0 HB THR A 113 15.321 1.117 -2.282 1.00 0.00 H new ATOM 0 HG1 THR A 113 16.061 1.168 -4.261 1.00 0.00 H new ATOM 0 HG21 THR A 113 13.240 0.438 -3.446 1.00 0.00 H new ATOM 0 HG22 THR A 113 12.876 1.417 -2.005 1.00 0.00 H new ATOM 0 HG23 THR A 113 12.782 2.149 -3.625 1.00 0.00 H new ATOM 1712 N ILE A 114 13.143 3.904 -0.747 1.00 0.00 N ATOM 1713 CA ILE A 114 12.457 3.933 0.575 1.00 0.00 C ATOM 1714 C ILE A 114 11.301 2.931 0.567 1.00 0.00 C ATOM 1715 O ILE A 114 10.552 2.842 -0.387 1.00 0.00 O ATOM 1716 CB ILE A 114 11.913 5.338 0.839 1.00 0.00 C ATOM 1717 CG1 ILE A 114 13.046 6.358 0.715 1.00 0.00 C ATOM 1718 CG2 ILE A 114 11.323 5.402 2.249 1.00 0.00 C ATOM 1719 CD1 ILE A 114 12.469 7.773 0.795 1.00 0.00 C ATOM 0 H ILE A 114 12.688 4.444 -1.484 1.00 0.00 H new ATOM 0 HA ILE A 114 13.166 3.667 1.359 1.00 0.00 H new ATOM 0 HB ILE A 114 11.137 5.567 0.109 1.00 0.00 H new ATOM 0 HG12 ILE A 114 13.776 6.206 1.510 1.00 0.00 H new ATOM 0 HG13 ILE A 114 13.571 6.221 -0.230 1.00 0.00 H new ATOM 0 HG21 ILE A 114 10.936 6.404 2.436 1.00 0.00 H new ATOM 0 HG22 ILE A 114 10.514 4.677 2.338 1.00 0.00 H new ATOM 0 HG23 ILE A 114 12.099 5.171 2.979 1.00 0.00 H new ATOM 0 HD11 ILE A 114 13.276 8.500 0.707 1.00 0.00 H new ATOM 0 HD12 ILE A 114 11.756 7.922 -0.016 1.00 0.00 H new ATOM 0 HD13 ILE A 114 11.963 7.906 1.751 1.00 0.00 H new ATOM 1731 N ILE A 115 11.149 2.173 1.618 1.00 0.00 N ATOM 1732 CA ILE A 115 10.040 1.178 1.662 1.00 0.00 C ATOM 1733 C ILE A 115 9.115 1.489 2.841 1.00 0.00 C ATOM 1734 O ILE A 115 9.558 1.692 3.954 1.00 0.00 O ATOM 1735 CB ILE A 115 10.622 -0.228 1.828 1.00 0.00 C ATOM 1736 CG1 ILE A 115 11.628 -0.500 0.707 1.00 0.00 C ATOM 1737 CG2 ILE A 115 9.494 -1.258 1.761 1.00 0.00 C ATOM 1738 CD1 ILE A 115 12.433 -1.758 1.037 1.00 0.00 C ATOM 0 H ILE A 115 11.743 2.199 2.447 1.00 0.00 H new ATOM 0 HA ILE A 115 9.472 1.230 0.733 1.00 0.00 H new ATOM 0 HB ILE A 115 11.124 -0.301 2.793 1.00 0.00 H new ATOM 0 HG12 ILE A 115 11.106 -0.628 -0.241 1.00 0.00 H new ATOM 0 HG13 ILE A 115 12.297 0.352 0.590 1.00 0.00 H new ATOM 0 HG21 ILE A 115 9.908 -2.259 1.879 1.00 0.00 H new ATOM 0 HG22 ILE A 115 8.777 -1.065 2.559 1.00 0.00 H new ATOM 0 HG23 ILE A 115 8.991 -1.185 0.797 1.00 0.00 H new ATOM 0 HD11 ILE A 115 13.149 -1.951 0.239 1.00 0.00 H new ATOM 0 HD12 ILE A 115 12.967 -1.612 1.976 1.00 0.00 H new ATOM 0 HD13 ILE A 115 11.757 -2.608 1.132 1.00 0.00 H new ATOM 1750 N LYS A 116 7.832 1.529 2.604 1.00 0.00 N ATOM 1751 CA LYS A 116 6.878 1.825 3.710 1.00 0.00 C ATOM 1752 C LYS A 116 5.967 0.615 3.931 1.00 0.00 C ATOM 1753 O LYS A 116 5.330 0.131 3.018 1.00 0.00 O ATOM 1754 CB LYS A 116 6.028 3.043 3.336 1.00 0.00 C ATOM 1755 CG LYS A 116 6.886 4.306 3.416 1.00 0.00 C ATOM 1756 CD LYS A 116 6.018 5.532 3.128 1.00 0.00 C ATOM 1757 CE LYS A 116 6.900 6.781 3.078 1.00 0.00 C ATOM 1758 NZ LYS A 116 7.567 6.866 1.748 1.00 0.00 N ATOM 0 H LYS A 116 7.403 1.369 1.692 1.00 0.00 H new ATOM 0 HA LYS A 116 7.432 2.036 4.625 1.00 0.00 H new ATOM 0 HB2 LYS A 116 5.628 2.925 2.329 1.00 0.00 H new ATOM 0 HB3 LYS A 116 5.176 3.126 4.010 1.00 0.00 H new ATOM 0 HG2 LYS A 116 7.336 4.390 4.405 1.00 0.00 H new ATOM 0 HG3 LYS A 116 7.704 4.249 2.697 1.00 0.00 H new ATOM 0 HD2 LYS A 116 5.494 5.406 2.181 1.00 0.00 H new ATOM 0 HD3 LYS A 116 5.257 5.642 3.901 1.00 0.00 H new ATOM 0 HE2 LYS A 116 6.297 7.672 3.252 1.00 0.00 H new ATOM 0 HE3 LYS A 116 7.648 6.743 3.870 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 8.085 7.765 1.676 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 8.232 6.074 1.642 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 6.850 6.819 0.996 1.00 0.00 H new ATOM 1772 N THR A 117 5.902 0.122 5.138 1.00 0.00 N ATOM 1773 CA THR A 117 5.034 -1.058 5.413 1.00 0.00 C ATOM 1774 C THR A 117 4.080 -0.738 6.565 1.00 0.00 C ATOM 1775 O THR A 117 4.462 -0.144 7.554 1.00 0.00 O ATOM 1776 CB THR A 117 5.908 -2.255 5.795 1.00 0.00 C ATOM 1777 OG1 THR A 117 6.368 -2.096 7.130 1.00 0.00 O ATOM 1778 CG2 THR A 117 7.105 -2.340 4.847 1.00 0.00 C ATOM 0 H THR A 117 6.411 0.485 5.944 1.00 0.00 H new ATOM 0 HA THR A 117 4.456 -1.297 4.520 1.00 0.00 H new ATOM 0 HB THR A 117 5.323 -3.171 5.718 1.00 0.00 H new ATOM 0 HG1 THR A 117 6.926 -2.862 7.377 1.00 0.00 H new ATOM 0 HG21 THR A 117 7.726 -3.193 5.121 1.00 0.00 H new ATOM 0 HG22 THR A 117 6.751 -2.463 3.824 1.00 0.00 H new ATOM 0 HG23 THR A 117 7.693 -1.425 4.920 1.00 0.00 H new ATOM 1786 N THR A 118 2.841 -1.132 6.446 1.00 0.00 N ATOM 1787 CA THR A 118 1.862 -0.855 7.534 1.00 0.00 C ATOM 1788 C THR A 118 1.310 -2.180 8.065 1.00 0.00 C ATOM 1789 O THR A 118 0.971 -3.069 7.308 1.00 0.00 O ATOM 1790 CB THR A 118 0.712 -0.006 6.985 1.00 0.00 C ATOM 1791 OG1 THR A 118 1.238 1.175 6.396 1.00 0.00 O ATOM 1792 CG2 THR A 118 -0.238 0.367 8.123 1.00 0.00 C ATOM 0 H THR A 118 2.465 -1.634 5.642 1.00 0.00 H new ATOM 0 HA THR A 118 2.356 -0.314 8.341 1.00 0.00 H new ATOM 0 HB THR A 118 0.166 -0.575 6.233 1.00 0.00 H new ATOM 0 HG1 THR A 118 0.504 1.719 6.042 1.00 0.00 H new ATOM 0 HG21 THR A 118 -1.056 0.971 7.731 1.00 0.00 H new ATOM 0 HG22 THR A 118 -0.641 -0.540 8.573 1.00 0.00 H new ATOM 0 HG23 THR A 118 0.304 0.937 8.878 1.00 0.00 H new ATOM 1800 N SER A 119 1.219 -2.323 9.359 1.00 0.00 N ATOM 1801 CA SER A 119 0.693 -3.594 9.930 1.00 0.00 C ATOM 1802 C SER A 119 -0.509 -3.297 10.830 1.00 0.00 C ATOM 1803 O SER A 119 -0.505 -2.357 11.600 1.00 0.00 O ATOM 1804 CB SER A 119 1.788 -4.275 10.753 1.00 0.00 C ATOM 1805 OG SER A 119 2.901 -4.559 9.918 1.00 0.00 O ATOM 0 H SER A 119 1.486 -1.616 10.044 1.00 0.00 H new ATOM 0 HA SER A 119 0.383 -4.252 9.118 1.00 0.00 H new ATOM 0 HB2 SER A 119 2.093 -3.630 11.577 1.00 0.00 H new ATOM 0 HB3 SER A 119 1.407 -5.196 11.194 1.00 0.00 H new ATOM 0 HG SER A 119 3.603 -4.994 10.446 1.00 0.00 H new ATOM 1811 N LYS A 120 -1.539 -4.093 10.738 1.00 0.00 N ATOM 1812 CA LYS A 120 -2.742 -3.862 11.587 1.00 0.00 C ATOM 1813 C LYS A 120 -3.334 -5.212 12.001 1.00 0.00 C ATOM 1814 O LYS A 120 -3.476 -6.109 11.195 1.00 0.00 O ATOM 1815 CB LYS A 120 -3.784 -3.070 10.796 1.00 0.00 C ATOM 1816 CG LYS A 120 -4.858 -2.546 11.749 1.00 0.00 C ATOM 1817 CD LYS A 120 -5.945 -1.826 10.949 1.00 0.00 C ATOM 1818 CE LYS A 120 -6.966 -1.214 11.911 1.00 0.00 C ATOM 1819 NZ LYS A 120 -8.245 -0.970 11.188 1.00 0.00 N ATOM 0 H LYS A 120 -1.599 -4.895 10.110 1.00 0.00 H new ATOM 0 HA LYS A 120 -2.458 -3.298 12.475 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -3.307 -2.239 10.276 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -4.237 -3.704 10.034 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -5.293 -3.372 12.312 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -4.414 -1.864 12.474 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -5.500 -1.047 10.330 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -6.439 -2.526 10.275 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -7.135 -1.884 12.754 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -6.582 -0.279 12.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -8.939 -0.554 11.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -8.078 -0.315 10.398 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -8.613 -1.870 10.819 1.00 0.00 H new ATOM 1833 N TYR A 121 -3.675 -5.365 13.251 1.00 0.00 N ATOM 1834 CA TYR A 121 -4.252 -6.659 13.711 1.00 0.00 C ATOM 1835 C TYR A 121 -5.502 -6.393 14.550 1.00 0.00 C ATOM 1836 O TYR A 121 -5.592 -5.408 15.254 1.00 0.00 O ATOM 1837 CB TYR A 121 -3.220 -7.404 14.559 1.00 0.00 C ATOM 1838 CG TYR A 121 -3.042 -6.686 15.874 1.00 0.00 C ATOM 1839 CD1 TYR A 121 -2.155 -5.607 15.969 1.00 0.00 C ATOM 1840 CD2 TYR A 121 -3.763 -7.100 17.000 1.00 0.00 C ATOM 1841 CE1 TYR A 121 -1.991 -4.941 17.189 1.00 0.00 C ATOM 1842 CE2 TYR A 121 -3.599 -6.435 18.221 1.00 0.00 C ATOM 1843 CZ TYR A 121 -2.712 -5.355 18.316 1.00 0.00 C ATOM 1844 OH TYR A 121 -2.550 -4.699 19.519 1.00 0.00 O ATOM 0 H TYR A 121 -3.579 -4.651 13.973 1.00 0.00 H new ATOM 0 HA TYR A 121 -4.519 -7.265 12.845 1.00 0.00 H new ATOM 0 HB2 TYR A 121 -3.547 -8.429 14.733 1.00 0.00 H new ATOM 0 HB3 TYR A 121 -2.269 -7.458 14.030 1.00 0.00 H new ATOM 0 HD1 TYR A 121 -1.597 -5.289 15.101 1.00 0.00 H new ATOM 0 HD2 TYR A 121 -4.446 -7.933 16.927 1.00 0.00 H new ATOM 0 HE1 TYR A 121 -1.308 -4.107 17.261 1.00 0.00 H new ATOM 0 HE2 TYR A 121 -4.156 -6.755 19.089 1.00 0.00 H new ATOM 0 HH TYR A 121 -3.125 -5.112 20.197 1.00 0.00 H new ATOM 1854 N HIS A 122 -6.470 -7.266 14.482 1.00 0.00 N ATOM 1855 CA HIS A 122 -7.711 -7.063 15.279 1.00 0.00 C ATOM 1856 C HIS A 122 -7.758 -8.082 16.419 1.00 0.00 C ATOM 1857 O HIS A 122 -7.109 -9.108 16.373 1.00 0.00 O ATOM 1858 CB HIS A 122 -8.933 -7.248 14.375 1.00 0.00 C ATOM 1859 CG HIS A 122 -8.995 -6.123 13.380 1.00 0.00 C ATOM 1860 ND1 HIS A 122 -9.393 -4.844 13.735 1.00 0.00 N ATOM 1861 CD2 HIS A 122 -8.713 -6.069 12.038 1.00 0.00 C ATOM 1862 CE1 HIS A 122 -9.340 -4.081 12.627 1.00 0.00 C ATOM 1863 NE2 HIS A 122 -8.931 -4.779 11.564 1.00 0.00 N ATOM 0 H HIS A 122 -6.454 -8.110 13.909 1.00 0.00 H new ATOM 0 HA HIS A 122 -7.716 -6.055 15.694 1.00 0.00 H new ATOM 0 HB2 HIS A 122 -8.873 -8.204 13.855 1.00 0.00 H new ATOM 0 HB3 HIS A 122 -9.843 -7.268 14.975 1.00 0.00 H new ATOM 0 HD2 HIS A 122 -8.373 -6.902 11.440 1.00 0.00 H new ATOM 0 HE1 HIS A 122 -9.597 -3.032 12.601 1.00 0.00 H new ATOM 0 HE2 HIS A 122 -8.806 -4.440 10.610 1.00 0.00 H new ATOM 1871 N THR A 123 -8.521 -7.809 17.442 1.00 0.00 N ATOM 1872 CA THR A 123 -8.608 -8.765 18.583 1.00 0.00 C ATOM 1873 C THR A 123 -10.078 -9.014 18.927 1.00 0.00 C ATOM 1874 O THR A 123 -10.950 -8.253 18.556 1.00 0.00 O ATOM 1875 CB THR A 123 -7.893 -8.173 19.800 1.00 0.00 C ATOM 1876 OG1 THR A 123 -8.655 -7.089 20.314 1.00 0.00 O ATOM 1877 CG2 THR A 123 -6.506 -7.675 19.389 1.00 0.00 C ATOM 0 H THR A 123 -9.088 -6.966 17.537 1.00 0.00 H new ATOM 0 HA THR A 123 -8.134 -9.707 18.306 1.00 0.00 H new ATOM 0 HB THR A 123 -7.787 -8.940 20.567 1.00 0.00 H new ATOM 0 HG1 THR A 123 -8.199 -6.710 21.094 1.00 0.00 H new ATOM 0 HG21 THR A 123 -5.999 -7.254 20.257 1.00 0.00 H new ATOM 0 HG22 THR A 123 -5.922 -8.507 18.996 1.00 0.00 H new ATOM 0 HG23 THR A 123 -6.608 -6.908 18.621 1.00 0.00 H new ATOM 2169 N ALA A 142 11.333 -6.683 10.326 1.00 0.00 N ATOM 2170 CA ALA A 142 12.457 -5.852 9.809 1.00 0.00 C ATOM 2171 C ALA A 142 13.622 -6.762 9.418 1.00 0.00 C ATOM 2172 O ALA A 142 14.294 -6.536 8.431 1.00 0.00 O ATOM 2173 CB ALA A 142 12.913 -4.878 10.897 1.00 0.00 C ATOM 0 HA ALA A 142 12.124 -5.291 8.936 1.00 0.00 H new ATOM 0 HB1 ALA A 142 13.735 -4.270 10.520 1.00 0.00 H new ATOM 0 HB2 ALA A 142 12.082 -4.231 11.178 1.00 0.00 H new ATOM 0 HB3 ALA A 142 13.247 -5.438 11.770 1.00 0.00 H new ATOM 2179 N HIS A 143 13.865 -7.792 10.183 1.00 0.00 N ATOM 2180 CA HIS A 143 14.985 -8.717 9.854 1.00 0.00 C ATOM 2181 C HIS A 143 14.756 -9.314 8.464 1.00 0.00 C ATOM 2182 O HIS A 143 15.647 -9.346 7.637 1.00 0.00 O ATOM 2183 CB HIS A 143 15.038 -9.842 10.889 1.00 0.00 C ATOM 2184 CG HIS A 143 15.373 -9.267 12.238 1.00 0.00 C ATOM 2185 ND1 HIS A 143 15.162 -9.969 13.414 1.00 0.00 N ATOM 2186 CD2 HIS A 143 15.906 -8.059 12.613 1.00 0.00 C ATOM 2187 CE1 HIS A 143 15.563 -9.184 14.432 1.00 0.00 C ATOM 2188 NE2 HIS A 143 16.024 -8.008 13.999 1.00 0.00 N ATOM 0 H HIS A 143 13.336 -8.032 11.021 1.00 0.00 H new ATOM 0 HA HIS A 143 15.927 -8.169 9.866 1.00 0.00 H new ATOM 0 HB2 HIS A 143 14.079 -10.358 10.930 1.00 0.00 H new ATOM 0 HB3 HIS A 143 15.786 -10.581 10.601 1.00 0.00 H new ATOM 0 HD2 HIS A 143 16.191 -7.268 11.935 1.00 0.00 H new ATOM 0 HE1 HIS A 143 15.517 -9.471 15.472 1.00 0.00 H new ATOM 0 HE2 HIS A 143 16.385 -7.238 14.562 1.00 0.00 H new ATOM 2196 N LEU A 144 13.569 -9.787 8.200 1.00 0.00 N ATOM 2197 CA LEU A 144 13.285 -10.379 6.863 1.00 0.00 C ATOM 2198 C LEU A 144 13.668 -9.378 5.772 1.00 0.00 C ATOM 2199 O LEU A 144 14.352 -9.708 4.823 1.00 0.00 O ATOM 2200 CB LEU A 144 11.794 -10.706 6.756 1.00 0.00 C ATOM 2201 CG LEU A 144 11.421 -11.731 7.829 1.00 0.00 C ATOM 2202 CD1 LEU A 144 9.973 -12.182 7.622 1.00 0.00 C ATOM 2203 CD2 LEU A 144 12.351 -12.941 7.725 1.00 0.00 C ATOM 0 H LEU A 144 12.784 -9.789 8.852 1.00 0.00 H new ATOM 0 HA LEU A 144 13.866 -11.293 6.738 1.00 0.00 H new ATOM 0 HB2 LEU A 144 11.202 -9.800 6.881 1.00 0.00 H new ATOM 0 HB3 LEU A 144 11.567 -11.101 5.766 1.00 0.00 H new ATOM 0 HG LEU A 144 11.524 -11.278 8.815 1.00 0.00 H new ATOM 0 HD11 LEU A 144 9.707 -12.912 8.386 1.00 0.00 H new ATOM 0 HD12 LEU A 144 9.309 -11.320 7.696 1.00 0.00 H new ATOM 0 HD13 LEU A 144 9.870 -12.635 6.636 1.00 0.00 H new ATOM 0 HD21 LEU A 144 12.085 -13.671 8.489 1.00 0.00 H new ATOM 0 HD22 LEU A 144 12.249 -13.395 6.739 1.00 0.00 H new ATOM 0 HD23 LEU A 144 13.382 -12.621 7.872 1.00 0.00 H new ATOM 2215 N PHE A 145 13.235 -8.153 5.900 1.00 0.00 N ATOM 2216 CA PHE A 145 13.576 -7.131 4.872 1.00 0.00 C ATOM 2217 C PHE A 145 15.094 -7.087 4.684 1.00 0.00 C ATOM 2218 O PHE A 145 15.589 -6.926 3.586 1.00 0.00 O ATOM 2219 CB PHE A 145 13.078 -5.760 5.332 1.00 0.00 C ATOM 2220 CG PHE A 145 11.571 -5.721 5.253 1.00 0.00 C ATOM 2221 CD1 PHE A 145 10.939 -5.555 4.015 1.00 0.00 C ATOM 2222 CD2 PHE A 145 10.805 -5.853 6.417 1.00 0.00 C ATOM 2223 CE1 PHE A 145 9.542 -5.520 3.940 1.00 0.00 C ATOM 2224 CE2 PHE A 145 9.406 -5.818 6.343 1.00 0.00 C ATOM 2225 CZ PHE A 145 8.776 -5.651 5.105 1.00 0.00 C ATOM 0 H PHE A 145 12.660 -7.817 6.672 1.00 0.00 H new ATOM 0 HA PHE A 145 13.100 -7.391 3.927 1.00 0.00 H new ATOM 0 HB2 PHE A 145 13.405 -5.566 6.354 1.00 0.00 H new ATOM 0 HB3 PHE A 145 13.506 -4.977 4.707 1.00 0.00 H new ATOM 0 HD1 PHE A 145 11.530 -5.454 3.117 1.00 0.00 H new ATOM 0 HD2 PHE A 145 11.292 -5.982 7.372 1.00 0.00 H new ATOM 0 HE1 PHE A 145 9.055 -5.392 2.985 1.00 0.00 H new ATOM 0 HE2 PHE A 145 8.815 -5.920 7.241 1.00 0.00 H new ATOM 0 HZ PHE A 145 7.698 -5.623 5.048 1.00 0.00 H new ATOM 2235 N LYS A 146 15.836 -7.231 5.748 1.00 0.00 N ATOM 2236 CA LYS A 146 17.321 -7.200 5.630 1.00 0.00 C ATOM 2237 C LYS A 146 17.778 -8.306 4.678 1.00 0.00 C ATOM 2238 O LYS A 146 18.654 -8.111 3.860 1.00 0.00 O ATOM 2239 CB LYS A 146 17.947 -7.423 7.009 1.00 0.00 C ATOM 2240 CG LYS A 146 19.463 -7.239 6.917 1.00 0.00 C ATOM 2241 CD LYS A 146 20.093 -7.510 8.285 1.00 0.00 C ATOM 2242 CE LYS A 146 21.585 -7.173 8.235 1.00 0.00 C ATOM 2243 NZ LYS A 146 22.281 -7.838 9.372 1.00 0.00 N ATOM 0 H LYS A 146 15.478 -7.369 6.693 1.00 0.00 H new ATOM 0 HA LYS A 146 17.635 -6.232 5.241 1.00 0.00 H new ATOM 0 HB2 LYS A 146 17.528 -6.720 7.729 1.00 0.00 H new ATOM 0 HB3 LYS A 146 17.713 -8.425 7.369 1.00 0.00 H new ATOM 0 HG2 LYS A 146 19.878 -7.918 6.172 1.00 0.00 H new ATOM 0 HG3 LYS A 146 19.698 -6.226 6.591 1.00 0.00 H new ATOM 0 HD2 LYS A 146 19.599 -6.911 9.050 1.00 0.00 H new ATOM 0 HD3 LYS A 146 19.954 -8.555 8.561 1.00 0.00 H new ATOM 0 HE2 LYS A 146 22.012 -7.504 7.289 1.00 0.00 H new ATOM 0 HE3 LYS A 146 21.727 -6.094 8.288 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 23.295 -7.610 9.339 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 21.879 -7.501 10.270 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 22.155 -8.868 9.301 1.00 0.00 H new ATOM 2257 N LEU A 147 17.190 -9.466 4.776 1.00 0.00 N ATOM 2258 CA LEU A 147 17.590 -10.584 3.876 1.00 0.00 C ATOM 2259 C LEU A 147 17.166 -10.256 2.443 1.00 0.00 C ATOM 2260 O LEU A 147 17.865 -10.552 1.495 1.00 0.00 O ATOM 2261 CB LEU A 147 16.908 -11.876 4.329 1.00 0.00 C ATOM 2262 CG LEU A 147 17.547 -12.362 5.632 1.00 0.00 C ATOM 2263 CD1 LEU A 147 19.067 -12.410 5.468 1.00 0.00 C ATOM 2264 CD2 LEU A 147 17.185 -11.403 6.767 1.00 0.00 C ATOM 0 H LEU A 147 16.449 -9.688 5.441 1.00 0.00 H new ATOM 0 HA LEU A 147 18.671 -10.715 3.916 1.00 0.00 H new ATOM 0 HB2 LEU A 147 15.842 -11.704 4.477 1.00 0.00 H new ATOM 0 HB3 LEU A 147 17.004 -12.640 3.558 1.00 0.00 H new ATOM 0 HG LEU A 147 17.176 -13.359 5.868 1.00 0.00 H new ATOM 0 HD11 LEU A 147 19.522 -12.756 6.396 1.00 0.00 H new ATOM 0 HD12 LEU A 147 19.324 -13.095 4.660 1.00 0.00 H new ATOM 0 HD13 LEU A 147 19.439 -11.413 5.231 1.00 0.00 H new ATOM 0 HD21 LEU A 147 17.640 -11.749 7.695 1.00 0.00 H new ATOM 0 HD22 LEU A 147 17.555 -10.405 6.532 1.00 0.00 H new ATOM 0 HD23 LEU A 147 16.102 -11.370 6.884 1.00 0.00 H new ATOM 2276 N ILE A 148 16.025 -9.644 2.278 1.00 0.00 N ATOM 2277 CA ILE A 148 15.559 -9.296 0.906 1.00 0.00 C ATOM 2278 C ILE A 148 16.588 -8.380 0.240 1.00 0.00 C ATOM 2279 O ILE A 148 16.997 -8.603 -0.883 1.00 0.00 O ATOM 2280 CB ILE A 148 14.214 -8.574 0.992 1.00 0.00 C ATOM 2281 CG1 ILE A 148 13.185 -9.489 1.659 1.00 0.00 C ATOM 2282 CG2 ILE A 148 13.738 -8.214 -0.417 1.00 0.00 C ATOM 2283 CD1 ILE A 148 11.877 -8.720 1.862 1.00 0.00 C ATOM 0 H ILE A 148 15.396 -9.370 3.033 1.00 0.00 H new ATOM 0 HA ILE A 148 15.444 -10.206 0.317 1.00 0.00 H new ATOM 0 HB ILE A 148 14.327 -7.664 1.582 1.00 0.00 H new ATOM 0 HG12 ILE A 148 13.010 -10.369 1.041 1.00 0.00 H new ATOM 0 HG13 ILE A 148 13.564 -9.843 2.618 1.00 0.00 H new ATOM 0 HG21 ILE A 148 12.779 -7.699 -0.357 1.00 0.00 H new ATOM 0 HG22 ILE A 148 14.470 -7.562 -0.893 1.00 0.00 H new ATOM 0 HG23 ILE A 148 13.625 -9.124 -1.006 1.00 0.00 H new ATOM 0 HD11 ILE A 148 11.143 -9.370 2.337 1.00 0.00 H new ATOM 0 HD12 ILE A 148 12.059 -7.853 2.497 1.00 0.00 H new ATOM 0 HD13 ILE A 148 11.496 -8.388 0.896 1.00 0.00 H new ATOM 2295 N GLU A 149 17.012 -7.355 0.925 1.00 0.00 N ATOM 2296 CA GLU A 149 18.016 -6.427 0.332 1.00 0.00 C ATOM 2297 C GLU A 149 19.336 -7.173 0.126 1.00 0.00 C ATOM 2298 O GLU A 149 19.941 -7.104 -0.926 1.00 0.00 O ATOM 2299 CB GLU A 149 18.241 -5.247 1.280 1.00 0.00 C ATOM 2300 CG GLU A 149 19.159 -4.223 0.611 1.00 0.00 C ATOM 2301 CD GLU A 149 19.535 -3.136 1.621 1.00 0.00 C ATOM 2302 OE1 GLU A 149 19.089 -3.229 2.753 1.00 0.00 O ATOM 2303 OE2 GLU A 149 20.262 -2.232 1.245 1.00 0.00 O ATOM 0 H GLU A 149 16.707 -7.119 1.869 1.00 0.00 H new ATOM 0 HA GLU A 149 17.651 -6.059 -0.627 1.00 0.00 H new ATOM 0 HB2 GLU A 149 17.287 -4.785 1.535 1.00 0.00 H new ATOM 0 HB3 GLU A 149 18.686 -5.595 2.212 1.00 0.00 H new ATOM 0 HG2 GLU A 149 20.058 -4.714 0.238 1.00 0.00 H new ATOM 0 HG3 GLU A 149 18.659 -3.778 -0.249 1.00 0.00 H new ATOM 2310 N GLY A 150 19.787 -7.886 1.120 1.00 0.00 N ATOM 2311 CA GLY A 150 21.066 -8.637 0.980 1.00 0.00 C ATOM 2312 C GLY A 150 20.887 -9.756 -0.048 1.00 0.00 C ATOM 2313 O GLY A 150 21.801 -10.099 -0.772 1.00 0.00 O ATOM 0 H GLY A 150 19.325 -7.981 2.024 1.00 0.00 H new ATOM 0 HA2 GLY A 150 21.864 -7.964 0.666 1.00 0.00 H new ATOM 0 HA3 GLY A 150 21.362 -9.055 1.942 1.00 0.00 H new ATOM 2317 N TYR A 151 19.716 -10.328 -0.119 1.00 0.00 N ATOM 2318 CA TYR A 151 19.480 -11.423 -1.101 1.00 0.00 C ATOM 2319 C TYR A 151 19.808 -10.922 -2.509 1.00 0.00 C ATOM 2320 O TYR A 151 20.487 -11.581 -3.271 1.00 0.00 O ATOM 2321 CB TYR A 151 18.013 -11.856 -1.041 1.00 0.00 C ATOM 2322 CG TYR A 151 17.805 -13.050 -1.941 1.00 0.00 C ATOM 2323 CD1 TYR A 151 18.005 -14.344 -1.443 1.00 0.00 C ATOM 2324 CD2 TYR A 151 17.413 -12.865 -3.272 1.00 0.00 C ATOM 2325 CE1 TYR A 151 17.811 -15.452 -2.278 1.00 0.00 C ATOM 2326 CE2 TYR A 151 17.221 -13.973 -4.106 1.00 0.00 C ATOM 2327 CZ TYR A 151 17.420 -15.266 -3.609 1.00 0.00 C ATOM 2328 OH TYR A 151 17.230 -16.358 -4.431 1.00 0.00 O ATOM 0 H TYR A 151 18.913 -10.084 0.461 1.00 0.00 H new ATOM 0 HA TYR A 151 20.118 -12.273 -0.859 1.00 0.00 H new ATOM 0 HB2 TYR A 151 17.738 -12.107 -0.016 1.00 0.00 H new ATOM 0 HB3 TYR A 151 17.367 -11.035 -1.352 1.00 0.00 H new ATOM 0 HD1 TYR A 151 18.308 -14.487 -0.416 1.00 0.00 H new ATOM 0 HD2 TYR A 151 17.259 -11.867 -3.656 1.00 0.00 H new ATOM 0 HE1 TYR A 151 17.963 -16.450 -1.895 1.00 0.00 H new ATOM 0 HE2 TYR A 151 16.919 -13.830 -5.133 1.00 0.00 H new ATOM 0 HH TYR A 151 16.959 -16.053 -5.322 1.00 0.00 H new ATOM 2338 N LEU A 152 19.330 -9.760 -2.861 1.00 0.00 N ATOM 2339 CA LEU A 152 19.617 -9.218 -4.220 1.00 0.00 C ATOM 2340 C LEU A 152 21.112 -8.923 -4.345 1.00 0.00 C ATOM 2341 O LEU A 152 21.721 -9.172 -5.367 1.00 0.00 O ATOM 2342 CB LEU A 152 18.824 -7.926 -4.430 1.00 0.00 C ATOM 2343 CG LEU A 152 17.330 -8.209 -4.259 1.00 0.00 C ATOM 2344 CD1 LEU A 152 16.531 -6.944 -4.580 1.00 0.00 C ATOM 2345 CD2 LEU A 152 16.911 -9.332 -5.210 1.00 0.00 C ATOM 0 H LEU A 152 18.754 -9.163 -2.268 1.00 0.00 H new ATOM 0 HA LEU A 152 19.326 -9.951 -4.973 1.00 0.00 H new ATOM 0 HB2 LEU A 152 19.146 -7.169 -3.714 1.00 0.00 H new ATOM 0 HB3 LEU A 152 19.017 -7.526 -5.425 1.00 0.00 H new ATOM 0 HG LEU A 152 17.133 -8.512 -3.231 1.00 0.00 H new ATOM 0 HD11 LEU A 152 15.467 -7.145 -4.458 1.00 0.00 H new ATOM 0 HD12 LEU A 152 16.829 -6.144 -3.902 1.00 0.00 H new ATOM 0 HD13 LEU A 152 16.728 -6.641 -5.608 1.00 0.00 H new ATOM 0 HD21 LEU A 152 15.847 -9.534 -5.088 1.00 0.00 H new ATOM 0 HD22 LEU A 152 17.108 -9.030 -6.239 1.00 0.00 H new ATOM 0 HD23 LEU A 152 17.480 -10.233 -4.981 1.00 0.00 H new