USER MOD reduce.3.24.130724 H: found=0, std=0, add=924, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 920 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 69 GLN : amide:sc= -2.86 K(o=-2.9,f=-7.5!) USER MOD Set 1.2: A 71 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 61 LYS NZ :NH3+ 155:sc= -0.751 (180deg=-1.71) USER MOD Set 2.2: A 108 LYS NZ :NH3+ 173:sc= -0.303 (180deg=-0.11) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0.182 USER MOD Single : A 35 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 36 TYR OH : rot -27:sc= 1.04 USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 LYS NZ :NH3+ -161:sc= -1.17 (180deg=-1.66!) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 43 THR OG1 : rot 150:sc= -1.6! USER MOD Single : A 44 ASN : amide:sc= -0.171 K(o=-0.17,f=-1.5!) USER MOD Single : A 46 THR OG1 : rot -85:sc= 1.52 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 50 ASN :FLIP amide:sc= -0.412 F(o=-1.3,f=-0.41) USER MOD Single : A 52 TYR OH : rot -19:sc= 0.674 USER MOD Single : A 54 ASN : amide:sc= -0.161 K(o=-0.16,f=-0.99) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 LYS NZ :NH3+ -145:sc= -0.0869 (180deg=-0.622) USER MOD Single : A 63 ASN : amide:sc= -0.0368 K(o=-0.037,f=-2.3!) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 73 ASN : amide:sc= -0.0267 X(o=-0.027,f=0) USER MOD Single : A 74 HIS : no HD1:sc= -0.648 X(o=-0.65,f=-0.26) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 76 HIS : no HD1:sc= -0.105 X(o=-0.1,f=-0.00062) USER MOD Single : A 79 THR OG1 : rot -160:sc= -0.361 USER MOD Single : A 81 MET CE :methyl -165:sc= -3.97! (180deg=-4.64!) USER MOD Single : A 82 SER OG : rot 180:sc= -0.438 USER MOD Single : A 86 HIS :FLIP no HE2:sc= -4.71! C(o=-5.6!,f=-4.7!) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 ASN : amide:sc= -0.0275 X(o=-0.028,f=0) USER MOD Single : A 92 SER OG : rot 44:sc= 1.18 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 ASN :FLIP amide:sc= -0.649 F(o=-1.8!,f=-0.65) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 THR OG1 : rot 180:sc= -0.0245 USER MOD Single : A 102 SER OG : rot 105:sc= 1.23 USER MOD Single : A 107 SER OG : rot 180:sc= 0.161 USER MOD Single : A 110 ASN : amide:sc= -0.76 K(o=-0.76,f=-1.7) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 ASN : amide:sc= -0.577 X(o=-0.58,f=-0.079) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 TYR OH : rot -61:sc= 1.46 USER MOD Single : A 134 HIS : no HD1:sc= 0 X(o=0,f=-0.19) USER MOD Single : A 135 HIS : no HE2:sc= -1.55 K(o=-1.5,f=-2.1) USER MOD Single : A 136 TYR OH : rot 180:sc= 0 USER MOD Single : A 137 ASN : amide:sc= -6.38! C(o=-6.4!,f=-8.5!) USER MOD Single : A 139 THR OG1 : rot -16:sc= 0.517 USER MOD Single : A 140 TYR OH : rot 180:sc= 0 USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 ASN :FLIP amide:sc= -1.22 F(o=-3.3!,f=-1.2) USER MOD ----------------------------------------------------------------- ATOM 56 N ASP A 30 111.918 -4.372 16.240 1.00 0.00 N ATOM 57 CA ASP A 30 113.311 -3.862 16.077 1.00 0.00 C ATOM 58 C ASP A 30 113.778 -4.058 14.636 1.00 0.00 C ATOM 59 O ASP A 30 114.951 -4.223 14.376 1.00 0.00 O ATOM 60 CB ASP A 30 114.162 -4.708 17.020 1.00 0.00 C ATOM 61 CG ASP A 30 113.350 -5.065 18.268 1.00 0.00 C ATOM 62 OD1 ASP A 30 112.593 -4.222 18.719 1.00 0.00 O ATOM 63 OD2 ASP A 30 113.502 -6.176 18.751 1.00 0.00 O ATOM 0 HA ASP A 30 113.384 -2.798 16.302 1.00 0.00 H new ATOM 0 HB2 ASP A 30 114.488 -5.617 16.514 1.00 0.00 H new ATOM 0 HB3 ASP A 30 115.061 -4.161 17.304 1.00 0.00 H new ATOM 68 N SER A 31 112.872 -4.053 13.697 1.00 0.00 N ATOM 69 CA SER A 31 113.273 -4.246 12.276 1.00 0.00 C ATOM 70 C SER A 31 112.177 -3.726 11.340 1.00 0.00 C ATOM 71 O SER A 31 111.001 -3.843 11.622 1.00 0.00 O ATOM 72 CB SER A 31 113.448 -5.755 12.126 1.00 0.00 C ATOM 73 OG SER A 31 112.298 -6.303 11.494 1.00 0.00 O ATOM 0 H SER A 31 111.872 -3.924 13.853 1.00 0.00 H new ATOM 0 HA SER A 31 114.183 -3.703 12.020 1.00 0.00 H new ATOM 0 HB2 SER A 31 114.339 -5.972 11.537 1.00 0.00 H new ATOM 0 HB3 SER A 31 113.593 -6.214 13.104 1.00 0.00 H new ATOM 0 HG SER A 31 112.409 -7.272 11.395 1.00 0.00 H new ATOM 79 N GLY A 32 112.551 -3.154 10.227 1.00 0.00 N ATOM 80 CA GLY A 32 111.526 -2.630 9.279 1.00 0.00 C ATOM 81 C GLY A 32 112.216 -1.873 8.142 1.00 0.00 C ATOM 82 O GLY A 32 113.426 -1.804 8.074 1.00 0.00 O ATOM 0 H GLY A 32 113.520 -3.027 9.934 1.00 0.00 H new ATOM 0 HA2 GLY A 32 110.935 -3.452 8.876 1.00 0.00 H new ATOM 0 HA3 GLY A 32 110.836 -1.969 9.803 1.00 0.00 H new ATOM 86 N THR A 33 111.452 -1.306 7.248 1.00 0.00 N ATOM 87 CA THR A 33 112.063 -0.552 6.113 1.00 0.00 C ATOM 88 C THR A 33 112.293 0.910 6.507 1.00 0.00 C ATOM 89 O THR A 33 111.365 1.685 6.634 1.00 0.00 O ATOM 90 CB THR A 33 111.042 -0.651 4.979 1.00 0.00 C ATOM 91 OG1 THR A 33 109.799 -1.100 5.500 1.00 0.00 O ATOM 92 CG2 THR A 33 111.543 -1.639 3.924 1.00 0.00 C ATOM 0 H THR A 33 110.432 -1.331 7.253 1.00 0.00 H new ATOM 0 HA THR A 33 113.034 -0.955 5.824 1.00 0.00 H new ATOM 0 HB THR A 33 110.911 0.330 4.521 1.00 0.00 H new ATOM 0 HG1 THR A 33 109.143 -1.162 4.774 1.00 0.00 H new ATOM 0 HG21 THR A 33 110.815 -1.709 3.116 1.00 0.00 H new ATOM 0 HG22 THR A 33 112.496 -1.292 3.524 1.00 0.00 H new ATOM 0 HG23 THR A 33 111.676 -2.621 4.379 1.00 0.00 H new ATOM 100 N LEU A 34 113.525 1.289 6.698 1.00 0.00 N ATOM 101 CA LEU A 34 113.833 2.697 7.082 1.00 0.00 C ATOM 102 C LEU A 34 114.165 3.518 5.832 1.00 0.00 C ATOM 103 O LEU A 34 114.681 3.001 4.861 1.00 0.00 O ATOM 104 CB LEU A 34 115.057 2.577 7.991 1.00 0.00 C ATOM 105 CG LEU A 34 114.979 3.595 9.130 1.00 0.00 C ATOM 106 CD1 LEU A 34 115.016 5.008 8.551 1.00 0.00 C ATOM 107 CD2 LEU A 34 113.679 3.396 9.914 1.00 0.00 C ATOM 0 H LEU A 34 114.338 0.681 6.604 1.00 0.00 H new ATOM 0 HA LEU A 34 112.999 3.197 7.575 1.00 0.00 H new ATOM 0 HB2 LEU A 34 115.116 1.568 8.400 1.00 0.00 H new ATOM 0 HB3 LEU A 34 115.966 2.740 7.411 1.00 0.00 H new ATOM 0 HG LEU A 34 115.827 3.453 9.800 1.00 0.00 H new ATOM 0 HD11 LEU A 34 114.960 5.735 9.361 1.00 0.00 H new ATOM 0 HD12 LEU A 34 115.945 5.151 7.999 1.00 0.00 H new ATOM 0 HD13 LEU A 34 114.169 5.148 7.879 1.00 0.00 H new ATOM 0 HD21 LEU A 34 113.628 4.123 10.724 1.00 0.00 H new ATOM 0 HD22 LEU A 34 112.827 3.534 9.248 1.00 0.00 H new ATOM 0 HD23 LEU A 34 113.655 2.388 10.329 1.00 0.00 H new ATOM 119 N ASN A 35 113.881 4.794 5.844 1.00 0.00 N ATOM 120 CA ASN A 35 114.195 5.630 4.649 1.00 0.00 C ATOM 121 C ASN A 35 115.684 5.976 4.639 1.00 0.00 C ATOM 122 O ASN A 35 116.273 6.234 5.668 1.00 0.00 O ATOM 123 CB ASN A 35 113.348 6.894 4.811 1.00 0.00 C ATOM 124 CG ASN A 35 112.092 6.788 3.944 1.00 0.00 C ATOM 125 OD1 ASN A 35 112.157 6.942 2.740 1.00 0.00 O ATOM 126 ND2 ASN A 35 110.944 6.528 4.507 1.00 0.00 N ATOM 0 H ASN A 35 113.449 5.290 6.623 1.00 0.00 H new ATOM 0 HA ASN A 35 113.976 5.118 3.712 1.00 0.00 H new ATOM 0 HB2 ASN A 35 113.070 7.025 5.857 1.00 0.00 H new ATOM 0 HB3 ASN A 35 113.927 7.771 4.523 1.00 0.00 H new ATOM 0 HD21 ASN A 35 110.101 6.454 3.937 1.00 0.00 H new ATOM 0 HD22 ASN A 35 110.889 6.399 5.517 1.00 0.00 H new ATOM 133 N TYR A 36 116.300 5.981 3.491 1.00 0.00 N ATOM 134 CA TYR A 36 117.751 6.313 3.433 1.00 0.00 C ATOM 135 C TYR A 36 118.177 6.612 1.993 1.00 0.00 C ATOM 136 O TYR A 36 117.553 6.175 1.047 1.00 0.00 O ATOM 137 CB TYR A 36 118.463 5.065 3.953 1.00 0.00 C ATOM 138 CG TYR A 36 118.752 4.140 2.798 1.00 0.00 C ATOM 139 CD1 TYR A 36 117.702 3.673 1.998 1.00 0.00 C ATOM 140 CD2 TYR A 36 120.068 3.751 2.523 1.00 0.00 C ATOM 141 CE1 TYR A 36 117.968 2.817 0.923 1.00 0.00 C ATOM 142 CE2 TYR A 36 120.334 2.895 1.447 1.00 0.00 C ATOM 143 CZ TYR A 36 119.285 2.427 0.648 1.00 0.00 C ATOM 144 OH TYR A 36 119.549 1.585 -0.412 1.00 0.00 O ATOM 0 H TYR A 36 115.864 5.771 2.593 1.00 0.00 H new ATOM 0 HA TYR A 36 117.992 7.198 4.021 1.00 0.00 H new ATOM 0 HB2 TYR A 36 119.391 5.343 4.452 1.00 0.00 H new ATOM 0 HB3 TYR A 36 117.842 4.559 4.693 1.00 0.00 H new ATOM 0 HD1 TYR A 36 116.687 3.973 2.210 1.00 0.00 H new ATOM 0 HD2 TYR A 36 120.878 4.111 3.140 1.00 0.00 H new ATOM 0 HE1 TYR A 36 117.158 2.457 0.306 1.00 0.00 H new ATOM 0 HE2 TYR A 36 121.350 2.596 1.234 1.00 0.00 H new ATOM 0 HH TYR A 36 118.762 1.029 -0.592 1.00 0.00 H new ATOM 154 N GLU A 37 119.238 7.351 1.824 1.00 0.00 N ATOM 155 CA GLU A 37 119.715 7.679 0.450 1.00 0.00 C ATOM 156 C GLU A 37 121.212 7.997 0.479 1.00 0.00 C ATOM 157 O GLU A 37 121.855 7.890 1.503 1.00 0.00 O ATOM 158 CB GLU A 37 118.911 8.913 0.035 1.00 0.00 C ATOM 159 CG GLU A 37 118.465 8.769 -1.421 1.00 0.00 C ATOM 160 CD GLU A 37 117.830 10.077 -1.893 1.00 0.00 C ATOM 161 OE1 GLU A 37 117.079 10.657 -1.126 1.00 0.00 O ATOM 162 OE2 GLU A 37 118.105 10.477 -3.012 1.00 0.00 O ATOM 0 H GLU A 37 119.798 7.744 2.581 1.00 0.00 H new ATOM 0 HA GLU A 37 119.577 6.852 -0.247 1.00 0.00 H new ATOM 0 HB2 GLU A 37 118.042 9.028 0.683 1.00 0.00 H new ATOM 0 HB3 GLU A 37 119.517 9.811 0.153 1.00 0.00 H new ATOM 0 HG2 GLU A 37 119.319 8.519 -2.051 1.00 0.00 H new ATOM 0 HG3 GLU A 37 117.750 7.951 -1.514 1.00 0.00 H new ATOM 169 N VAL A 38 121.774 8.387 -0.633 1.00 0.00 N ATOM 170 CA VAL A 38 123.229 8.710 -0.653 1.00 0.00 C ATOM 171 C VAL A 38 123.496 9.921 -1.552 1.00 0.00 C ATOM 172 O VAL A 38 122.614 10.410 -2.229 1.00 0.00 O ATOM 173 CB VAL A 38 123.910 7.463 -1.216 1.00 0.00 C ATOM 174 CG1 VAL A 38 124.228 6.497 -0.074 1.00 0.00 C ATOM 175 CG2 VAL A 38 122.978 6.777 -2.217 1.00 0.00 C ATOM 0 H VAL A 38 121.291 8.496 -1.525 1.00 0.00 H new ATOM 0 HA VAL A 38 123.604 8.965 0.338 1.00 0.00 H new ATOM 0 HB VAL A 38 124.833 7.751 -1.719 1.00 0.00 H new ATOM 0 HG11 VAL A 38 124.714 5.607 -0.475 1.00 0.00 H new ATOM 0 HG12 VAL A 38 124.893 6.983 0.639 1.00 0.00 H new ATOM 0 HG13 VAL A 38 123.304 6.211 0.428 1.00 0.00 H new ATOM 0 HG21 VAL A 38 123.465 5.888 -2.618 1.00 0.00 H new ATOM 0 HG22 VAL A 38 122.054 6.490 -1.716 1.00 0.00 H new ATOM 0 HG23 VAL A 38 122.750 7.464 -3.032 1.00 0.00 H new ATOM 185 N TYR A 39 124.708 10.405 -1.561 1.00 0.00 N ATOM 186 CA TYR A 39 125.038 11.582 -2.415 1.00 0.00 C ATOM 187 C TYR A 39 126.487 11.488 -2.896 1.00 0.00 C ATOM 188 O TYR A 39 127.293 10.773 -2.335 1.00 0.00 O ATOM 189 CB TYR A 39 124.852 12.798 -1.505 1.00 0.00 C ATOM 190 CG TYR A 39 123.382 13.000 -1.224 1.00 0.00 C ATOM 191 CD1 TYR A 39 122.518 13.375 -2.259 1.00 0.00 C ATOM 192 CD2 TYR A 39 122.885 12.815 0.072 1.00 0.00 C ATOM 193 CE1 TYR A 39 121.156 13.566 -1.999 1.00 0.00 C ATOM 194 CE2 TYR A 39 121.522 13.006 0.332 1.00 0.00 C ATOM 195 CZ TYR A 39 120.657 13.381 -0.703 1.00 0.00 C ATOM 196 OH TYR A 39 119.314 13.567 -0.447 1.00 0.00 O ATOM 0 H TYR A 39 125.485 10.036 -1.013 1.00 0.00 H new ATOM 0 HA TYR A 39 124.409 11.640 -3.303 1.00 0.00 H new ATOM 0 HB2 TYR A 39 125.394 12.652 -0.571 1.00 0.00 H new ATOM 0 HB3 TYR A 39 125.267 13.687 -1.980 1.00 0.00 H new ATOM 0 HD1 TYR A 39 122.902 13.517 -3.258 1.00 0.00 H new ATOM 0 HD2 TYR A 39 123.552 12.525 0.870 1.00 0.00 H new ATOM 0 HE1 TYR A 39 120.489 13.856 -2.798 1.00 0.00 H new ATOM 0 HE2 TYR A 39 121.138 12.864 1.331 1.00 0.00 H new ATOM 0 HH TYR A 39 119.135 13.397 0.501 1.00 0.00 H new ATOM 206 N LYS A 40 126.824 12.206 -3.931 1.00 0.00 N ATOM 207 CA LYS A 40 128.221 12.160 -4.446 1.00 0.00 C ATOM 208 C LYS A 40 129.172 12.790 -3.427 1.00 0.00 C ATOM 209 O LYS A 40 128.916 13.858 -2.905 1.00 0.00 O ATOM 210 CB LYS A 40 128.194 12.978 -5.738 1.00 0.00 C ATOM 211 CG LYS A 40 129.584 12.970 -6.378 1.00 0.00 C ATOM 212 CD LYS A 40 129.716 11.752 -7.296 1.00 0.00 C ATOM 213 CE LYS A 40 130.030 10.512 -6.456 1.00 0.00 C ATOM 214 NZ LYS A 40 128.770 9.720 -6.454 1.00 0.00 N ATOM 0 H LYS A 40 126.193 12.823 -4.442 1.00 0.00 H new ATOM 0 HA LYS A 40 128.569 11.142 -4.620 1.00 0.00 H new ATOM 0 HB2 LYS A 40 127.462 12.561 -6.429 1.00 0.00 H new ATOM 0 HB3 LYS A 40 127.886 14.002 -5.526 1.00 0.00 H new ATOM 0 HG2 LYS A 40 129.739 13.886 -6.947 1.00 0.00 H new ATOM 0 HG3 LYS A 40 130.352 12.941 -5.605 1.00 0.00 H new ATOM 0 HD2 LYS A 40 128.792 11.602 -7.854 1.00 0.00 H new ATOM 0 HD3 LYS A 40 130.507 11.919 -8.028 1.00 0.00 H new ATOM 0 HE2 LYS A 40 130.854 9.942 -6.886 1.00 0.00 H new ATOM 0 HE3 LYS A 40 130.326 10.786 -5.443 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 128.787 9.043 -5.664 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 127.958 10.360 -6.344 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 128.684 9.202 -7.352 1.00 0.00 H new ATOM 228 N TYR A 41 130.265 12.141 -3.133 1.00 0.00 N ATOM 229 CA TYR A 41 131.222 12.713 -2.143 1.00 0.00 C ATOM 230 C TYR A 41 131.678 14.102 -2.596 1.00 0.00 C ATOM 231 O TYR A 41 131.801 14.368 -3.776 1.00 0.00 O ATOM 232 CB TYR A 41 132.397 11.736 -2.107 1.00 0.00 C ATOM 233 CG TYR A 41 132.697 11.371 -0.672 1.00 0.00 C ATOM 234 CD1 TYR A 41 131.661 10.949 0.171 1.00 0.00 C ATOM 235 CD2 TYR A 41 134.006 11.455 -0.185 1.00 0.00 C ATOM 236 CE1 TYR A 41 131.935 10.612 1.502 1.00 0.00 C ATOM 237 CE2 TYR A 41 134.280 11.118 1.147 1.00 0.00 C ATOM 238 CZ TYR A 41 133.244 10.696 1.990 1.00 0.00 C ATOM 239 OH TYR A 41 133.515 10.365 3.302 1.00 0.00 O ATOM 0 H TYR A 41 130.536 11.243 -3.533 1.00 0.00 H new ATOM 0 HA TYR A 41 130.774 12.834 -1.157 1.00 0.00 H new ATOM 0 HB2 TYR A 41 132.158 10.840 -2.680 1.00 0.00 H new ATOM 0 HB3 TYR A 41 133.274 12.187 -2.571 1.00 0.00 H new ATOM 0 HD1 TYR A 41 130.651 10.884 -0.206 1.00 0.00 H new ATOM 0 HD2 TYR A 41 134.805 11.779 -0.836 1.00 0.00 H new ATOM 0 HE1 TYR A 41 131.136 10.287 2.152 1.00 0.00 H new ATOM 0 HE2 TYR A 41 135.290 11.184 1.524 1.00 0.00 H new ATOM 0 HH TYR A 41 134.473 10.478 3.477 1.00 0.00 H new ATOM 249 N ASN A 42 131.915 14.987 -1.661 1.00 0.00 N ATOM 250 CA ASN A 42 132.354 16.377 -2.008 1.00 0.00 C ATOM 251 C ASN A 42 131.203 17.179 -2.636 1.00 0.00 C ATOM 252 O ASN A 42 131.374 18.318 -3.021 1.00 0.00 O ATOM 253 CB ASN A 42 133.505 16.211 -3.004 1.00 0.00 C ATOM 254 CG ASN A 42 134.631 17.184 -2.647 1.00 0.00 C ATOM 255 OD1 ASN A 42 135.459 16.892 -1.809 1.00 0.00 O ATOM 256 ND2 ASN A 42 134.696 18.337 -3.255 1.00 0.00 N ATOM 0 H ASN A 42 131.823 14.806 -0.661 1.00 0.00 H new ATOM 0 HA ASN A 42 132.665 16.928 -1.121 1.00 0.00 H new ATOM 0 HB2 ASN A 42 133.875 15.186 -2.982 1.00 0.00 H new ATOM 0 HB3 ASN A 42 133.153 16.401 -4.018 1.00 0.00 H new ATOM 0 HD21 ASN A 42 135.443 18.993 -3.026 1.00 0.00 H new ATOM 0 HD22 ASN A 42 134.000 18.582 -3.959 1.00 0.00 H new ATOM 263 N THR A 43 130.028 16.607 -2.732 1.00 0.00 N ATOM 264 CA THR A 43 128.879 17.355 -3.320 1.00 0.00 C ATOM 265 C THR A 43 127.629 17.142 -2.462 1.00 0.00 C ATOM 266 O THR A 43 127.708 16.687 -1.337 1.00 0.00 O ATOM 267 CB THR A 43 128.676 16.768 -4.721 1.00 0.00 C ATOM 268 OG1 THR A 43 127.492 15.984 -4.738 1.00 0.00 O ATOM 269 CG2 THR A 43 129.871 15.892 -5.100 1.00 0.00 C ATOM 0 H THR A 43 129.817 15.656 -2.429 1.00 0.00 H new ATOM 0 HA THR A 43 129.066 18.428 -3.362 1.00 0.00 H new ATOM 0 HB THR A 43 128.588 17.583 -5.440 1.00 0.00 H new ATOM 0 HG1 THR A 43 127.097 16.008 -5.634 1.00 0.00 H new ATOM 0 HG21 THR A 43 129.718 15.479 -6.097 1.00 0.00 H new ATOM 0 HG22 THR A 43 130.780 16.493 -5.092 1.00 0.00 H new ATOM 0 HG23 THR A 43 129.968 15.078 -4.381 1.00 0.00 H new ATOM 277 N ASN A 44 126.476 17.459 -2.983 1.00 0.00 N ATOM 278 CA ASN A 44 125.226 17.266 -2.195 1.00 0.00 C ATOM 279 C ASN A 44 124.170 16.545 -3.041 1.00 0.00 C ATOM 280 O ASN A 44 123.005 16.510 -2.697 1.00 0.00 O ATOM 281 CB ASN A 44 124.758 18.678 -1.844 1.00 0.00 C ATOM 282 CG ASN A 44 124.445 18.753 -0.348 1.00 0.00 C ATOM 283 OD1 ASN A 44 124.155 17.751 0.275 1.00 0.00 O ATOM 284 ND2 ASN A 44 124.493 19.906 0.259 1.00 0.00 N ATOM 0 H ASN A 44 126.345 17.843 -3.919 1.00 0.00 H new ATOM 0 HA ASN A 44 125.389 16.657 -1.306 1.00 0.00 H new ATOM 0 HB2 ASN A 44 125.530 19.403 -2.102 1.00 0.00 H new ATOM 0 HB3 ASN A 44 123.872 18.934 -2.425 1.00 0.00 H new ATOM 0 HD21 ASN A 44 124.287 19.966 1.256 1.00 0.00 H new ATOM 0 HD22 ASN A 44 124.736 20.748 -0.263 1.00 0.00 H new ATOM 291 N ASP A 45 124.565 15.968 -4.146 1.00 0.00 N ATOM 292 CA ASP A 45 123.579 15.253 -5.005 1.00 0.00 C ATOM 293 C ASP A 45 124.141 13.900 -5.450 1.00 0.00 C ATOM 294 O ASP A 45 125.281 13.795 -5.855 1.00 0.00 O ATOM 295 CB ASP A 45 123.371 16.167 -6.213 1.00 0.00 C ATOM 296 CG ASP A 45 122.014 16.862 -6.101 1.00 0.00 C ATOM 297 OD1 ASP A 45 121.736 17.411 -5.047 1.00 0.00 O ATOM 298 OD2 ASP A 45 121.274 16.834 -7.071 1.00 0.00 O ATOM 0 H ASP A 45 125.526 15.962 -4.489 1.00 0.00 H new ATOM 0 HA ASP A 45 122.647 15.050 -4.478 1.00 0.00 H new ATOM 0 HB2 ASP A 45 124.168 16.909 -6.262 1.00 0.00 H new ATOM 0 HB3 ASP A 45 123.419 15.586 -7.134 1.00 0.00 H new ATOM 303 N THR A 46 123.346 12.867 -5.386 1.00 0.00 N ATOM 304 CA THR A 46 123.835 11.527 -5.816 1.00 0.00 C ATOM 305 C THR A 46 124.061 11.530 -7.328 1.00 0.00 C ATOM 306 O THR A 46 123.238 12.010 -8.084 1.00 0.00 O ATOM 307 CB THR A 46 122.718 10.558 -5.436 1.00 0.00 C ATOM 308 OG1 THR A 46 121.768 11.232 -4.623 1.00 0.00 O ATOM 309 CG2 THR A 46 123.305 9.375 -4.665 1.00 0.00 C ATOM 0 H THR A 46 122.381 12.893 -5.055 1.00 0.00 H new ATOM 0 HA THR A 46 124.780 11.251 -5.348 1.00 0.00 H new ATOM 0 HB THR A 46 122.230 10.192 -6.339 1.00 0.00 H new ATOM 0 HG1 THR A 46 122.059 11.203 -3.688 1.00 0.00 H new ATOM 0 HG21 THR A 46 122.506 8.684 -4.395 1.00 0.00 H new ATOM 0 HG22 THR A 46 124.034 8.859 -5.290 1.00 0.00 H new ATOM 0 HG23 THR A 46 123.794 9.737 -3.760 1.00 0.00 H new ATOM 317 N SER A 47 125.174 11.025 -7.780 1.00 0.00 N ATOM 318 CA SER A 47 125.437 11.039 -9.249 1.00 0.00 C ATOM 319 C SER A 47 125.851 9.658 -9.777 1.00 0.00 C ATOM 320 O SER A 47 125.806 9.409 -10.966 1.00 0.00 O ATOM 321 CB SER A 47 126.592 12.022 -9.404 1.00 0.00 C ATOM 322 OG SER A 47 126.263 12.985 -10.397 1.00 0.00 O ATOM 0 H SER A 47 125.906 10.607 -7.206 1.00 0.00 H new ATOM 0 HA SER A 47 124.546 11.315 -9.813 1.00 0.00 H new ATOM 0 HB2 SER A 47 126.792 12.517 -8.454 1.00 0.00 H new ATOM 0 HB3 SER A 47 127.501 11.490 -9.684 1.00 0.00 H new ATOM 0 HG SER A 47 127.004 13.619 -10.496 1.00 0.00 H new ATOM 328 N ILE A 48 126.261 8.760 -8.926 1.00 0.00 N ATOM 329 CA ILE A 48 126.676 7.414 -9.427 1.00 0.00 C ATOM 330 C ILE A 48 126.128 6.300 -8.533 1.00 0.00 C ATOM 331 O ILE A 48 125.420 5.419 -8.979 1.00 0.00 O ATOM 332 CB ILE A 48 128.205 7.433 -9.381 1.00 0.00 C ATOM 333 CG1 ILE A 48 128.718 8.683 -10.099 1.00 0.00 C ATOM 334 CG2 ILE A 48 128.752 6.187 -10.079 1.00 0.00 C ATOM 335 CD1 ILE A 48 130.247 8.650 -10.151 1.00 0.00 C ATOM 0 H ILE A 48 126.328 8.894 -7.917 1.00 0.00 H new ATOM 0 HA ILE A 48 126.292 7.219 -10.429 1.00 0.00 H new ATOM 0 HB ILE A 48 128.538 7.444 -8.343 1.00 0.00 H new ATOM 0 HG12 ILE A 48 128.310 8.729 -11.109 1.00 0.00 H new ATOM 0 HG13 ILE A 48 128.380 9.579 -9.578 1.00 0.00 H new ATOM 0 HG21 ILE A 48 129.841 6.200 -10.046 1.00 0.00 H new ATOM 0 HG22 ILE A 48 128.385 5.295 -9.572 1.00 0.00 H new ATOM 0 HG23 ILE A 48 128.420 6.176 -11.117 1.00 0.00 H new ATOM 0 HD11 ILE A 48 130.613 9.540 -10.662 1.00 0.00 H new ATOM 0 HD12 ILE A 48 130.645 8.625 -9.137 1.00 0.00 H new ATOM 0 HD13 ILE A 48 130.574 7.761 -10.691 1.00 0.00 H new ATOM 347 N ALA A 49 126.470 6.327 -7.276 1.00 0.00 N ATOM 348 CA ALA A 49 125.999 5.267 -6.340 1.00 0.00 C ATOM 349 C ALA A 49 124.474 5.308 -6.168 1.00 0.00 C ATOM 350 O ALA A 49 123.887 4.418 -5.586 1.00 0.00 O ATOM 351 CB ALA A 49 126.699 5.592 -5.021 1.00 0.00 C ATOM 0 H ALA A 49 127.060 7.043 -6.853 1.00 0.00 H new ATOM 0 HA ALA A 49 126.230 4.266 -6.705 1.00 0.00 H new ATOM 0 HB1 ALA A 49 126.411 4.860 -4.266 1.00 0.00 H new ATOM 0 HB2 ALA A 49 127.779 5.560 -5.165 1.00 0.00 H new ATOM 0 HB3 ALA A 49 126.407 6.589 -4.690 1.00 0.00 H new ATOM 357 N ASN A 50 123.825 6.328 -6.659 1.00 0.00 N ATOM 358 CA ASN A 50 122.341 6.407 -6.508 1.00 0.00 C ATOM 359 C ASN A 50 121.644 5.449 -7.479 1.00 0.00 C ATOM 360 O ASN A 50 120.487 5.120 -7.313 1.00 0.00 O ATOM 361 CB ASN A 50 121.987 7.853 -6.845 1.00 0.00 C ATOM 362 CG ASN A 50 120.982 7.879 -7.999 1.00 0.00 C ATOM 363 OD1 ASN A 50 119.739 7.559 -7.770 1.00 0.00 O flip ATOM 364 ND2 ASN A 50 121.333 8.195 -9.117 1.00 0.00 N flip ATOM 0 H ASN A 50 124.254 7.108 -7.157 1.00 0.00 H new ATOM 0 HA ASN A 50 122.019 6.125 -5.505 1.00 0.00 H new ATOM 0 HB2 ASN A 50 121.565 8.348 -5.970 1.00 0.00 H new ATOM 0 HB3 ASN A 50 122.886 8.404 -7.120 1.00 0.00 H new ATOM 0 HD21 ASN A 50 122.306 8.445 -9.295 1.00 0.00 H new ATOM 0 HD22 ASN A 50 120.655 8.211 -9.879 1.00 0.00 H new ATOM 371 N ASP A 51 122.332 5.007 -8.494 1.00 0.00 N ATOM 372 CA ASP A 51 121.696 4.080 -9.475 1.00 0.00 C ATOM 373 C ASP A 51 122.142 2.635 -9.224 1.00 0.00 C ATOM 374 O ASP A 51 121.970 1.772 -10.063 1.00 0.00 O ATOM 375 CB ASP A 51 122.183 4.561 -10.841 1.00 0.00 C ATOM 376 CG ASP A 51 121.237 5.638 -11.372 1.00 0.00 C ATOM 377 OD1 ASP A 51 120.203 5.846 -10.757 1.00 0.00 O ATOM 378 OD2 ASP A 51 121.560 6.238 -12.384 1.00 0.00 O ATOM 0 H ASP A 51 123.305 5.246 -8.688 1.00 0.00 H new ATOM 0 HA ASP A 51 120.609 4.087 -9.399 1.00 0.00 H new ATOM 0 HB2 ASP A 51 123.194 4.959 -10.758 1.00 0.00 H new ATOM 0 HB3 ASP A 51 122.226 3.724 -11.538 1.00 0.00 H new ATOM 383 N TYR A 52 122.713 2.360 -8.082 1.00 0.00 N ATOM 384 CA TYR A 52 123.167 0.967 -7.798 1.00 0.00 C ATOM 385 C TYR A 52 122.638 0.482 -6.439 1.00 0.00 C ATOM 386 O TYR A 52 122.945 -0.610 -6.001 1.00 0.00 O ATOM 387 CB TYR A 52 124.693 1.049 -7.783 1.00 0.00 C ATOM 388 CG TYR A 52 125.198 1.269 -9.191 1.00 0.00 C ATOM 389 CD1 TYR A 52 124.955 0.308 -10.180 1.00 0.00 C ATOM 390 CD2 TYR A 52 125.906 2.435 -9.507 1.00 0.00 C ATOM 391 CE1 TYR A 52 125.421 0.512 -11.485 1.00 0.00 C ATOM 392 CE2 TYR A 52 126.372 2.638 -10.812 1.00 0.00 C ATOM 393 CZ TYR A 52 126.129 1.677 -11.801 1.00 0.00 C ATOM 394 OH TYR A 52 126.590 1.879 -13.087 1.00 0.00 O ATOM 0 H TYR A 52 122.884 3.035 -7.337 1.00 0.00 H new ATOM 0 HA TYR A 52 122.798 0.259 -8.540 1.00 0.00 H new ATOM 0 HB2 TYR A 52 125.018 1.864 -7.137 1.00 0.00 H new ATOM 0 HB3 TYR A 52 125.114 0.131 -7.373 1.00 0.00 H new ATOM 0 HD1 TYR A 52 124.408 -0.591 -9.936 1.00 0.00 H new ATOM 0 HD2 TYR A 52 126.093 3.177 -8.745 1.00 0.00 H new ATOM 0 HE1 TYR A 52 125.234 -0.230 -12.247 1.00 0.00 H new ATOM 0 HE2 TYR A 52 126.919 3.537 -11.056 1.00 0.00 H new ATOM 0 HH TYR A 52 126.616 1.023 -13.563 1.00 0.00 H new ATOM 404 N PHE A 53 121.843 1.277 -5.770 1.00 0.00 N ATOM 405 CA PHE A 53 121.301 0.846 -4.448 1.00 0.00 C ATOM 406 C PHE A 53 119.778 1.021 -4.415 1.00 0.00 C ATOM 407 O PHE A 53 119.267 2.117 -4.531 1.00 0.00 O ATOM 408 CB PHE A 53 121.967 1.766 -3.422 1.00 0.00 C ATOM 409 CG PHE A 53 123.466 1.571 -3.455 1.00 0.00 C ATOM 410 CD1 PHE A 53 124.006 0.285 -3.582 1.00 0.00 C ATOM 411 CD2 PHE A 53 124.316 2.680 -3.353 1.00 0.00 C ATOM 412 CE1 PHE A 53 125.395 0.108 -3.609 1.00 0.00 C ATOM 413 CE2 PHE A 53 125.705 2.502 -3.379 1.00 0.00 C ATOM 414 CZ PHE A 53 126.243 1.217 -3.508 1.00 0.00 C ATOM 0 H PHE A 53 121.547 2.202 -6.081 1.00 0.00 H new ATOM 0 HA PHE A 53 121.505 -0.205 -4.245 1.00 0.00 H new ATOM 0 HB2 PHE A 53 121.722 2.806 -3.639 1.00 0.00 H new ATOM 0 HB3 PHE A 53 121.585 1.550 -2.424 1.00 0.00 H new ATOM 0 HD1 PHE A 53 123.351 -0.570 -3.659 1.00 0.00 H new ATOM 0 HD2 PHE A 53 123.900 3.672 -3.254 1.00 0.00 H new ATOM 0 HE1 PHE A 53 125.812 -0.884 -3.708 1.00 0.00 H new ATOM 0 HE2 PHE A 53 126.361 3.357 -3.299 1.00 0.00 H new ATOM 0 HZ PHE A 53 127.314 1.081 -3.530 1.00 0.00 H new ATOM 424 N ASN A 54 119.053 -0.053 -4.260 1.00 0.00 N ATOM 425 CA ASN A 54 117.563 0.047 -4.221 1.00 0.00 C ATOM 426 C ASN A 54 117.101 0.668 -2.897 1.00 0.00 C ATOM 427 O ASN A 54 117.860 0.787 -1.956 1.00 0.00 O ATOM 428 CB ASN A 54 117.069 -1.394 -4.339 1.00 0.00 C ATOM 429 CG ASN A 54 116.346 -1.580 -5.674 1.00 0.00 C ATOM 430 OD1 ASN A 54 115.674 -0.683 -6.144 1.00 0.00 O ATOM 431 ND2 ASN A 54 116.457 -2.713 -6.310 1.00 0.00 N ATOM 0 H ASN A 54 119.427 -0.997 -4.158 1.00 0.00 H new ATOM 0 HA ASN A 54 117.172 0.681 -5.017 1.00 0.00 H new ATOM 0 HB2 ASN A 54 117.910 -2.084 -4.270 1.00 0.00 H new ATOM 0 HB3 ASN A 54 116.396 -1.627 -3.514 1.00 0.00 H new ATOM 0 HD21 ASN A 54 115.980 -2.846 -7.202 1.00 0.00 H new ATOM 0 HD22 ASN A 54 117.021 -3.466 -5.916 1.00 0.00 H new ATOM 438 N LYS A 55 115.858 1.064 -2.821 1.00 0.00 N ATOM 439 CA LYS A 55 115.336 1.676 -1.562 1.00 0.00 C ATOM 440 C LYS A 55 113.859 1.311 -1.380 1.00 0.00 C ATOM 441 O LYS A 55 113.197 0.942 -2.331 1.00 0.00 O ATOM 442 CB LYS A 55 115.496 3.185 -1.765 1.00 0.00 C ATOM 443 CG LYS A 55 114.846 3.593 -3.088 1.00 0.00 C ATOM 444 CD LYS A 55 114.216 4.981 -2.942 1.00 0.00 C ATOM 445 CE LYS A 55 112.835 4.849 -2.296 1.00 0.00 C ATOM 446 NZ LYS A 55 112.388 6.251 -2.058 1.00 0.00 N ATOM 0 H LYS A 55 115.179 0.990 -3.579 1.00 0.00 H new ATOM 0 HA LYS A 55 115.864 1.326 -0.675 1.00 0.00 H new ATOM 0 HB2 LYS A 55 115.034 3.725 -0.939 1.00 0.00 H new ATOM 0 HB3 LYS A 55 116.553 3.452 -1.769 1.00 0.00 H new ATOM 0 HG2 LYS A 55 115.591 3.602 -3.884 1.00 0.00 H new ATOM 0 HG3 LYS A 55 114.086 2.865 -3.371 1.00 0.00 H new ATOM 0 HD2 LYS A 55 114.855 5.620 -2.332 1.00 0.00 H new ATOM 0 HD3 LYS A 55 114.128 5.457 -3.919 1.00 0.00 H new ATOM 0 HE2 LYS A 55 112.142 4.319 -2.949 1.00 0.00 H new ATOM 0 HE3 LYS A 55 112.887 4.287 -1.363 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 111.447 6.245 -1.616 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 113.063 6.728 -1.428 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 112.342 6.759 -2.964 1.00 0.00 H new ATOM 460 N PRO A 56 113.379 1.426 -0.167 1.00 0.00 N ATOM 461 CA PRO A 56 114.223 1.881 0.968 1.00 0.00 C ATOM 462 C PRO A 56 115.101 0.736 1.484 1.00 0.00 C ATOM 463 O PRO A 56 115.118 -0.345 0.931 1.00 0.00 O ATOM 464 CB PRO A 56 113.202 2.287 2.026 1.00 0.00 C ATOM 465 CG PRO A 56 111.980 1.476 1.726 1.00 0.00 C ATOM 466 CD PRO A 56 112.000 1.149 0.253 1.00 0.00 C ATOM 0 HA PRO A 56 114.904 2.687 0.695 1.00 0.00 H new ATOM 0 HB2 PRO A 56 113.573 2.082 3.030 1.00 0.00 H new ATOM 0 HB3 PRO A 56 112.988 3.355 1.977 1.00 0.00 H new ATOM 0 HG2 PRO A 56 111.971 0.563 2.321 1.00 0.00 H new ATOM 0 HG3 PRO A 56 111.079 2.032 1.983 1.00 0.00 H new ATOM 0 HD2 PRO A 56 111.732 0.108 0.074 1.00 0.00 H new ATOM 0 HD3 PRO A 56 111.287 1.761 -0.299 1.00 0.00 H new ATOM 474 N ALA A 57 115.829 0.967 2.543 1.00 0.00 N ATOM 475 CA ALA A 57 116.705 -0.105 3.100 1.00 0.00 C ATOM 476 C ALA A 57 116.043 -0.735 4.330 1.00 0.00 C ATOM 477 O ALA A 57 115.047 -0.248 4.825 1.00 0.00 O ATOM 478 CB ALA A 57 117.998 0.606 3.495 1.00 0.00 C ATOM 0 H ALA A 57 115.855 1.853 3.048 1.00 0.00 H new ATOM 0 HA ALA A 57 116.884 -0.908 2.385 1.00 0.00 H new ATOM 0 HB1 ALA A 57 118.697 -0.117 3.915 1.00 0.00 H new ATOM 0 HB2 ALA A 57 118.442 1.070 2.614 1.00 0.00 H new ATOM 0 HB3 ALA A 57 117.779 1.373 4.238 1.00 0.00 H new ATOM 484 N LYS A 58 116.582 -1.818 4.824 1.00 0.00 N ATOM 485 CA LYS A 58 115.966 -2.468 6.019 1.00 0.00 C ATOM 486 C LYS A 58 116.838 -2.254 7.262 1.00 0.00 C ATOM 487 O LYS A 58 117.923 -2.789 7.369 1.00 0.00 O ATOM 488 CB LYS A 58 115.886 -3.954 5.663 1.00 0.00 C ATOM 489 CG LYS A 58 114.421 -4.355 5.473 1.00 0.00 C ATOM 490 CD LYS A 58 113.912 -5.050 6.736 1.00 0.00 C ATOM 491 CE LYS A 58 112.914 -6.144 6.349 1.00 0.00 C ATOM 492 NZ LYS A 58 112.671 -6.905 7.606 1.00 0.00 N ATOM 0 H LYS A 58 117.415 -2.278 4.456 1.00 0.00 H new ATOM 0 HA LYS A 58 114.987 -2.050 6.253 1.00 0.00 H new ATOM 0 HB2 LYS A 58 116.449 -4.151 4.751 1.00 0.00 H new ATOM 0 HB3 LYS A 58 116.339 -4.553 6.453 1.00 0.00 H new ATOM 0 HG2 LYS A 58 113.816 -3.473 5.262 1.00 0.00 H new ATOM 0 HG3 LYS A 58 114.324 -5.020 4.615 1.00 0.00 H new ATOM 0 HD2 LYS A 58 114.747 -5.483 7.287 1.00 0.00 H new ATOM 0 HD3 LYS A 58 113.436 -4.325 7.396 1.00 0.00 H new ATOM 0 HE2 LYS A 58 111.989 -5.716 5.962 1.00 0.00 H new ATOM 0 HE3 LYS A 58 113.318 -6.789 5.569 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 111.995 -7.674 7.421 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 113.568 -7.306 7.948 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 112.280 -6.267 8.328 1.00 0.00 H new ATOM 506 N TYR A 59 116.366 -1.482 8.206 1.00 0.00 N ATOM 507 CA TYR A 59 117.165 -1.243 9.444 1.00 0.00 C ATOM 508 C TYR A 59 116.691 -2.168 10.562 1.00 0.00 C ATOM 509 O TYR A 59 115.636 -2.763 10.483 1.00 0.00 O ATOM 510 CB TYR A 59 116.912 0.216 9.818 1.00 0.00 C ATOM 511 CG TYR A 59 115.718 0.299 10.744 1.00 0.00 C ATOM 512 CD1 TYR A 59 114.421 0.149 10.237 1.00 0.00 C ATOM 513 CD2 TYR A 59 115.912 0.524 12.113 1.00 0.00 C ATOM 514 CE1 TYR A 59 113.319 0.223 11.099 1.00 0.00 C ATOM 515 CE2 TYR A 59 114.811 0.597 12.973 1.00 0.00 C ATOM 516 CZ TYR A 59 113.514 0.447 12.467 1.00 0.00 C ATOM 517 OH TYR A 59 112.429 0.518 13.317 1.00 0.00 O ATOM 0 H TYR A 59 115.464 -1.008 8.173 1.00 0.00 H new ATOM 0 HA TYR A 59 118.226 -1.441 9.289 1.00 0.00 H new ATOM 0 HB2 TYR A 59 117.793 0.636 10.304 1.00 0.00 H new ATOM 0 HB3 TYR A 59 116.731 0.807 8.920 1.00 0.00 H new ATOM 0 HD1 TYR A 59 114.270 -0.024 9.182 1.00 0.00 H new ATOM 0 HD2 TYR A 59 116.912 0.641 12.505 1.00 0.00 H new ATOM 0 HE1 TYR A 59 112.319 0.107 10.708 1.00 0.00 H new ATOM 0 HE2 TYR A 59 114.962 0.769 14.028 1.00 0.00 H new ATOM 0 HH TYR A 59 112.740 0.677 14.232 1.00 0.00 H new ATOM 527 N ILE A 60 117.464 -2.297 11.604 1.00 0.00 N ATOM 528 CA ILE A 60 117.050 -3.188 12.720 1.00 0.00 C ATOM 529 C ILE A 60 117.719 -2.760 14.030 1.00 0.00 C ATOM 530 O ILE A 60 118.776 -2.169 14.023 1.00 0.00 O ATOM 531 CB ILE A 60 117.527 -4.574 12.298 1.00 0.00 C ATOM 532 CG1 ILE A 60 117.707 -5.449 13.535 1.00 0.00 C ATOM 533 CG2 ILE A 60 118.863 -4.451 11.565 1.00 0.00 C ATOM 534 CD1 ILE A 60 117.798 -6.911 13.104 1.00 0.00 C ATOM 0 H ILE A 60 118.360 -1.826 11.730 1.00 0.00 H new ATOM 0 HA ILE A 60 115.975 -3.157 12.900 1.00 0.00 H new ATOM 0 HB ILE A 60 116.788 -5.026 11.637 1.00 0.00 H new ATOM 0 HG12 ILE A 60 118.610 -5.159 14.073 1.00 0.00 H new ATOM 0 HG13 ILE A 60 116.870 -5.310 14.219 1.00 0.00 H new ATOM 0 HG21 ILE A 60 119.205 -5.441 11.263 1.00 0.00 H new ATOM 0 HG22 ILE A 60 118.737 -3.825 10.681 1.00 0.00 H new ATOM 0 HG23 ILE A 60 119.601 -3.999 12.227 1.00 0.00 H new ATOM 0 HD11 ILE A 60 117.927 -7.542 13.983 1.00 0.00 H new ATOM 0 HD12 ILE A 60 116.883 -7.195 12.584 1.00 0.00 H new ATOM 0 HD13 ILE A 60 118.650 -7.041 12.436 1.00 0.00 H new ATOM 546 N LYS A 61 117.113 -3.062 15.151 1.00 0.00 N ATOM 547 CA LYS A 61 117.714 -2.673 16.465 1.00 0.00 C ATOM 548 C LYS A 61 117.683 -3.853 17.438 1.00 0.00 C ATOM 549 O LYS A 61 117.076 -4.873 17.177 1.00 0.00 O ATOM 550 CB LYS A 61 116.851 -1.520 16.991 1.00 0.00 C ATOM 551 CG LYS A 61 116.300 -0.686 15.829 1.00 0.00 C ATOM 552 CD LYS A 61 115.414 0.430 16.387 1.00 0.00 C ATOM 553 CE LYS A 61 116.051 1.788 16.087 1.00 0.00 C ATOM 554 NZ LYS A 61 114.904 2.713 15.875 1.00 0.00 N ATOM 0 H LYS A 61 116.226 -3.562 15.214 1.00 0.00 H new ATOM 0 HA LYS A 61 118.758 -2.377 16.358 1.00 0.00 H new ATOM 0 HB2 LYS A 61 116.027 -1.916 17.584 1.00 0.00 H new ATOM 0 HB3 LYS A 61 117.443 -0.887 17.651 1.00 0.00 H new ATOM 0 HG2 LYS A 61 117.120 -0.261 15.250 1.00 0.00 H new ATOM 0 HG3 LYS A 61 115.726 -1.318 15.152 1.00 0.00 H new ATOM 0 HD2 LYS A 61 114.420 0.377 15.942 1.00 0.00 H new ATOM 0 HD3 LYS A 61 115.288 0.305 17.463 1.00 0.00 H new ATOM 0 HE2 LYS A 61 116.679 2.121 16.914 1.00 0.00 H new ATOM 0 HE3 LYS A 61 116.687 1.739 15.203 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 115.201 3.688 16.083 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 114.587 2.652 14.887 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 114.122 2.447 16.507 1.00 0.00 H new ATOM 568 N LYS A 62 118.341 -3.721 18.559 1.00 0.00 N ATOM 569 CA LYS A 62 118.356 -4.832 19.552 1.00 0.00 C ATOM 570 C LYS A 62 118.560 -4.274 20.964 1.00 0.00 C ATOM 571 O LYS A 62 119.531 -4.575 21.629 1.00 0.00 O ATOM 572 CB LYS A 62 119.536 -5.714 19.144 1.00 0.00 C ATOM 573 CG LYS A 62 119.020 -6.928 18.368 1.00 0.00 C ATOM 574 CD LYS A 62 119.996 -7.265 17.238 1.00 0.00 C ATOM 575 CE LYS A 62 120.220 -8.779 17.192 1.00 0.00 C ATOM 576 NZ LYS A 62 121.014 -9.085 18.414 1.00 0.00 N ATOM 0 H LYS A 62 118.869 -2.891 18.829 1.00 0.00 H new ATOM 0 HA LYS A 62 117.419 -5.390 19.564 1.00 0.00 H new ATOM 0 HB2 LYS A 62 120.234 -5.145 18.529 1.00 0.00 H new ATOM 0 HB3 LYS A 62 120.083 -6.040 20.028 1.00 0.00 H new ATOM 0 HG2 LYS A 62 118.913 -7.782 19.037 1.00 0.00 H new ATOM 0 HG3 LYS A 62 118.032 -6.718 17.959 1.00 0.00 H new ATOM 0 HD2 LYS A 62 119.600 -6.916 16.284 1.00 0.00 H new ATOM 0 HD3 LYS A 62 120.944 -6.751 17.396 1.00 0.00 H new ATOM 0 HE2 LYS A 62 119.273 -9.319 17.190 1.00 0.00 H new ATOM 0 HE3 LYS A 62 120.755 -9.072 16.289 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 121.683 -9.855 18.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 121.541 -8.237 18.707 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 120.374 -9.377 19.180 1.00 0.00 H new ATOM 590 N ASN A 63 117.643 -3.470 21.427 1.00 0.00 N ATOM 591 CA ASN A 63 117.771 -2.893 22.797 1.00 0.00 C ATOM 592 C ASN A 63 119.154 -2.260 23.002 1.00 0.00 C ATOM 593 O ASN A 63 120.043 -2.863 23.568 1.00 0.00 O ATOM 594 CB ASN A 63 117.585 -4.082 23.738 1.00 0.00 C ATOM 595 CG ASN A 63 117.195 -3.578 25.129 1.00 0.00 C ATOM 596 OD1 ASN A 63 116.982 -2.397 25.322 1.00 0.00 O ATOM 597 ND2 ASN A 63 117.091 -4.430 26.112 1.00 0.00 N ATOM 0 H ASN A 63 116.808 -3.186 20.915 1.00 0.00 H new ATOM 0 HA ASN A 63 117.042 -2.102 22.974 1.00 0.00 H new ATOM 0 HB2 ASN A 63 116.813 -4.748 23.351 1.00 0.00 H new ATOM 0 HB3 ASN A 63 118.506 -4.662 23.795 1.00 0.00 H new ATOM 0 HD21 ASN A 63 116.831 -4.105 27.043 1.00 0.00 H new ATOM 0 HD22 ASN A 63 117.270 -5.421 25.949 1.00 0.00 H new ATOM 604 N GLY A 64 119.334 -1.042 22.563 1.00 0.00 N ATOM 605 CA GLY A 64 120.651 -0.365 22.753 1.00 0.00 C ATOM 606 C GLY A 64 121.567 -0.633 21.555 1.00 0.00 C ATOM 607 O GLY A 64 122.773 -0.526 21.653 1.00 0.00 O ATOM 0 H GLY A 64 118.627 -0.487 22.081 1.00 0.00 H new ATOM 0 HA2 GLY A 64 120.502 0.708 22.872 1.00 0.00 H new ATOM 0 HA3 GLY A 64 121.123 -0.724 23.667 1.00 0.00 H new ATOM 611 N LYS A 65 121.012 -0.975 20.425 1.00 0.00 N ATOM 612 CA LYS A 65 121.868 -1.241 19.231 1.00 0.00 C ATOM 613 C LYS A 65 121.023 -1.310 17.965 1.00 0.00 C ATOM 614 O LYS A 65 119.821 -1.476 18.016 1.00 0.00 O ATOM 615 CB LYS A 65 122.512 -2.600 19.483 1.00 0.00 C ATOM 616 CG LYS A 65 121.595 -3.460 20.351 1.00 0.00 C ATOM 617 CD LYS A 65 122.152 -4.883 20.426 1.00 0.00 C ATOM 618 CE LYS A 65 123.654 -4.826 20.719 1.00 0.00 C ATOM 619 NZ LYS A 65 124.069 -6.248 20.875 1.00 0.00 N ATOM 0 H LYS A 65 120.009 -1.082 20.275 1.00 0.00 H new ATOM 0 HA LYS A 65 122.604 -0.450 19.091 1.00 0.00 H new ATOM 0 HB2 LYS A 65 122.704 -3.102 18.535 1.00 0.00 H new ATOM 0 HB3 LYS A 65 123.475 -2.469 19.976 1.00 0.00 H new ATOM 0 HG2 LYS A 65 121.519 -3.034 21.352 1.00 0.00 H new ATOM 0 HG3 LYS A 65 120.588 -3.473 19.933 1.00 0.00 H new ATOM 0 HD2 LYS A 65 121.639 -5.446 21.206 1.00 0.00 H new ATOM 0 HD3 LYS A 65 121.973 -5.405 19.486 1.00 0.00 H new ATOM 0 HE2 LYS A 65 124.197 -4.343 19.906 1.00 0.00 H new ATOM 0 HE3 LYS A 65 123.858 -4.253 21.624 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 125.088 -6.292 21.078 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 123.541 -6.680 21.660 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 123.869 -6.767 19.996 1.00 0.00 H new ATOM 633 N LEU A 66 121.648 -1.210 16.823 1.00 0.00 N ATOM 634 CA LEU A 66 120.877 -1.295 15.557 1.00 0.00 C ATOM 635 C LEU A 66 121.808 -1.310 14.349 1.00 0.00 C ATOM 636 O LEU A 66 122.924 -0.835 14.391 1.00 0.00 O ATOM 637 CB LEU A 66 119.952 -0.073 15.558 1.00 0.00 C ATOM 638 CG LEU A 66 120.678 1.151 15.004 1.00 0.00 C ATOM 639 CD1 LEU A 66 119.697 2.320 14.952 1.00 0.00 C ATOM 640 CD2 LEU A 66 121.848 1.512 15.923 1.00 0.00 C ATOM 0 H LEU A 66 122.653 -1.074 16.715 1.00 0.00 H new ATOM 0 HA LEU A 66 120.302 -2.218 15.490 1.00 0.00 H new ATOM 0 HB2 LEU A 66 119.066 -0.280 14.957 1.00 0.00 H new ATOM 0 HB3 LEU A 66 119.609 0.129 16.573 1.00 0.00 H new ATOM 0 HG LEU A 66 121.058 0.936 14.005 1.00 0.00 H new ATOM 0 HD11 LEU A 66 120.202 3.202 14.558 1.00 0.00 H new ATOM 0 HD12 LEU A 66 118.858 2.063 14.305 1.00 0.00 H new ATOM 0 HD13 LEU A 66 119.329 2.531 15.956 1.00 0.00 H new ATOM 0 HD21 LEU A 66 122.366 2.386 15.527 1.00 0.00 H new ATOM 0 HD22 LEU A 66 121.471 1.735 16.921 1.00 0.00 H new ATOM 0 HD23 LEU A 66 122.541 0.673 15.976 1.00 0.00 H new ATOM 652 N TYR A 67 121.347 -1.884 13.275 1.00 0.00 N ATOM 653 CA TYR A 67 122.180 -1.976 12.051 1.00 0.00 C ATOM 654 C TYR A 67 121.311 -1.710 10.822 1.00 0.00 C ATOM 655 O TYR A 67 120.287 -1.063 10.906 1.00 0.00 O ATOM 656 CB TYR A 67 122.692 -3.419 12.042 1.00 0.00 C ATOM 657 CG TYR A 67 122.920 -3.894 13.462 1.00 0.00 C ATOM 658 CD1 TYR A 67 121.850 -4.392 14.226 1.00 0.00 C ATOM 659 CD2 TYR A 67 124.205 -3.842 14.013 1.00 0.00 C ATOM 660 CE1 TYR A 67 122.073 -4.833 15.536 1.00 0.00 C ATOM 661 CE2 TYR A 67 124.425 -4.284 15.324 1.00 0.00 C ATOM 662 CZ TYR A 67 123.360 -4.778 16.085 1.00 0.00 C ATOM 663 OH TYR A 67 123.577 -5.214 17.376 1.00 0.00 O ATOM 0 H TYR A 67 120.418 -2.297 13.194 1.00 0.00 H new ATOM 0 HA TYR A 67 122.995 -1.252 12.035 1.00 0.00 H new ATOM 0 HB2 TYR A 67 121.971 -4.067 11.544 1.00 0.00 H new ATOM 0 HB3 TYR A 67 123.621 -3.481 11.475 1.00 0.00 H new ATOM 0 HD1 TYR A 67 120.857 -4.434 13.803 1.00 0.00 H new ATOM 0 HD2 TYR A 67 125.028 -3.461 13.427 1.00 0.00 H new ATOM 0 HE1 TYR A 67 121.252 -5.216 16.124 1.00 0.00 H new ATOM 0 HE2 TYR A 67 125.418 -4.243 15.748 1.00 0.00 H new ATOM 0 HH TYR A 67 124.525 -5.108 17.602 1.00 0.00 H new ATOM 673 N VAL A 68 121.705 -2.205 9.683 1.00 0.00 N ATOM 674 CA VAL A 68 120.886 -1.975 8.462 1.00 0.00 C ATOM 675 C VAL A 68 121.401 -2.825 7.304 1.00 0.00 C ATOM 676 O VAL A 68 122.588 -2.909 7.063 1.00 0.00 O ATOM 677 CB VAL A 68 121.059 -0.489 8.147 1.00 0.00 C ATOM 678 CG1 VAL A 68 121.569 -0.325 6.714 1.00 0.00 C ATOM 679 CG2 VAL A 68 119.717 0.230 8.292 1.00 0.00 C ATOM 0 H VAL A 68 122.553 -2.755 9.545 1.00 0.00 H new ATOM 0 HA VAL A 68 119.841 -2.247 8.613 1.00 0.00 H new ATOM 0 HB VAL A 68 121.778 -0.057 8.843 1.00 0.00 H new ATOM 0 HG11 VAL A 68 121.692 0.735 6.491 1.00 0.00 H new ATOM 0 HG12 VAL A 68 122.528 -0.832 6.609 1.00 0.00 H new ATOM 0 HG13 VAL A 68 120.851 -0.761 6.020 1.00 0.00 H new ATOM 0 HG21 VAL A 68 119.845 1.289 8.067 1.00 0.00 H new ATOM 0 HG22 VAL A 68 118.995 -0.204 7.600 1.00 0.00 H new ATOM 0 HG23 VAL A 68 119.353 0.118 9.313 1.00 0.00 H new ATOM 689 N GLN A 69 120.516 -3.447 6.575 1.00 0.00 N ATOM 690 CA GLN A 69 120.964 -4.274 5.425 1.00 0.00 C ATOM 691 C GLN A 69 120.803 -3.480 4.126 1.00 0.00 C ATOM 692 O GLN A 69 119.787 -2.855 3.888 1.00 0.00 O ATOM 693 CB GLN A 69 120.057 -5.506 5.430 1.00 0.00 C ATOM 694 CG GLN A 69 118.632 -5.097 5.060 1.00 0.00 C ATOM 695 CD GLN A 69 118.369 -5.435 3.591 1.00 0.00 C ATOM 696 OE1 GLN A 69 119.003 -4.893 2.708 1.00 0.00 O ATOM 697 NE2 GLN A 69 117.454 -6.316 3.291 1.00 0.00 N ATOM 0 H GLN A 69 119.508 -3.418 6.726 1.00 0.00 H new ATOM 0 HA GLN A 69 122.014 -4.558 5.500 1.00 0.00 H new ATOM 0 HB2 GLN A 69 120.429 -6.246 4.722 1.00 0.00 H new ATOM 0 HB3 GLN A 69 120.068 -5.973 6.415 1.00 0.00 H new ATOM 0 HG2 GLN A 69 117.916 -5.616 5.697 1.00 0.00 H new ATOM 0 HG3 GLN A 69 118.493 -4.029 5.229 1.00 0.00 H new ATOM 0 HE21 GLN A 69 116.922 -6.771 4.033 1.00 0.00 H new ATOM 0 HE22 GLN A 69 117.271 -6.549 2.315 1.00 0.00 H new ATOM 706 N ILE A 70 121.803 -3.492 3.291 1.00 0.00 N ATOM 707 CA ILE A 70 121.723 -2.733 2.011 1.00 0.00 C ATOM 708 C ILE A 70 121.699 -3.696 0.824 1.00 0.00 C ATOM 709 O ILE A 70 122.395 -4.691 0.806 1.00 0.00 O ATOM 710 CB ILE A 70 122.994 -1.883 1.980 1.00 0.00 C ATOM 711 CG1 ILE A 70 122.620 -0.400 1.938 1.00 0.00 C ATOM 712 CG2 ILE A 70 123.813 -2.236 0.736 1.00 0.00 C ATOM 713 CD1 ILE A 70 122.706 0.186 3.348 1.00 0.00 C ATOM 0 H ILE A 70 122.677 -3.997 3.440 1.00 0.00 H new ATOM 0 HA ILE A 70 120.820 -2.126 1.946 1.00 0.00 H new ATOM 0 HB ILE A 70 123.584 -2.083 2.875 1.00 0.00 H new ATOM 0 HG12 ILE A 70 123.291 0.137 1.268 1.00 0.00 H new ATOM 0 HG13 ILE A 70 121.611 -0.279 1.543 1.00 0.00 H new ATOM 0 HG21 ILE A 70 124.719 -1.631 0.713 1.00 0.00 H new ATOM 0 HG22 ILE A 70 124.083 -3.292 0.765 1.00 0.00 H new ATOM 0 HG23 ILE A 70 123.221 -2.037 -0.158 1.00 0.00 H new ATOM 0 HD11 ILE A 70 122.440 1.243 3.320 1.00 0.00 H new ATOM 0 HD12 ILE A 70 122.017 -0.344 4.005 1.00 0.00 H new ATOM 0 HD13 ILE A 70 123.723 0.078 3.726 1.00 0.00 H new ATOM 725 N THR A 71 120.908 -3.406 -0.171 1.00 0.00 N ATOM 726 CA THR A 71 120.847 -4.304 -1.358 1.00 0.00 C ATOM 727 C THR A 71 121.898 -3.876 -2.385 1.00 0.00 C ATOM 728 O THR A 71 122.000 -2.719 -2.738 1.00 0.00 O ATOM 729 CB THR A 71 119.437 -4.124 -1.919 1.00 0.00 C ATOM 730 OG1 THR A 71 118.498 -4.722 -1.036 1.00 0.00 O ATOM 731 CG2 THR A 71 119.341 -4.785 -3.294 1.00 0.00 C ATOM 0 H THR A 71 120.302 -2.587 -0.214 1.00 0.00 H new ATOM 0 HA THR A 71 121.050 -5.345 -1.107 1.00 0.00 H new ATOM 0 HB THR A 71 119.219 -3.060 -2.017 1.00 0.00 H new ATOM 0 HG1 THR A 71 117.593 -4.606 -1.393 1.00 0.00 H new ATOM 0 HG21 THR A 71 118.334 -4.655 -3.691 1.00 0.00 H new ATOM 0 HG22 THR A 71 120.060 -4.324 -3.971 1.00 0.00 H new ATOM 0 HG23 THR A 71 119.560 -5.849 -3.202 1.00 0.00 H new ATOM 739 N VAL A 72 122.687 -4.800 -2.858 1.00 0.00 N ATOM 740 CA VAL A 72 123.740 -4.445 -3.851 1.00 0.00 C ATOM 741 C VAL A 72 123.317 -4.873 -5.259 1.00 0.00 C ATOM 742 O VAL A 72 122.945 -6.007 -5.487 1.00 0.00 O ATOM 743 CB VAL A 72 124.973 -5.227 -3.405 1.00 0.00 C ATOM 744 CG1 VAL A 72 126.228 -4.581 -3.992 1.00 0.00 C ATOM 745 CG2 VAL A 72 125.059 -5.212 -1.876 1.00 0.00 C ATOM 0 H VAL A 72 122.648 -5.786 -2.600 1.00 0.00 H new ATOM 0 HA VAL A 72 123.923 -3.371 -3.892 1.00 0.00 H new ATOM 0 HB VAL A 72 124.897 -6.256 -3.756 1.00 0.00 H new ATOM 0 HG11 VAL A 72 127.108 -5.140 -3.673 1.00 0.00 H new ATOM 0 HG12 VAL A 72 126.167 -4.590 -5.080 1.00 0.00 H new ATOM 0 HG13 VAL A 72 126.305 -3.552 -3.642 1.00 0.00 H new ATOM 0 HG21 VAL A 72 125.939 -5.770 -1.556 1.00 0.00 H new ATOM 0 HG22 VAL A 72 125.135 -4.183 -1.526 1.00 0.00 H new ATOM 0 HG23 VAL A 72 124.165 -5.673 -1.457 1.00 0.00 H new ATOM 755 N ASN A 73 123.372 -3.975 -6.204 1.00 0.00 N ATOM 756 CA ASN A 73 122.975 -4.334 -7.596 1.00 0.00 C ATOM 757 C ASN A 73 124.218 -4.586 -8.455 1.00 0.00 C ATOM 758 O ASN A 73 125.172 -3.835 -8.417 1.00 0.00 O ATOM 759 CB ASN A 73 122.204 -3.120 -8.113 1.00 0.00 C ATOM 760 CG ASN A 73 120.704 -3.348 -7.923 1.00 0.00 C ATOM 761 OD1 ASN A 73 120.059 -2.637 -7.177 1.00 0.00 O ATOM 762 ND2 ASN A 73 120.116 -4.317 -8.570 1.00 0.00 N ATOM 0 H ASN A 73 123.674 -3.010 -6.073 1.00 0.00 H new ATOM 0 HA ASN A 73 122.376 -5.244 -7.632 1.00 0.00 H new ATOM 0 HB2 ASN A 73 122.517 -2.223 -7.578 1.00 0.00 H new ATOM 0 HB3 ASN A 73 122.427 -2.957 -9.167 1.00 0.00 H new ATOM 0 HD21 ASN A 73 119.116 -4.477 -8.450 1.00 0.00 H new ATOM 0 HD22 ASN A 73 120.657 -4.914 -9.196 1.00 0.00 H new ATOM 769 N HIS A 74 124.212 -5.637 -9.228 1.00 0.00 N ATOM 770 CA HIS A 74 125.393 -5.936 -10.089 1.00 0.00 C ATOM 771 C HIS A 74 126.664 -6.006 -9.239 1.00 0.00 C ATOM 772 O HIS A 74 127.299 -5.005 -8.971 1.00 0.00 O ATOM 773 CB HIS A 74 125.471 -4.769 -11.076 1.00 0.00 C ATOM 774 CG HIS A 74 124.149 -4.615 -11.777 1.00 0.00 C ATOM 775 ND1 HIS A 74 123.834 -3.487 -12.519 1.00 0.00 N ATOM 776 CD2 HIS A 74 123.052 -5.436 -11.858 1.00 0.00 C ATOM 777 CE1 HIS A 74 122.592 -3.659 -13.010 1.00 0.00 C ATOM 778 NE2 HIS A 74 122.069 -4.830 -12.637 1.00 0.00 N ATOM 0 H HIS A 74 123.442 -6.302 -9.301 1.00 0.00 H new ATOM 0 HA HIS A 74 125.299 -6.895 -10.599 1.00 0.00 H new ATOM 0 HB2 HIS A 74 125.724 -3.849 -10.549 1.00 0.00 H new ATOM 0 HB3 HIS A 74 126.262 -4.947 -11.804 1.00 0.00 H new ATOM 0 HD2 HIS A 74 122.964 -6.405 -11.389 1.00 0.00 H new ATOM 0 HE1 HIS A 74 122.081 -2.938 -13.630 1.00 0.00 H new ATOM 0 HE2 HIS A 74 121.148 -5.201 -12.872 1.00 0.00 H new ATOM 786 N SER A 75 127.041 -7.180 -8.812 1.00 0.00 N ATOM 787 CA SER A 75 128.271 -7.311 -7.980 1.00 0.00 C ATOM 788 C SER A 75 129.520 -7.143 -8.849 1.00 0.00 C ATOM 789 O SER A 75 130.559 -6.717 -8.385 1.00 0.00 O ATOM 790 CB SER A 75 128.208 -8.723 -7.399 1.00 0.00 C ATOM 791 OG SER A 75 129.281 -9.494 -7.922 1.00 0.00 O ATOM 0 H SER A 75 126.551 -8.054 -9.003 1.00 0.00 H new ATOM 0 HA SER A 75 128.324 -6.551 -7.200 1.00 0.00 H new ATOM 0 HB2 SER A 75 128.269 -8.684 -6.311 1.00 0.00 H new ATOM 0 HB3 SER A 75 127.255 -9.189 -7.648 1.00 0.00 H new ATOM 0 HG SER A 75 129.245 -10.400 -7.550 1.00 0.00 H new ATOM 797 N HIS A 76 129.427 -7.472 -10.109 1.00 0.00 N ATOM 798 CA HIS A 76 130.611 -7.331 -11.005 1.00 0.00 C ATOM 799 C HIS A 76 131.116 -5.885 -10.994 1.00 0.00 C ATOM 800 O HIS A 76 132.280 -5.622 -11.220 1.00 0.00 O ATOM 801 CB HIS A 76 130.103 -7.711 -12.397 1.00 0.00 C ATOM 802 CG HIS A 76 130.883 -8.891 -12.911 1.00 0.00 C ATOM 803 ND1 HIS A 76 131.439 -8.912 -14.181 1.00 0.00 N ATOM 804 CD2 HIS A 76 131.208 -10.096 -12.340 1.00 0.00 C ATOM 805 CE1 HIS A 76 132.062 -10.095 -14.331 1.00 0.00 C ATOM 806 NE2 HIS A 76 131.952 -10.855 -13.238 1.00 0.00 N ATOM 0 H HIS A 76 128.584 -7.832 -10.556 1.00 0.00 H new ATOM 0 HA HIS A 76 131.444 -7.960 -10.689 1.00 0.00 H new ATOM 0 HB2 HIS A 76 129.041 -7.954 -12.355 1.00 0.00 H new ATOM 0 HB3 HIS A 76 130.210 -6.866 -13.078 1.00 0.00 H new ATOM 0 HD2 HIS A 76 130.929 -10.408 -11.344 1.00 0.00 H new ATOM 0 HE1 HIS A 76 132.587 -10.394 -15.226 1.00 0.00 H new ATOM 0 HE2 HIS A 76 132.332 -11.790 -13.093 1.00 0.00 H new ATOM 814 N TRP A 77 130.249 -4.945 -10.731 1.00 0.00 N ATOM 815 CA TRP A 77 130.681 -3.517 -10.705 1.00 0.00 C ATOM 816 C TRP A 77 131.074 -3.113 -9.281 1.00 0.00 C ATOM 817 O TRP A 77 132.152 -2.600 -9.045 1.00 0.00 O ATOM 818 CB TRP A 77 129.461 -2.730 -11.181 1.00 0.00 C ATOM 819 CG TRP A 77 129.324 -2.887 -12.661 1.00 0.00 C ATOM 820 CD1 TRP A 77 130.164 -3.602 -13.444 1.00 0.00 C ATOM 821 CD2 TRP A 77 128.310 -2.332 -13.548 1.00 0.00 C ATOM 822 NE1 TRP A 77 129.730 -3.521 -14.754 1.00 0.00 N ATOM 823 CE2 TRP A 77 128.590 -2.750 -14.870 1.00 0.00 C ATOM 824 CE3 TRP A 77 127.184 -1.516 -13.335 1.00 0.00 C ATOM 825 CZ2 TRP A 77 127.785 -2.372 -15.944 1.00 0.00 C ATOM 826 CZ3 TRP A 77 126.370 -1.133 -14.415 1.00 0.00 C ATOM 827 CH2 TRP A 77 126.669 -1.560 -15.715 1.00 0.00 C ATOM 0 H TRP A 77 129.261 -5.103 -10.533 1.00 0.00 H new ATOM 0 HA TRP A 77 131.551 -3.331 -11.334 1.00 0.00 H new ATOM 0 HB2 TRP A 77 128.562 -3.090 -10.680 1.00 0.00 H new ATOM 0 HB3 TRP A 77 129.569 -1.676 -10.923 1.00 0.00 H new ATOM 0 HD1 TRP A 77 131.031 -4.147 -13.102 1.00 0.00 H new ATOM 0 HE1 TRP A 77 130.195 -3.976 -15.540 1.00 0.00 H new ATOM 0 HE3 TRP A 77 126.944 -1.182 -12.336 1.00 0.00 H new ATOM 0 HZ2 TRP A 77 128.021 -2.703 -16.944 1.00 0.00 H new ATOM 0 HZ3 TRP A 77 125.508 -0.505 -14.241 1.00 0.00 H new ATOM 0 HH2 TRP A 77 126.039 -1.263 -16.540 1.00 0.00 H new ATOM 838 N ILE A 78 130.213 -3.350 -8.329 1.00 0.00 N ATOM 839 CA ILE A 78 130.542 -2.988 -6.920 1.00 0.00 C ATOM 840 C ILE A 78 131.265 -4.159 -6.250 1.00 0.00 C ATOM 841 O ILE A 78 130.742 -5.251 -6.149 1.00 0.00 O ATOM 842 CB ILE A 78 129.195 -2.721 -6.248 1.00 0.00 C ATOM 843 CG1 ILE A 78 129.427 -2.248 -4.812 1.00 0.00 C ATOM 844 CG2 ILE A 78 128.367 -4.006 -6.231 1.00 0.00 C ATOM 845 CD1 ILE A 78 128.530 -1.045 -4.519 1.00 0.00 C ATOM 0 H ILE A 78 129.297 -3.778 -8.465 1.00 0.00 H new ATOM 0 HA ILE A 78 131.198 -2.120 -6.850 1.00 0.00 H new ATOM 0 HB ILE A 78 128.660 -1.952 -6.804 1.00 0.00 H new ATOM 0 HG12 ILE A 78 129.210 -3.055 -4.113 1.00 0.00 H new ATOM 0 HG13 ILE A 78 130.473 -1.977 -4.672 1.00 0.00 H new ATOM 0 HG21 ILE A 78 127.407 -3.814 -5.752 1.00 0.00 H new ATOM 0 HG22 ILE A 78 128.201 -4.345 -7.253 1.00 0.00 H new ATOM 0 HG23 ILE A 78 128.902 -4.776 -5.676 1.00 0.00 H new ATOM 0 HD11 ILE A 78 128.696 -0.708 -3.496 1.00 0.00 H new ATOM 0 HD12 ILE A 78 128.768 -0.236 -5.210 1.00 0.00 H new ATOM 0 HD13 ILE A 78 127.486 -1.331 -4.642 1.00 0.00 H new ATOM 857 N THR A 79 132.474 -3.942 -5.815 1.00 0.00 N ATOM 858 CA THR A 79 133.253 -5.042 -5.178 1.00 0.00 C ATOM 859 C THR A 79 132.963 -5.135 -3.675 1.00 0.00 C ATOM 860 O THR A 79 133.138 -6.174 -3.069 1.00 0.00 O ATOM 861 CB THR A 79 134.715 -4.669 -5.430 1.00 0.00 C ATOM 862 OG1 THR A 79 135.481 -5.850 -5.613 1.00 0.00 O ATOM 863 CG2 THR A 79 135.265 -3.882 -4.242 1.00 0.00 C ATOM 0 H THR A 79 132.959 -3.047 -5.873 1.00 0.00 H new ATOM 0 HA THR A 79 132.994 -6.018 -5.589 1.00 0.00 H new ATOM 0 HB THR A 79 134.777 -4.052 -6.326 1.00 0.00 H new ATOM 0 HG1 THR A 79 136.428 -5.653 -5.458 1.00 0.00 H new ATOM 0 HG21 THR A 79 136.306 -3.620 -4.430 1.00 0.00 H new ATOM 0 HG22 THR A 79 134.681 -2.972 -4.107 1.00 0.00 H new ATOM 0 HG23 THR A 79 135.201 -4.492 -3.341 1.00 0.00 H new ATOM 871 N GLY A 80 132.526 -4.069 -3.062 1.00 0.00 N ATOM 872 CA GLY A 80 132.240 -4.131 -1.601 1.00 0.00 C ATOM 873 C GLY A 80 131.707 -2.783 -1.113 1.00 0.00 C ATOM 874 O GLY A 80 131.548 -1.851 -1.876 1.00 0.00 O ATOM 0 H GLY A 80 132.356 -3.166 -3.505 1.00 0.00 H new ATOM 0 HA2 GLY A 80 131.510 -4.915 -1.398 1.00 0.00 H new ATOM 0 HA3 GLY A 80 133.147 -4.391 -1.056 1.00 0.00 H new ATOM 878 N MET A 81 131.432 -2.677 0.159 1.00 0.00 N ATOM 879 CA MET A 81 130.908 -1.394 0.708 1.00 0.00 C ATOM 880 C MET A 81 131.300 -1.253 2.183 1.00 0.00 C ATOM 881 O MET A 81 131.668 -2.212 2.832 1.00 0.00 O ATOM 882 CB MET A 81 129.388 -1.495 0.561 1.00 0.00 C ATOM 883 CG MET A 81 128.977 -1.020 -0.834 1.00 0.00 C ATOM 884 SD MET A 81 127.201 -0.669 -0.851 1.00 0.00 S ATOM 885 CE MET A 81 126.666 -2.230 -1.595 1.00 0.00 C ATOM 0 H MET A 81 131.548 -3.425 0.843 1.00 0.00 H new ATOM 0 HA MET A 81 131.310 -0.524 0.189 1.00 0.00 H new ATOM 0 HB2 MET A 81 129.065 -2.524 0.716 1.00 0.00 H new ATOM 0 HB3 MET A 81 128.897 -0.889 1.322 1.00 0.00 H new ATOM 0 HG2 MET A 81 129.538 -0.126 -1.106 1.00 0.00 H new ATOM 0 HG3 MET A 81 129.215 -1.783 -1.575 1.00 0.00 H new ATOM 0 HE1 MET A 81 125.638 -2.133 -1.944 1.00 0.00 H new ATOM 0 HE2 MET A 81 127.314 -2.473 -2.437 1.00 0.00 H new ATOM 0 HE3 MET A 81 126.723 -3.026 -0.852 1.00 0.00 H new ATOM 895 N SER A 82 131.227 -0.063 2.713 1.00 0.00 N ATOM 896 CA SER A 82 131.599 0.144 4.142 1.00 0.00 C ATOM 897 C SER A 82 130.884 1.382 4.694 1.00 0.00 C ATOM 898 O SER A 82 130.736 2.379 4.015 1.00 0.00 O ATOM 899 CB SER A 82 133.111 0.358 4.128 1.00 0.00 C ATOM 900 OG SER A 82 133.536 0.614 2.795 1.00 0.00 O ATOM 0 H SER A 82 130.925 0.776 2.218 1.00 0.00 H new ATOM 0 HA SER A 82 131.314 -0.697 4.774 1.00 0.00 H new ATOM 0 HB2 SER A 82 133.378 1.194 4.774 1.00 0.00 H new ATOM 0 HB3 SER A 82 133.618 -0.523 4.521 1.00 0.00 H new ATOM 0 HG SER A 82 134.506 0.753 2.782 1.00 0.00 H new ATOM 906 N ILE A 83 130.437 1.325 5.918 1.00 0.00 N ATOM 907 CA ILE A 83 129.728 2.498 6.509 1.00 0.00 C ATOM 908 C ILE A 83 130.220 2.762 7.937 1.00 0.00 C ATOM 909 O ILE A 83 130.454 1.851 8.702 1.00 0.00 O ATOM 910 CB ILE A 83 128.252 2.102 6.515 1.00 0.00 C ATOM 911 CG1 ILE A 83 127.625 2.457 5.164 1.00 0.00 C ATOM 912 CG2 ILE A 83 127.525 2.858 7.628 1.00 0.00 C ATOM 913 CD1 ILE A 83 126.199 1.905 5.102 1.00 0.00 C ATOM 0 H ILE A 83 130.531 0.518 6.535 1.00 0.00 H new ATOM 0 HA ILE A 83 129.906 3.413 5.944 1.00 0.00 H new ATOM 0 HB ILE A 83 128.164 1.029 6.688 1.00 0.00 H new ATOM 0 HG12 ILE A 83 127.614 3.539 5.029 1.00 0.00 H new ATOM 0 HG13 ILE A 83 128.223 2.041 4.353 1.00 0.00 H new ATOM 0 HG21 ILE A 83 126.472 2.576 7.632 1.00 0.00 H new ATOM 0 HG22 ILE A 83 127.972 2.607 8.590 1.00 0.00 H new ATOM 0 HG23 ILE A 83 127.612 3.931 7.456 1.00 0.00 H new ATOM 0 HD11 ILE A 83 125.753 2.158 4.140 1.00 0.00 H new ATOM 0 HD12 ILE A 83 126.223 0.821 5.217 1.00 0.00 H new ATOM 0 HD13 ILE A 83 125.604 2.342 5.904 1.00 0.00 H new ATOM 925 N GLU A 84 130.373 4.012 8.294 1.00 0.00 N ATOM 926 CA GLU A 84 130.845 4.370 9.670 1.00 0.00 C ATOM 927 C GLU A 84 132.329 4.022 9.863 1.00 0.00 C ATOM 928 O GLU A 84 132.883 4.227 10.923 1.00 0.00 O ATOM 929 CB GLU A 84 129.969 3.569 10.634 1.00 0.00 C ATOM 930 CG GLU A 84 129.400 4.507 11.700 1.00 0.00 C ATOM 931 CD GLU A 84 130.356 4.563 12.895 1.00 0.00 C ATOM 932 OE1 GLU A 84 131.373 5.227 12.784 1.00 0.00 O ATOM 933 OE2 GLU A 84 130.054 3.940 13.899 1.00 0.00 O ATOM 0 H GLU A 84 130.189 4.810 7.685 1.00 0.00 H new ATOM 0 HA GLU A 84 130.761 5.442 9.846 1.00 0.00 H new ATOM 0 HB2 GLU A 84 129.158 3.085 10.090 1.00 0.00 H new ATOM 0 HB3 GLU A 84 130.554 2.779 11.104 1.00 0.00 H new ATOM 0 HG2 GLU A 84 129.262 5.505 11.285 1.00 0.00 H new ATOM 0 HG3 GLU A 84 128.419 4.157 12.022 1.00 0.00 H new ATOM 940 N GLY A 85 132.988 3.520 8.851 1.00 0.00 N ATOM 941 CA GLY A 85 134.437 3.197 9.004 1.00 0.00 C ATOM 942 C GLY A 85 134.652 1.693 9.208 1.00 0.00 C ATOM 943 O GLY A 85 135.674 1.277 9.717 1.00 0.00 O ATOM 0 H GLY A 85 132.590 3.321 7.933 1.00 0.00 H new ATOM 0 HA2 GLY A 85 134.981 3.528 8.120 1.00 0.00 H new ATOM 0 HA3 GLY A 85 134.846 3.744 9.853 1.00 0.00 H new ATOM 947 N HIS A 86 133.723 0.866 8.809 1.00 0.00 N ATOM 948 CA HIS A 86 133.931 -0.603 8.988 1.00 0.00 C ATOM 949 C HIS A 86 133.485 -1.354 7.729 1.00 0.00 C ATOM 950 O HIS A 86 132.712 -0.853 6.937 1.00 0.00 O ATOM 951 CB HIS A 86 133.088 -0.997 10.210 1.00 0.00 C ATOM 952 CG HIS A 86 131.708 -1.426 9.788 1.00 0.00 C ATOM 953 ND1 HIS A 86 130.846 -0.951 8.835 1.00 0.00 N flip ATOM 954 CD2 HIS A 86 131.050 -2.487 10.395 1.00 0.00 C flip ATOM 955 CE1 HIS A 86 129.672 -1.698 8.845 1.00 0.00 C flip ATOM 956 NE2 HIS A 86 129.848 -2.611 9.803 1.00 0.00 N flip ATOM 0 H HIS A 86 132.841 1.137 8.373 1.00 0.00 H new ATOM 0 HA HIS A 86 134.980 -0.856 9.144 1.00 0.00 H new ATOM 0 HB2 HIS A 86 133.577 -1.808 10.750 1.00 0.00 H new ATOM 0 HB3 HIS A 86 133.018 -0.154 10.897 1.00 0.00 H new ATOM 0 HD1 HIS A 86 131.036 -0.167 8.211 1.00 0.00 H new ATOM 0 HD2 HIS A 86 131.433 -3.101 11.197 1.00 0.00 H new ATOM 0 HE1 HIS A 86 128.805 -1.567 8.214 1.00 0.00 H new ATOM 964 N LYS A 87 133.972 -2.548 7.533 1.00 0.00 N ATOM 965 CA LYS A 87 133.577 -3.320 6.319 1.00 0.00 C ATOM 966 C LYS A 87 132.124 -3.787 6.435 1.00 0.00 C ATOM 967 O LYS A 87 131.440 -3.487 7.394 1.00 0.00 O ATOM 968 CB LYS A 87 134.524 -4.518 6.286 1.00 0.00 C ATOM 969 CG LYS A 87 135.674 -4.233 5.318 1.00 0.00 C ATOM 970 CD LYS A 87 136.658 -3.254 5.964 1.00 0.00 C ATOM 971 CE LYS A 87 137.570 -2.661 4.887 1.00 0.00 C ATOM 972 NZ LYS A 87 138.512 -1.775 5.625 1.00 0.00 N ATOM 0 H LYS A 87 134.624 -3.022 8.158 1.00 0.00 H new ATOM 0 HA LYS A 87 133.645 -2.721 5.411 1.00 0.00 H new ATOM 0 HB2 LYS A 87 134.915 -4.714 7.284 1.00 0.00 H new ATOM 0 HB3 LYS A 87 133.985 -5.413 5.974 1.00 0.00 H new ATOM 0 HG2 LYS A 87 136.185 -5.161 5.061 1.00 0.00 H new ATOM 0 HG3 LYS A 87 135.286 -3.815 4.389 1.00 0.00 H new ATOM 0 HD2 LYS A 87 136.114 -2.458 6.473 1.00 0.00 H new ATOM 0 HD3 LYS A 87 137.254 -3.766 6.719 1.00 0.00 H new ATOM 0 HE2 LYS A 87 138.104 -3.443 4.348 1.00 0.00 H new ATOM 0 HE3 LYS A 87 136.996 -2.100 4.149 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 139.170 -1.332 4.953 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 137.976 -1.036 6.123 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 139.049 -2.338 6.315 1.00 0.00 H new ATOM 986 N GLU A 88 131.648 -4.520 5.464 1.00 0.00 N ATOM 987 CA GLU A 88 130.240 -5.007 5.518 1.00 0.00 C ATOM 988 C GLU A 88 130.213 -6.521 5.747 1.00 0.00 C ATOM 989 O GLU A 88 131.227 -7.186 5.683 1.00 0.00 O ATOM 990 CB GLU A 88 129.646 -4.662 4.152 1.00 0.00 C ATOM 991 CG GLU A 88 129.759 -5.875 3.226 1.00 0.00 C ATOM 992 CD GLU A 88 129.397 -5.463 1.797 1.00 0.00 C ATOM 993 OE1 GLU A 88 128.625 -4.531 1.649 1.00 0.00 O ATOM 994 OE2 GLU A 88 129.898 -6.088 0.878 1.00 0.00 O ATOM 0 H GLU A 88 132.173 -4.802 4.636 1.00 0.00 H new ATOM 0 HA GLU A 88 129.678 -4.551 6.333 1.00 0.00 H new ATOM 0 HB2 GLU A 88 128.601 -4.370 4.261 1.00 0.00 H new ATOM 0 HB3 GLU A 88 130.171 -3.811 3.719 1.00 0.00 H new ATOM 0 HG2 GLU A 88 130.773 -6.274 3.255 1.00 0.00 H new ATOM 0 HG3 GLU A 88 129.094 -6.669 3.566 1.00 0.00 H new ATOM 1001 N ASN A 89 129.060 -7.070 6.013 1.00 0.00 N ATOM 1002 CA ASN A 89 128.969 -8.540 6.247 1.00 0.00 C ATOM 1003 C ASN A 89 128.127 -9.201 5.152 1.00 0.00 C ATOM 1004 O ASN A 89 127.069 -8.723 4.797 1.00 0.00 O ATOM 1005 CB ASN A 89 128.279 -8.682 7.604 1.00 0.00 C ATOM 1006 CG ASN A 89 128.883 -9.865 8.363 1.00 0.00 C ATOM 1007 OD1 ASN A 89 128.212 -10.844 8.619 1.00 0.00 O ATOM 1008 ND2 ASN A 89 130.132 -9.815 8.736 1.00 0.00 N ATOM 0 H ASN A 89 128.176 -6.565 6.079 1.00 0.00 H new ATOM 0 HA ASN A 89 129.947 -9.020 6.231 1.00 0.00 H new ATOM 0 HB2 ASN A 89 128.399 -7.766 8.182 1.00 0.00 H new ATOM 0 HB3 ASN A 89 127.209 -8.834 7.465 1.00 0.00 H new ATOM 0 HD21 ASN A 89 130.545 -10.598 9.243 1.00 0.00 H new ATOM 0 HD22 ASN A 89 130.696 -8.993 8.521 1.00 0.00 H new ATOM 1015 N ILE A 90 128.583 -10.301 4.619 1.00 0.00 N ATOM 1016 CA ILE A 90 127.798 -10.990 3.554 1.00 0.00 C ATOM 1017 C ILE A 90 126.516 -11.572 4.154 1.00 0.00 C ATOM 1018 O ILE A 90 126.533 -12.593 4.812 1.00 0.00 O ATOM 1019 CB ILE A 90 128.710 -12.103 3.040 1.00 0.00 C ATOM 1020 CG1 ILE A 90 129.144 -12.990 4.211 1.00 0.00 C ATOM 1021 CG2 ILE A 90 129.947 -11.488 2.384 1.00 0.00 C ATOM 1022 CD1 ILE A 90 128.693 -14.429 3.956 1.00 0.00 C ATOM 0 H ILE A 90 129.462 -10.752 4.873 1.00 0.00 H new ATOM 0 HA ILE A 90 127.500 -10.315 2.751 1.00 0.00 H new ATOM 0 HB ILE A 90 128.170 -12.704 2.308 1.00 0.00 H new ATOM 0 HG12 ILE A 90 130.227 -12.952 4.327 1.00 0.00 H new ATOM 0 HG13 ILE A 90 128.710 -12.621 5.141 1.00 0.00 H new ATOM 0 HG21 ILE A 90 130.597 -12.282 2.017 1.00 0.00 H new ATOM 0 HG22 ILE A 90 129.641 -10.856 1.550 1.00 0.00 H new ATOM 0 HG23 ILE A 90 130.486 -10.887 3.116 1.00 0.00 H new ATOM 0 HD11 ILE A 90 129.002 -15.060 4.789 1.00 0.00 H new ATOM 0 HD12 ILE A 90 127.608 -14.459 3.861 1.00 0.00 H new ATOM 0 HD13 ILE A 90 129.148 -14.795 3.036 1.00 0.00 H new ATOM 1034 N ILE A 91 125.407 -10.921 3.943 1.00 0.00 N ATOM 1035 CA ILE A 91 124.124 -11.425 4.512 1.00 0.00 C ATOM 1036 C ILE A 91 123.362 -12.267 3.486 1.00 0.00 C ATOM 1037 O ILE A 91 122.598 -13.143 3.838 1.00 0.00 O ATOM 1038 CB ILE A 91 123.332 -10.167 4.854 1.00 0.00 C ATOM 1039 CG1 ILE A 91 122.290 -10.501 5.922 1.00 0.00 C ATOM 1040 CG2 ILE A 91 122.630 -9.653 3.597 1.00 0.00 C ATOM 1041 CD1 ILE A 91 121.229 -9.403 5.954 1.00 0.00 C ATOM 0 H ILE A 91 125.332 -10.060 3.401 1.00 0.00 H new ATOM 0 HA ILE A 91 124.288 -12.066 5.378 1.00 0.00 H new ATOM 0 HB ILE A 91 124.007 -9.399 5.232 1.00 0.00 H new ATOM 0 HG12 ILE A 91 121.827 -11.464 5.706 1.00 0.00 H new ATOM 0 HG13 ILE A 91 122.768 -10.589 6.898 1.00 0.00 H new ATOM 0 HG21 ILE A 91 122.063 -8.754 3.839 1.00 0.00 H new ATOM 0 HG22 ILE A 91 123.373 -9.419 2.835 1.00 0.00 H new ATOM 0 HG23 ILE A 91 121.952 -10.419 3.220 1.00 0.00 H new ATOM 0 HD11 ILE A 91 120.485 -9.638 6.715 1.00 0.00 H new ATOM 0 HD12 ILE A 91 121.700 -8.449 6.190 1.00 0.00 H new ATOM 0 HD13 ILE A 91 120.744 -9.337 4.980 1.00 0.00 H new ATOM 1053 N SER A 92 123.556 -12.011 2.223 1.00 0.00 N ATOM 1054 CA SER A 92 122.831 -12.801 1.191 1.00 0.00 C ATOM 1055 C SER A 92 123.441 -12.540 -0.186 1.00 0.00 C ATOM 1056 O SER A 92 123.219 -11.510 -0.790 1.00 0.00 O ATOM 1057 CB SER A 92 121.391 -12.296 1.243 1.00 0.00 C ATOM 1058 OG SER A 92 120.615 -13.172 2.051 1.00 0.00 O ATOM 0 H SER A 92 124.183 -11.292 1.862 1.00 0.00 H new ATOM 0 HA SER A 92 122.890 -13.874 1.371 1.00 0.00 H new ATOM 0 HB2 SER A 92 121.362 -11.286 1.651 1.00 0.00 H new ATOM 0 HB3 SER A 92 120.974 -12.246 0.237 1.00 0.00 H new ATOM 0 HG SER A 92 121.114 -13.396 2.864 1.00 0.00 H new ATOM 1064 N LYS A 93 124.212 -13.464 -0.682 1.00 0.00 N ATOM 1065 CA LYS A 93 124.842 -13.267 -2.015 1.00 0.00 C ATOM 1066 C LYS A 93 123.995 -13.930 -3.105 1.00 0.00 C ATOM 1067 O LYS A 93 123.330 -14.920 -2.871 1.00 0.00 O ATOM 1068 CB LYS A 93 126.209 -13.942 -1.908 1.00 0.00 C ATOM 1069 CG LYS A 93 127.165 -13.336 -2.936 1.00 0.00 C ATOM 1070 CD LYS A 93 128.213 -14.377 -3.334 1.00 0.00 C ATOM 1071 CE LYS A 93 129.103 -14.695 -2.129 1.00 0.00 C ATOM 1072 NZ LYS A 93 130.493 -14.439 -2.600 1.00 0.00 N ATOM 0 H LYS A 93 124.433 -14.347 -0.222 1.00 0.00 H new ATOM 0 HA LYS A 93 124.928 -12.213 -2.281 1.00 0.00 H new ATOM 0 HB2 LYS A 93 126.611 -13.813 -0.903 1.00 0.00 H new ATOM 0 HB3 LYS A 93 126.110 -15.014 -2.077 1.00 0.00 H new ATOM 0 HG2 LYS A 93 126.610 -13.008 -3.815 1.00 0.00 H new ATOM 0 HG3 LYS A 93 127.652 -12.454 -2.520 1.00 0.00 H new ATOM 0 HD2 LYS A 93 127.723 -15.285 -3.687 1.00 0.00 H new ATOM 0 HD3 LYS A 93 128.819 -14.001 -4.158 1.00 0.00 H new ATOM 0 HE2 LYS A 93 128.853 -14.065 -1.276 1.00 0.00 H new ATOM 0 HE3 LYS A 93 128.979 -15.729 -1.808 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 131.163 -14.635 -1.829 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 130.705 -15.058 -3.408 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 130.583 -13.445 -2.892 1.00 0.00 H new ATOM 1086 N ASN A 94 124.014 -13.394 -4.294 1.00 0.00 N ATOM 1087 CA ASN A 94 123.210 -13.996 -5.397 1.00 0.00 C ATOM 1088 C ASN A 94 123.971 -13.890 -6.722 1.00 0.00 C ATOM 1089 O ASN A 94 123.523 -13.261 -7.659 1.00 0.00 O ATOM 1090 CB ASN A 94 121.925 -13.168 -5.444 1.00 0.00 C ATOM 1091 CG ASN A 94 120.714 -14.100 -5.356 1.00 0.00 C ATOM 1092 OD1 ASN A 94 120.622 -15.108 -6.179 1.00 0.00 O flip ATOM 1093 ND2 ASN A 94 119.844 -13.908 -4.530 1.00 0.00 N flip ATOM 0 H ASN A 94 124.551 -12.566 -4.550 1.00 0.00 H new ATOM 0 HA ASN A 94 123.006 -15.054 -5.234 1.00 0.00 H new ATOM 0 HB2 ASN A 94 121.909 -12.455 -4.620 1.00 0.00 H new ATOM 0 HB3 ASN A 94 121.886 -12.590 -6.367 1.00 0.00 H new ATOM 0 HD21 ASN A 94 119.916 -13.120 -3.887 1.00 0.00 H new ATOM 0 HD22 ASN A 94 119.041 -14.535 -4.480 1.00 0.00 H new ATOM 1100 N THR A 95 125.121 -14.502 -6.806 1.00 0.00 N ATOM 1101 CA THR A 95 125.910 -14.436 -8.070 1.00 0.00 C ATOM 1102 C THR A 95 125.054 -14.902 -9.251 1.00 0.00 C ATOM 1103 O THR A 95 125.225 -14.454 -10.368 1.00 0.00 O ATOM 1104 CB THR A 95 127.089 -15.386 -7.850 1.00 0.00 C ATOM 1105 OG1 THR A 95 128.140 -14.688 -7.198 1.00 0.00 O ATOM 1106 CG2 THR A 95 127.582 -15.910 -9.200 1.00 0.00 C ATOM 0 H THR A 95 125.548 -15.044 -6.055 1.00 0.00 H new ATOM 0 HA THR A 95 126.242 -13.423 -8.300 1.00 0.00 H new ATOM 0 HB THR A 95 126.771 -16.225 -7.232 1.00 0.00 H new ATOM 0 HG1 THR A 95 128.896 -15.295 -7.054 1.00 0.00 H new ATOM 0 HG21 THR A 95 128.422 -16.587 -9.043 1.00 0.00 H new ATOM 0 HG22 THR A 95 126.774 -16.444 -9.700 1.00 0.00 H new ATOM 0 HG23 THR A 95 127.902 -15.073 -9.820 1.00 0.00 H new ATOM 1114 N ALA A 96 124.134 -15.797 -9.013 1.00 0.00 N ATOM 1115 CA ALA A 96 123.269 -16.288 -10.124 1.00 0.00 C ATOM 1116 C ALA A 96 122.431 -15.136 -10.687 1.00 0.00 C ATOM 1117 O ALA A 96 122.375 -14.924 -11.881 1.00 0.00 O ATOM 1118 CB ALA A 96 122.369 -17.349 -9.489 1.00 0.00 C ATOM 0 H ALA A 96 123.944 -16.209 -8.099 1.00 0.00 H new ATOM 0 HA ALA A 96 123.850 -16.693 -10.953 1.00 0.00 H new ATOM 0 HB1 ALA A 96 121.701 -17.760 -10.246 1.00 0.00 H new ATOM 0 HB2 ALA A 96 122.984 -18.148 -9.076 1.00 0.00 H new ATOM 0 HB3 ALA A 96 121.780 -16.896 -8.692 1.00 0.00 H new ATOM 1124 N LYS A 97 121.779 -14.390 -9.836 1.00 0.00 N ATOM 1125 CA LYS A 97 120.948 -13.253 -10.327 1.00 0.00 C ATOM 1126 C LYS A 97 121.739 -11.939 -10.261 1.00 0.00 C ATOM 1127 O LYS A 97 121.192 -10.869 -10.445 1.00 0.00 O ATOM 1128 CB LYS A 97 119.749 -13.201 -9.381 1.00 0.00 C ATOM 1129 CG LYS A 97 118.827 -14.390 -9.656 1.00 0.00 C ATOM 1130 CD LYS A 97 118.497 -15.097 -8.340 1.00 0.00 C ATOM 1131 CE LYS A 97 117.275 -15.997 -8.535 1.00 0.00 C ATOM 1132 NZ LYS A 97 117.395 -17.041 -7.480 1.00 0.00 N ATOM 0 H LYS A 97 121.786 -14.518 -8.824 1.00 0.00 H new ATOM 0 HA LYS A 97 120.646 -13.387 -11.366 1.00 0.00 H new ATOM 0 HB2 LYS A 97 120.089 -13.223 -8.346 1.00 0.00 H new ATOM 0 HB3 LYS A 97 119.205 -12.267 -9.518 1.00 0.00 H new ATOM 0 HG2 LYS A 97 117.910 -14.049 -10.137 1.00 0.00 H new ATOM 0 HG3 LYS A 97 119.308 -15.085 -10.344 1.00 0.00 H new ATOM 0 HD2 LYS A 97 119.350 -15.690 -8.010 1.00 0.00 H new ATOM 0 HD3 LYS A 97 118.299 -14.362 -7.560 1.00 0.00 H new ATOM 0 HE2 LYS A 97 116.348 -15.433 -8.429 1.00 0.00 H new ATOM 0 HE3 LYS A 97 117.266 -16.441 -9.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 116.592 -17.698 -7.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 118.283 -17.566 -7.610 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 117.394 -16.590 -6.543 1.00 0.00 H new ATOM 1146 N ASP A 98 123.017 -12.007 -10.001 1.00 0.00 N ATOM 1147 CA ASP A 98 123.828 -10.757 -9.927 1.00 0.00 C ATOM 1148 C ASP A 98 123.280 -9.831 -8.837 1.00 0.00 C ATOM 1149 O ASP A 98 122.954 -8.687 -9.087 1.00 0.00 O ATOM 1150 CB ASP A 98 123.683 -10.109 -11.304 1.00 0.00 C ATOM 1151 CG ASP A 98 125.070 -9.843 -11.893 1.00 0.00 C ATOM 1152 OD1 ASP A 98 125.850 -9.169 -11.241 1.00 0.00 O ATOM 1153 OD2 ASP A 98 125.328 -10.316 -12.988 1.00 0.00 O ATOM 0 H ASP A 98 123.533 -12.871 -9.837 1.00 0.00 H new ATOM 0 HA ASP A 98 124.870 -10.956 -9.677 1.00 0.00 H new ATOM 0 HB2 ASP A 98 123.114 -10.762 -11.966 1.00 0.00 H new ATOM 0 HB3 ASP A 98 123.126 -9.175 -11.221 1.00 0.00 H new ATOM 1158 N GLU A 99 123.175 -10.315 -7.629 1.00 0.00 N ATOM 1159 CA GLU A 99 122.648 -9.459 -6.526 1.00 0.00 C ATOM 1160 C GLU A 99 123.310 -9.834 -5.196 1.00 0.00 C ATOM 1161 O GLU A 99 123.838 -10.916 -5.037 1.00 0.00 O ATOM 1162 CB GLU A 99 121.147 -9.747 -6.482 1.00 0.00 C ATOM 1163 CG GLU A 99 120.433 -8.914 -7.548 1.00 0.00 C ATOM 1164 CD GLU A 99 118.924 -8.936 -7.290 1.00 0.00 C ATOM 1165 OE1 GLU A 99 118.536 -8.780 -6.145 1.00 0.00 O ATOM 1166 OE2 GLU A 99 118.183 -9.111 -8.245 1.00 0.00 O ATOM 0 H GLU A 99 123.431 -11.264 -7.358 1.00 0.00 H new ATOM 0 HA GLU A 99 122.854 -8.402 -6.692 1.00 0.00 H new ATOM 0 HB2 GLU A 99 120.965 -10.808 -6.653 1.00 0.00 H new ATOM 0 HB3 GLU A 99 120.750 -9.510 -5.495 1.00 0.00 H new ATOM 0 HG2 GLU A 99 120.801 -7.888 -7.529 1.00 0.00 H new ATOM 0 HG3 GLU A 99 120.649 -9.312 -8.540 1.00 0.00 H new ATOM 1173 N ARG A 100 123.285 -8.944 -4.241 1.00 0.00 N ATOM 1174 CA ARG A 100 123.912 -9.242 -2.919 1.00 0.00 C ATOM 1175 C ARG A 100 123.404 -8.258 -1.865 1.00 0.00 C ATOM 1176 O ARG A 100 122.865 -7.217 -2.182 1.00 0.00 O ATOM 1177 CB ARG A 100 125.413 -9.055 -3.144 1.00 0.00 C ATOM 1178 CG ARG A 100 126.193 -9.970 -2.198 1.00 0.00 C ATOM 1179 CD ARG A 100 127.514 -9.300 -1.810 1.00 0.00 C ATOM 1180 NE ARG A 100 128.438 -9.588 -2.946 1.00 0.00 N ATOM 1181 CZ ARG A 100 129.599 -8.986 -3.033 1.00 0.00 C ATOM 1182 NH1 ARG A 100 129.975 -8.119 -2.127 1.00 0.00 N ATOM 1183 NH2 ARG A 100 130.390 -9.252 -4.036 1.00 0.00 N ATOM 0 H ARG A 100 122.857 -8.021 -4.318 1.00 0.00 H new ATOM 0 HA ARG A 100 123.674 -10.244 -2.563 1.00 0.00 H new ATOM 0 HB2 ARG A 100 125.667 -9.284 -4.179 1.00 0.00 H new ATOM 0 HB3 ARG A 100 125.690 -8.015 -2.971 1.00 0.00 H new ATOM 0 HG2 ARG A 100 125.602 -10.176 -1.306 1.00 0.00 H new ATOM 0 HG3 ARG A 100 126.387 -10.928 -2.680 1.00 0.00 H new ATOM 0 HD2 ARG A 100 127.386 -8.227 -1.667 1.00 0.00 H new ATOM 0 HD3 ARG A 100 127.901 -9.702 -0.874 1.00 0.00 H new ATOM 0 HE ARG A 100 128.163 -10.260 -3.662 1.00 0.00 H new ATOM 0 HH11 ARG A 100 129.362 -7.905 -1.341 1.00 0.00 H new ATOM 0 HH12 ARG A 100 130.881 -7.658 -2.207 1.00 0.00 H new ATOM 0 HH21 ARG A 100 130.104 -9.925 -4.747 1.00 0.00 H new ATOM 0 HH22 ARG A 100 131.295 -8.787 -4.109 1.00 0.00 H new ATOM 1197 N THR A 101 123.573 -8.576 -0.614 1.00 0.00 N ATOM 1198 CA THR A 101 123.104 -7.657 0.462 1.00 0.00 C ATOM 1199 C THR A 101 124.121 -7.643 1.607 1.00 0.00 C ATOM 1200 O THR A 101 124.839 -8.600 1.818 1.00 0.00 O ATOM 1201 CB THR A 101 121.771 -8.244 0.925 1.00 0.00 C ATOM 1202 OG1 THR A 101 120.877 -8.308 -0.178 1.00 0.00 O ATOM 1203 CG2 THR A 101 121.171 -7.359 2.018 1.00 0.00 C ATOM 0 H THR A 101 124.017 -9.434 -0.288 1.00 0.00 H new ATOM 0 HA THR A 101 122.993 -6.628 0.121 1.00 0.00 H new ATOM 0 HB THR A 101 121.934 -9.246 1.322 1.00 0.00 H new ATOM 0 HG1 THR A 101 120.022 -8.686 0.116 1.00 0.00 H new ATOM 0 HG21 THR A 101 120.221 -7.780 2.346 1.00 0.00 H new ATOM 0 HG22 THR A 101 121.857 -7.309 2.863 1.00 0.00 H new ATOM 0 HG23 THR A 101 121.007 -6.356 1.625 1.00 0.00 H new ATOM 1211 N SER A 102 124.198 -6.569 2.346 1.00 0.00 N ATOM 1212 CA SER A 102 125.182 -6.516 3.467 1.00 0.00 C ATOM 1213 C SER A 102 124.623 -5.707 4.641 1.00 0.00 C ATOM 1214 O SER A 102 123.939 -4.719 4.460 1.00 0.00 O ATOM 1215 CB SER A 102 126.411 -5.827 2.880 1.00 0.00 C ATOM 1216 OG SER A 102 126.041 -4.548 2.382 1.00 0.00 O ATOM 0 H SER A 102 123.628 -5.732 2.224 1.00 0.00 H new ATOM 0 HA SER A 102 125.412 -7.508 3.855 1.00 0.00 H new ATOM 0 HB2 SER A 102 127.183 -5.723 3.643 1.00 0.00 H new ATOM 0 HB3 SER A 102 126.834 -6.433 2.079 1.00 0.00 H new ATOM 0 HG SER A 102 126.364 -3.853 2.993 1.00 0.00 H new ATOM 1222 N GLU A 103 124.917 -6.119 5.844 1.00 0.00 N ATOM 1223 CA GLU A 103 124.414 -5.375 7.035 1.00 0.00 C ATOM 1224 C GLU A 103 125.459 -4.349 7.487 1.00 0.00 C ATOM 1225 O GLU A 103 126.648 -4.590 7.412 1.00 0.00 O ATOM 1226 CB GLU A 103 124.206 -6.444 8.109 1.00 0.00 C ATOM 1227 CG GLU A 103 123.458 -5.838 9.299 1.00 0.00 C ATOM 1228 CD GLU A 103 123.951 -6.484 10.595 1.00 0.00 C ATOM 1229 OE1 GLU A 103 123.794 -7.686 10.732 1.00 0.00 O ATOM 1230 OE2 GLU A 103 124.478 -5.766 11.428 1.00 0.00 O ATOM 0 H GLU A 103 125.485 -6.940 6.054 1.00 0.00 H new ATOM 0 HA GLU A 103 123.496 -4.826 6.828 1.00 0.00 H new ATOM 0 HB2 GLU A 103 123.640 -7.281 7.699 1.00 0.00 H new ATOM 0 HB3 GLU A 103 125.168 -6.839 8.434 1.00 0.00 H new ATOM 0 HG2 GLU A 103 123.620 -4.761 9.333 1.00 0.00 H new ATOM 0 HG3 GLU A 103 122.385 -5.996 9.187 1.00 0.00 H new ATOM 1237 N PHE A 104 125.030 -3.205 7.950 1.00 0.00 N ATOM 1238 CA PHE A 104 126.011 -2.173 8.397 1.00 0.00 C ATOM 1239 C PHE A 104 125.712 -1.733 9.833 1.00 0.00 C ATOM 1240 O PHE A 104 124.573 -1.664 10.249 1.00 0.00 O ATOM 1241 CB PHE A 104 125.823 -1.004 7.429 1.00 0.00 C ATOM 1242 CG PHE A 104 126.457 -1.344 6.102 1.00 0.00 C ATOM 1243 CD1 PHE A 104 127.838 -1.553 6.020 1.00 0.00 C ATOM 1244 CD2 PHE A 104 125.663 -1.452 4.954 1.00 0.00 C ATOM 1245 CE1 PHE A 104 128.427 -1.870 4.789 1.00 0.00 C ATOM 1246 CE2 PHE A 104 126.250 -1.768 3.724 1.00 0.00 C ATOM 1247 CZ PHE A 104 127.633 -1.977 3.641 1.00 0.00 C ATOM 0 H PHE A 104 124.049 -2.941 8.038 1.00 0.00 H new ATOM 0 HA PHE A 104 127.034 -2.551 8.391 1.00 0.00 H new ATOM 0 HB2 PHE A 104 124.761 -0.796 7.295 1.00 0.00 H new ATOM 0 HB3 PHE A 104 126.275 -0.101 7.840 1.00 0.00 H new ATOM 0 HD1 PHE A 104 128.450 -1.470 6.906 1.00 0.00 H new ATOM 0 HD2 PHE A 104 124.597 -1.291 5.018 1.00 0.00 H new ATOM 0 HE1 PHE A 104 129.493 -2.032 4.726 1.00 0.00 H new ATOM 0 HE2 PHE A 104 125.637 -1.851 2.839 1.00 0.00 H new ATOM 0 HZ PHE A 104 128.086 -2.221 2.692 1.00 0.00 H new ATOM 1257 N GLU A 105 126.733 -1.432 10.592 1.00 0.00 N ATOM 1258 CA GLU A 105 126.516 -0.992 12.001 1.00 0.00 C ATOM 1259 C GLU A 105 126.646 0.531 12.104 1.00 0.00 C ATOM 1260 O GLU A 105 127.597 1.115 11.625 1.00 0.00 O ATOM 1261 CB GLU A 105 127.619 -1.681 12.805 1.00 0.00 C ATOM 1262 CG GLU A 105 127.043 -2.201 14.123 1.00 0.00 C ATOM 1263 CD GLU A 105 128.037 -1.935 15.255 1.00 0.00 C ATOM 1264 OE1 GLU A 105 129.193 -2.292 15.098 1.00 0.00 O ATOM 1265 OE2 GLU A 105 127.625 -1.379 16.260 1.00 0.00 O ATOM 0 H GLU A 105 127.708 -1.472 10.296 1.00 0.00 H new ATOM 0 HA GLU A 105 125.523 -1.251 12.368 1.00 0.00 H new ATOM 0 HB2 GLU A 105 128.041 -2.505 12.230 1.00 0.00 H new ATOM 0 HB3 GLU A 105 128.431 -0.981 13.002 1.00 0.00 H new ATOM 0 HG2 GLU A 105 126.093 -1.710 14.336 1.00 0.00 H new ATOM 0 HG3 GLU A 105 126.840 -3.269 14.047 1.00 0.00 H new ATOM 1272 N VAL A 106 125.697 1.177 12.725 1.00 0.00 N ATOM 1273 CA VAL A 106 125.766 2.661 12.854 1.00 0.00 C ATOM 1274 C VAL A 106 125.094 3.113 14.154 1.00 0.00 C ATOM 1275 O VAL A 106 124.174 2.482 14.636 1.00 0.00 O ATOM 1276 CB VAL A 106 124.997 3.194 11.646 1.00 0.00 C ATOM 1277 CG1 VAL A 106 123.539 2.736 11.726 1.00 0.00 C ATOM 1278 CG2 VAL A 106 125.046 4.724 11.641 1.00 0.00 C ATOM 0 H VAL A 106 124.877 0.742 13.148 1.00 0.00 H new ATOM 0 HA VAL A 106 126.793 3.026 12.883 1.00 0.00 H new ATOM 0 HB VAL A 106 125.451 2.812 10.732 1.00 0.00 H new ATOM 0 HG11 VAL A 106 122.990 3.116 10.864 1.00 0.00 H new ATOM 0 HG12 VAL A 106 123.499 1.647 11.730 1.00 0.00 H new ATOM 0 HG13 VAL A 106 123.087 3.118 12.641 1.00 0.00 H new ATOM 0 HG21 VAL A 106 124.497 5.103 10.779 1.00 0.00 H new ATOM 0 HG22 VAL A 106 124.593 5.106 12.556 1.00 0.00 H new ATOM 0 HG23 VAL A 106 126.083 5.055 11.585 1.00 0.00 H new ATOM 1288 N SER A 107 125.538 4.205 14.719 1.00 0.00 N ATOM 1289 CA SER A 107 124.911 4.696 15.980 1.00 0.00 C ATOM 1290 C SER A 107 123.393 4.751 15.805 1.00 0.00 C ATOM 1291 O SER A 107 122.639 4.408 16.693 1.00 0.00 O ATOM 1292 CB SER A 107 125.484 6.095 16.191 1.00 0.00 C ATOM 1293 OG SER A 107 126.764 6.176 15.577 1.00 0.00 O ATOM 0 H SER A 107 126.305 4.776 14.363 1.00 0.00 H new ATOM 0 HA SER A 107 125.115 4.049 16.833 1.00 0.00 H new ATOM 0 HB2 SER A 107 124.815 6.843 15.764 1.00 0.00 H new ATOM 0 HB3 SER A 107 125.565 6.311 17.256 1.00 0.00 H new ATOM 0 HG SER A 107 127.134 7.074 15.709 1.00 0.00 H new ATOM 1299 N LYS A 108 122.943 5.169 14.653 1.00 0.00 N ATOM 1300 CA LYS A 108 121.477 5.234 14.397 1.00 0.00 C ATOM 1301 C LYS A 108 121.225 5.400 12.897 1.00 0.00 C ATOM 1302 O LYS A 108 122.061 5.066 12.080 1.00 0.00 O ATOM 1303 CB LYS A 108 120.975 6.449 15.179 1.00 0.00 C ATOM 1304 CG LYS A 108 119.992 5.988 16.263 1.00 0.00 C ATOM 1305 CD LYS A 108 118.783 5.301 15.614 1.00 0.00 C ATOM 1306 CE LYS A 108 118.128 4.350 16.623 1.00 0.00 C ATOM 1307 NZ LYS A 108 116.899 5.060 17.078 1.00 0.00 N ATOM 0 H LYS A 108 123.531 5.469 13.875 1.00 0.00 H new ATOM 0 HA LYS A 108 120.959 4.328 14.711 1.00 0.00 H new ATOM 0 HB2 LYS A 108 121.815 6.975 15.634 1.00 0.00 H new ATOM 0 HB3 LYS A 108 120.486 7.152 14.505 1.00 0.00 H new ATOM 0 HG2 LYS A 108 120.488 5.300 16.947 1.00 0.00 H new ATOM 0 HG3 LYS A 108 119.662 6.842 16.854 1.00 0.00 H new ATOM 0 HD2 LYS A 108 118.062 6.048 15.283 1.00 0.00 H new ATOM 0 HD3 LYS A 108 119.098 4.748 14.729 1.00 0.00 H new ATOM 0 HE2 LYS A 108 117.884 3.393 16.162 1.00 0.00 H new ATOM 0 HE3 LYS A 108 118.795 4.140 17.459 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 116.334 4.426 17.679 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 117.167 5.905 17.622 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 116.336 5.345 16.251 1.00 0.00 H new ATOM 1321 N LEU A 109 120.087 5.911 12.521 1.00 0.00 N ATOM 1322 CA LEU A 109 119.803 6.088 11.067 1.00 0.00 C ATOM 1323 C LEU A 109 118.911 7.311 10.837 1.00 0.00 C ATOM 1324 O LEU A 109 117.803 7.202 10.351 1.00 0.00 O ATOM 1325 CB LEU A 109 119.090 4.802 10.622 1.00 0.00 C ATOM 1326 CG LEU A 109 118.291 4.195 11.782 1.00 0.00 C ATOM 1327 CD1 LEU A 109 117.195 5.168 12.223 1.00 0.00 C ATOM 1328 CD2 LEU A 109 117.643 2.889 11.313 1.00 0.00 C ATOM 0 H LEU A 109 119.344 6.213 13.152 1.00 0.00 H new ATOM 0 HA LEU A 109 120.717 6.255 10.497 1.00 0.00 H new ATOM 0 HB2 LEU A 109 118.422 5.021 9.789 1.00 0.00 H new ATOM 0 HB3 LEU A 109 119.823 4.080 10.262 1.00 0.00 H new ATOM 0 HG LEU A 109 118.960 4.002 12.620 1.00 0.00 H new ATOM 0 HD11 LEU A 109 116.631 4.731 13.047 1.00 0.00 H new ATOM 0 HD12 LEU A 109 117.649 6.104 12.550 1.00 0.00 H new ATOM 0 HD13 LEU A 109 116.524 5.363 11.387 1.00 0.00 H new ATOM 0 HD21 LEU A 109 117.073 2.451 12.132 1.00 0.00 H new ATOM 0 HD22 LEU A 109 116.976 3.094 10.476 1.00 0.00 H new ATOM 0 HD23 LEU A 109 118.418 2.191 10.997 1.00 0.00 H new ATOM 1340 N ASN A 110 119.391 8.477 11.178 1.00 0.00 N ATOM 1341 CA ASN A 110 118.577 9.710 10.976 1.00 0.00 C ATOM 1342 C ASN A 110 119.488 10.889 10.618 1.00 0.00 C ATOM 1343 O ASN A 110 119.573 11.860 11.343 1.00 0.00 O ATOM 1344 CB ASN A 110 117.884 9.950 12.317 1.00 0.00 C ATOM 1345 CG ASN A 110 117.069 11.242 12.248 1.00 0.00 C ATOM 1346 OD1 ASN A 110 117.478 12.261 12.768 1.00 0.00 O ATOM 1347 ND2 ASN A 110 115.923 11.243 11.623 1.00 0.00 N ATOM 0 H ASN A 110 120.313 8.629 11.588 1.00 0.00 H new ATOM 0 HA ASN A 110 117.859 9.606 10.162 1.00 0.00 H new ATOM 0 HB2 ASN A 110 117.233 9.110 12.557 1.00 0.00 H new ATOM 0 HB3 ASN A 110 118.625 10.017 13.114 1.00 0.00 H new ATOM 0 HD21 ASN A 110 115.371 12.099 11.571 1.00 0.00 H new ATOM 0 HD22 ASN A 110 115.579 10.388 11.186 1.00 0.00 H new ATOM 1354 N GLY A 111 120.172 10.813 9.508 1.00 0.00 N ATOM 1355 CA GLY A 111 121.077 11.931 9.110 1.00 0.00 C ATOM 1356 C GLY A 111 122.138 11.411 8.137 1.00 0.00 C ATOM 1357 O GLY A 111 122.161 10.247 7.794 1.00 0.00 O ATOM 0 H GLY A 111 120.144 10.026 8.860 1.00 0.00 H new ATOM 0 HA2 GLY A 111 120.501 12.730 8.643 1.00 0.00 H new ATOM 0 HA3 GLY A 111 121.555 12.357 9.992 1.00 0.00 H new ATOM 1361 N LYS A 112 123.017 12.268 7.688 1.00 0.00 N ATOM 1362 CA LYS A 112 124.074 11.821 6.736 1.00 0.00 C ATOM 1363 C LYS A 112 125.237 11.171 7.490 1.00 0.00 C ATOM 1364 O LYS A 112 125.581 11.568 8.586 1.00 0.00 O ATOM 1365 CB LYS A 112 124.537 13.097 6.029 1.00 0.00 C ATOM 1366 CG LYS A 112 125.121 14.070 7.055 1.00 0.00 C ATOM 1367 CD LYS A 112 126.572 14.386 6.691 1.00 0.00 C ATOM 1368 CE LYS A 112 127.509 13.478 7.491 1.00 0.00 C ATOM 1369 NZ LYS A 112 128.753 14.274 7.669 1.00 0.00 N ATOM 0 H LYS A 112 123.048 13.256 7.939 1.00 0.00 H new ATOM 0 HA LYS A 112 123.703 11.076 6.033 1.00 0.00 H new ATOM 0 HB2 LYS A 112 125.286 12.855 5.275 1.00 0.00 H new ATOM 0 HB3 LYS A 112 123.699 13.561 5.509 1.00 0.00 H new ATOM 0 HG2 LYS A 112 124.533 14.987 7.078 1.00 0.00 H new ATOM 0 HG3 LYS A 112 125.072 13.635 8.053 1.00 0.00 H new ATOM 0 HD2 LYS A 112 126.730 14.239 5.623 1.00 0.00 H new ATOM 0 HD3 LYS A 112 126.792 15.432 6.905 1.00 0.00 H new ATOM 0 HE2 LYS A 112 127.072 13.208 8.452 1.00 0.00 H new ATOM 0 HE3 LYS A 112 127.708 12.548 6.959 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 129.446 13.718 8.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 129.150 14.511 6.737 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 128.534 15.150 8.185 1.00 0.00 H new ATOM 1383 N ILE A 113 125.847 10.175 6.908 1.00 0.00 N ATOM 1384 CA ILE A 113 126.991 9.499 7.583 1.00 0.00 C ATOM 1385 C ILE A 113 128.104 9.223 6.571 1.00 0.00 C ATOM 1386 O ILE A 113 127.854 9.021 5.399 1.00 0.00 O ATOM 1387 CB ILE A 113 126.416 8.189 8.124 1.00 0.00 C ATOM 1388 CG1 ILE A 113 125.660 8.468 9.426 1.00 0.00 C ATOM 1389 CG2 ILE A 113 127.556 7.206 8.400 1.00 0.00 C ATOM 1390 CD1 ILE A 113 124.796 7.258 9.784 1.00 0.00 C ATOM 0 H ILE A 113 125.602 9.799 5.992 1.00 0.00 H new ATOM 0 HA ILE A 113 127.425 10.107 8.377 1.00 0.00 H new ATOM 0 HB ILE A 113 125.735 7.759 7.389 1.00 0.00 H new ATOM 0 HG12 ILE A 113 126.365 8.676 10.231 1.00 0.00 H new ATOM 0 HG13 ILE A 113 125.035 9.354 9.313 1.00 0.00 H new ATOM 0 HG21 ILE A 113 127.146 6.272 8.786 1.00 0.00 H new ATOM 0 HG22 ILE A 113 128.099 7.010 7.475 1.00 0.00 H new ATOM 0 HG23 ILE A 113 128.236 7.635 9.136 1.00 0.00 H new ATOM 0 HD11 ILE A 113 124.258 7.457 10.711 1.00 0.00 H new ATOM 0 HD12 ILE A 113 124.081 7.071 8.982 1.00 0.00 H new ATOM 0 HD13 ILE A 113 125.432 6.382 9.914 1.00 0.00 H new ATOM 1402 N ASP A 114 129.333 9.217 7.010 1.00 0.00 N ATOM 1403 CA ASP A 114 130.460 8.959 6.068 1.00 0.00 C ATOM 1404 C ASP A 114 130.535 7.468 5.730 1.00 0.00 C ATOM 1405 O ASP A 114 130.696 6.633 6.597 1.00 0.00 O ATOM 1406 CB ASP A 114 131.714 9.402 6.821 1.00 0.00 C ATOM 1407 CG ASP A 114 131.505 10.810 7.382 1.00 0.00 C ATOM 1408 OD1 ASP A 114 131.575 11.752 6.608 1.00 0.00 O ATOM 1409 OD2 ASP A 114 131.278 10.924 8.575 1.00 0.00 O ATOM 0 H ASP A 114 129.606 9.379 7.979 1.00 0.00 H new ATOM 0 HA ASP A 114 130.341 9.493 5.125 1.00 0.00 H new ATOM 0 HB2 ASP A 114 131.929 8.705 7.631 1.00 0.00 H new ATOM 0 HB3 ASP A 114 132.575 9.390 6.153 1.00 0.00 H new ATOM 1414 N GLY A 115 130.423 7.127 4.474 1.00 0.00 N ATOM 1415 CA GLY A 115 130.490 5.691 4.084 1.00 0.00 C ATOM 1416 C GLY A 115 131.585 5.498 3.034 1.00 0.00 C ATOM 1417 O GLY A 115 132.144 6.448 2.522 1.00 0.00 O ATOM 0 H GLY A 115 130.288 7.781 3.703 1.00 0.00 H new ATOM 0 HA2 GLY A 115 130.698 5.075 4.959 1.00 0.00 H new ATOM 0 HA3 GLY A 115 129.529 5.366 3.686 1.00 0.00 H new ATOM 1421 N LYS A 116 131.897 4.275 2.711 1.00 0.00 N ATOM 1422 CA LYS A 116 132.958 4.019 1.693 1.00 0.00 C ATOM 1423 C LYS A 116 132.620 2.761 0.888 1.00 0.00 C ATOM 1424 O LYS A 116 131.846 1.931 1.315 1.00 0.00 O ATOM 1425 CB LYS A 116 134.240 3.806 2.501 1.00 0.00 C ATOM 1426 CG LYS A 116 134.676 5.128 3.133 1.00 0.00 C ATOM 1427 CD LYS A 116 135.955 4.908 3.944 1.00 0.00 C ATOM 1428 CE LYS A 116 136.824 6.166 3.880 1.00 0.00 C ATOM 1429 NZ LYS A 116 138.133 5.758 4.462 1.00 0.00 N ATOM 0 H LYS A 116 131.465 3.440 3.107 1.00 0.00 H new ATOM 0 HA LYS A 116 133.056 4.839 0.982 1.00 0.00 H new ATOM 0 HB2 LYS A 116 134.073 3.059 3.277 1.00 0.00 H new ATOM 0 HB3 LYS A 116 135.030 3.423 1.854 1.00 0.00 H new ATOM 0 HG2 LYS A 116 134.848 5.875 2.358 1.00 0.00 H new ATOM 0 HG3 LYS A 116 133.886 5.514 3.777 1.00 0.00 H new ATOM 0 HD2 LYS A 116 135.706 4.678 4.980 1.00 0.00 H new ATOM 0 HD3 LYS A 116 136.505 4.053 3.551 1.00 0.00 H new ATOM 0 HE2 LYS A 116 136.939 6.515 2.854 1.00 0.00 H new ATOM 0 HE3 LYS A 116 136.378 6.984 4.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 138.785 6.569 4.453 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 137.993 5.437 5.441 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 138.537 4.983 3.898 1.00 0.00 H new ATOM 1443 N ILE A 117 133.197 2.612 -0.273 1.00 0.00 N ATOM 1444 CA ILE A 117 132.908 1.402 -1.095 1.00 0.00 C ATOM 1445 C ILE A 117 134.036 1.159 -2.096 1.00 0.00 C ATOM 1446 O ILE A 117 134.616 2.083 -2.634 1.00 0.00 O ATOM 1447 CB ILE A 117 131.604 1.715 -1.828 1.00 0.00 C ATOM 1448 CG1 ILE A 117 131.515 0.862 -3.102 1.00 0.00 C ATOM 1449 CG2 ILE A 117 131.571 3.200 -2.196 1.00 0.00 C ATOM 1450 CD1 ILE A 117 132.009 1.670 -4.304 1.00 0.00 C ATOM 0 H ILE A 117 133.854 3.273 -0.687 1.00 0.00 H new ATOM 0 HA ILE A 117 132.825 0.504 -0.483 1.00 0.00 H new ATOM 0 HB ILE A 117 130.757 1.485 -1.182 1.00 0.00 H new ATOM 0 HG12 ILE A 117 132.115 -0.041 -2.988 1.00 0.00 H new ATOM 0 HG13 ILE A 117 130.486 0.543 -3.265 1.00 0.00 H new ATOM 0 HG21 ILE A 117 130.641 3.425 -2.719 1.00 0.00 H new ATOM 0 HG22 ILE A 117 131.631 3.801 -1.289 1.00 0.00 H new ATOM 0 HG23 ILE A 117 132.417 3.433 -2.843 1.00 0.00 H new ATOM 0 HD11 ILE A 117 131.943 1.059 -5.205 1.00 0.00 H new ATOM 0 HD12 ILE A 117 131.391 2.560 -4.423 1.00 0.00 H new ATOM 0 HD13 ILE A 117 133.045 1.967 -4.142 1.00 0.00 H new ATOM 1462 N ASP A 118 134.344 -0.078 -2.358 1.00 0.00 N ATOM 1463 CA ASP A 118 135.424 -0.383 -3.332 1.00 0.00 C ATOM 1464 C ASP A 118 134.812 -0.900 -4.634 1.00 0.00 C ATOM 1465 O ASP A 118 133.695 -1.380 -4.657 1.00 0.00 O ATOM 1466 CB ASP A 118 136.271 -1.466 -2.664 1.00 0.00 C ATOM 1467 CG ASP A 118 137.052 -0.857 -1.498 1.00 0.00 C ATOM 1468 OD1 ASP A 118 138.108 -0.298 -1.746 1.00 0.00 O ATOM 1469 OD2 ASP A 118 136.581 -0.959 -0.377 1.00 0.00 O ATOM 0 H ASP A 118 133.894 -0.892 -1.939 1.00 0.00 H new ATOM 0 HA ASP A 118 136.021 0.494 -3.583 1.00 0.00 H new ATOM 0 HB2 ASP A 118 135.632 -2.273 -2.305 1.00 0.00 H new ATOM 0 HB3 ASP A 118 136.959 -1.902 -3.388 1.00 0.00 H new ATOM 1474 N VAL A 119 135.528 -0.805 -5.716 1.00 0.00 N ATOM 1475 CA VAL A 119 134.983 -1.292 -7.013 1.00 0.00 C ATOM 1476 C VAL A 119 136.020 -2.167 -7.713 1.00 0.00 C ATOM 1477 O VAL A 119 137.210 -1.994 -7.536 1.00 0.00 O ATOM 1478 CB VAL A 119 134.702 -0.029 -7.824 1.00 0.00 C ATOM 1479 CG1 VAL A 119 133.362 -0.175 -8.548 1.00 0.00 C ATOM 1480 CG2 VAL A 119 134.646 1.177 -6.885 1.00 0.00 C ATOM 0 H VAL A 119 136.468 -0.411 -5.760 1.00 0.00 H new ATOM 0 HA VAL A 119 134.085 -1.898 -6.890 1.00 0.00 H new ATOM 0 HB VAL A 119 135.496 0.117 -8.556 1.00 0.00 H new ATOM 0 HG11 VAL A 119 133.161 0.726 -9.127 1.00 0.00 H new ATOM 0 HG12 VAL A 119 133.402 -1.035 -9.217 1.00 0.00 H new ATOM 0 HG13 VAL A 119 132.567 -0.321 -7.816 1.00 0.00 H new ATOM 0 HG21 VAL A 119 134.445 2.079 -7.463 1.00 0.00 H new ATOM 0 HG22 VAL A 119 133.852 1.031 -6.153 1.00 0.00 H new ATOM 0 HG23 VAL A 119 135.601 1.281 -6.369 1.00 0.00 H new ATOM 1490 N TYR A 120 135.584 -3.109 -8.502 1.00 0.00 N ATOM 1491 CA TYR A 120 136.557 -3.994 -9.203 1.00 0.00 C ATOM 1492 C TYR A 120 135.967 -4.504 -10.520 1.00 0.00 C ATOM 1493 O TYR A 120 135.186 -5.434 -10.543 1.00 0.00 O ATOM 1494 CB TYR A 120 136.798 -5.156 -8.237 1.00 0.00 C ATOM 1495 CG TYR A 120 137.696 -6.178 -8.891 1.00 0.00 C ATOM 1496 CD1 TYR A 120 138.846 -5.765 -9.574 1.00 0.00 C ATOM 1497 CD2 TYR A 120 137.380 -7.540 -8.813 1.00 0.00 C ATOM 1498 CE1 TYR A 120 139.679 -6.713 -10.180 1.00 0.00 C ATOM 1499 CE2 TYR A 120 138.212 -8.488 -9.419 1.00 0.00 C ATOM 1500 CZ TYR A 120 139.362 -8.074 -10.104 1.00 0.00 C ATOM 1501 OH TYR A 120 140.183 -9.008 -10.702 1.00 0.00 O ATOM 0 H TYR A 120 134.601 -3.304 -8.692 1.00 0.00 H new ATOM 0 HA TYR A 120 137.480 -3.472 -9.456 1.00 0.00 H new ATOM 0 HB2 TYR A 120 137.256 -4.790 -7.318 1.00 0.00 H new ATOM 0 HB3 TYR A 120 135.849 -5.615 -7.960 1.00 0.00 H new ATOM 0 HD1 TYR A 120 139.091 -4.715 -9.633 1.00 0.00 H new ATOM 0 HD2 TYR A 120 136.494 -7.859 -8.285 1.00 0.00 H new ATOM 0 HE1 TYR A 120 140.566 -6.394 -10.706 1.00 0.00 H new ATOM 0 HE2 TYR A 120 137.968 -9.538 -9.359 1.00 0.00 H new ATOM 0 HH TYR A 120 139.819 -9.906 -10.554 1.00 0.00 H new ATOM 1511 N ILE A 121 136.340 -3.905 -11.617 1.00 0.00 N ATOM 1512 CA ILE A 121 135.806 -4.358 -12.933 1.00 0.00 C ATOM 1513 C ILE A 121 136.952 -4.576 -13.920 1.00 0.00 C ATOM 1514 O ILE A 121 137.992 -3.954 -13.827 1.00 0.00 O ATOM 1515 CB ILE A 121 134.897 -3.228 -13.411 1.00 0.00 C ATOM 1516 CG1 ILE A 121 133.790 -2.998 -12.380 1.00 0.00 C ATOM 1517 CG2 ILE A 121 134.274 -3.612 -14.755 1.00 0.00 C ATOM 1518 CD1 ILE A 121 133.176 -1.613 -12.591 1.00 0.00 C ATOM 0 H ILE A 121 136.992 -3.121 -11.659 1.00 0.00 H new ATOM 0 HA ILE A 121 135.268 -5.303 -12.853 1.00 0.00 H new ATOM 0 HB ILE A 121 135.479 -2.314 -13.529 1.00 0.00 H new ATOM 0 HG12 ILE A 121 133.023 -3.766 -12.477 1.00 0.00 H new ATOM 0 HG13 ILE A 121 134.195 -3.078 -11.371 1.00 0.00 H new ATOM 0 HG21 ILE A 121 133.625 -2.807 -15.098 1.00 0.00 H new ATOM 0 HG22 ILE A 121 135.064 -3.779 -15.488 1.00 0.00 H new ATOM 0 HG23 ILE A 121 133.689 -4.524 -14.638 1.00 0.00 H new ATOM 0 HD11 ILE A 121 132.387 -1.449 -11.857 1.00 0.00 H new ATOM 0 HD12 ILE A 121 133.947 -0.851 -12.472 1.00 0.00 H new ATOM 0 HD13 ILE A 121 132.756 -1.550 -13.595 1.00 0.00 H new ATOM 1530 N ASP A 122 136.771 -5.455 -14.863 1.00 0.00 N ATOM 1531 CA ASP A 122 137.849 -5.715 -15.857 1.00 0.00 C ATOM 1532 C ASP A 122 137.263 -6.384 -17.102 1.00 0.00 C ATOM 1533 O ASP A 122 137.074 -7.583 -17.143 1.00 0.00 O ATOM 1534 CB ASP A 122 138.819 -6.658 -15.145 1.00 0.00 C ATOM 1535 CG ASP A 122 138.029 -7.638 -14.276 1.00 0.00 C ATOM 1536 OD1 ASP A 122 137.631 -8.670 -14.792 1.00 0.00 O ATOM 1537 OD2 ASP A 122 137.834 -7.341 -13.108 1.00 0.00 O ATOM 0 H ASP A 122 135.922 -6.006 -14.989 1.00 0.00 H new ATOM 0 HA ASP A 122 138.340 -4.800 -16.189 1.00 0.00 H new ATOM 0 HB2 ASP A 122 139.416 -7.203 -15.876 1.00 0.00 H new ATOM 0 HB3 ASP A 122 139.513 -6.086 -14.529 1.00 0.00 H new ATOM 1542 N GLU A 123 136.970 -5.616 -18.116 1.00 0.00 N ATOM 1543 CA GLU A 123 136.392 -6.211 -19.355 1.00 0.00 C ATOM 1544 C GLU A 123 136.277 -5.150 -20.453 1.00 0.00 C ATOM 1545 O GLU A 123 136.703 -4.024 -20.288 1.00 0.00 O ATOM 1546 CB GLU A 123 135.007 -6.710 -18.946 1.00 0.00 C ATOM 1547 CG GLU A 123 134.321 -5.657 -18.073 1.00 0.00 C ATOM 1548 CD GLU A 123 132.903 -6.118 -17.734 1.00 0.00 C ATOM 1549 OE1 GLU A 123 132.513 -7.169 -18.215 1.00 0.00 O ATOM 1550 OE2 GLU A 123 132.231 -5.411 -17.001 1.00 0.00 O ATOM 0 H GLU A 123 137.105 -4.605 -18.140 1.00 0.00 H new ATOM 0 HA GLU A 123 137.014 -7.012 -19.754 1.00 0.00 H new ATOM 0 HB2 GLU A 123 134.405 -6.911 -19.832 1.00 0.00 H new ATOM 0 HB3 GLU A 123 135.094 -7.649 -18.400 1.00 0.00 H new ATOM 0 HG2 GLU A 123 134.892 -5.500 -17.158 1.00 0.00 H new ATOM 0 HG3 GLU A 123 134.288 -4.701 -18.596 1.00 0.00 H new ATOM 1557 N LYS A 124 135.708 -5.503 -21.573 1.00 0.00 N ATOM 1558 CA LYS A 124 135.567 -4.516 -22.683 1.00 0.00 C ATOM 1559 C LYS A 124 134.232 -3.776 -22.572 1.00 0.00 C ATOM 1560 O LYS A 124 133.187 -4.308 -22.892 1.00 0.00 O ATOM 1561 CB LYS A 124 135.611 -5.353 -23.961 1.00 0.00 C ATOM 1562 CG LYS A 124 137.047 -5.413 -24.484 1.00 0.00 C ATOM 1563 CD LYS A 124 137.776 -6.594 -23.839 1.00 0.00 C ATOM 1564 CE LYS A 124 138.297 -7.531 -24.932 1.00 0.00 C ATOM 1565 NZ LYS A 124 138.432 -8.858 -24.269 1.00 0.00 N ATOM 0 H LYS A 124 135.334 -6.432 -21.768 1.00 0.00 H new ATOM 0 HA LYS A 124 136.350 -3.758 -22.662 1.00 0.00 H new ATOM 0 HB2 LYS A 124 135.243 -6.360 -23.762 1.00 0.00 H new ATOM 0 HB3 LYS A 124 134.956 -4.918 -24.716 1.00 0.00 H new ATOM 0 HG2 LYS A 124 137.046 -5.521 -25.569 1.00 0.00 H new ATOM 0 HG3 LYS A 124 137.567 -4.483 -24.257 1.00 0.00 H new ATOM 0 HD2 LYS A 124 138.604 -6.234 -23.228 1.00 0.00 H new ATOM 0 HD3 LYS A 124 137.101 -7.133 -23.175 1.00 0.00 H new ATOM 0 HE2 LYS A 124 137.606 -7.579 -25.774 1.00 0.00 H new ATOM 0 HE3 LYS A 124 139.254 -7.186 -25.324 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 138.785 -9.555 -24.956 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 139.101 -8.784 -23.476 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 137.504 -9.163 -23.912 1.00 0.00 H new ATOM 1579 N VAL A 125 134.258 -2.550 -22.124 1.00 0.00 N ATOM 1580 CA VAL A 125 132.990 -1.777 -21.996 1.00 0.00 C ATOM 1581 C VAL A 125 132.529 -1.292 -23.373 1.00 0.00 C ATOM 1582 O VAL A 125 132.964 -0.267 -23.859 1.00 0.00 O ATOM 1583 CB VAL A 125 133.338 -0.590 -21.098 1.00 0.00 C ATOM 1584 CG1 VAL A 125 132.289 0.510 -21.273 1.00 0.00 C ATOM 1585 CG2 VAL A 125 133.357 -1.047 -19.637 1.00 0.00 C ATOM 0 H VAL A 125 135.102 -2.051 -21.841 1.00 0.00 H new ATOM 0 HA VAL A 125 132.180 -2.376 -21.581 1.00 0.00 H new ATOM 0 HB VAL A 125 134.319 -0.202 -21.373 1.00 0.00 H new ATOM 0 HG11 VAL A 125 132.538 1.356 -20.632 1.00 0.00 H new ATOM 0 HG12 VAL A 125 132.273 0.835 -22.313 1.00 0.00 H new ATOM 0 HG13 VAL A 125 131.307 0.124 -20.998 1.00 0.00 H new ATOM 0 HG21 VAL A 125 133.605 -0.202 -18.995 1.00 0.00 H new ATOM 0 HG22 VAL A 125 132.375 -1.434 -19.364 1.00 0.00 H new ATOM 0 HG23 VAL A 125 134.104 -1.830 -19.511 1.00 0.00 H new ATOM 1595 N ASN A 126 131.651 -2.021 -24.006 1.00 0.00 N ATOM 1596 CA ASN A 126 131.165 -1.600 -25.351 1.00 0.00 C ATOM 1597 C ASN A 126 132.334 -1.543 -26.340 1.00 0.00 C ATOM 1598 O ASN A 126 132.464 -0.611 -27.109 1.00 0.00 O ATOM 1599 CB ASN A 126 130.575 -0.205 -25.135 1.00 0.00 C ATOM 1600 CG ASN A 126 129.162 -0.151 -25.719 1.00 0.00 C ATOM 1601 OD1 ASN A 126 128.285 0.476 -25.160 1.00 0.00 O ATOM 1602 ND2 ASN A 126 128.903 -0.788 -26.828 1.00 0.00 N ATOM 0 H ASN A 126 131.250 -2.889 -23.651 1.00 0.00 H new ATOM 0 HA ASN A 126 130.433 -2.294 -25.765 1.00 0.00 H new ATOM 0 HB2 ASN A 126 130.549 0.029 -24.071 1.00 0.00 H new ATOM 0 HB3 ASN A 126 131.206 0.546 -25.611 1.00 0.00 H new ATOM 0 HD21 ASN A 126 127.964 -0.759 -27.225 1.00 0.00 H new ATOM 0 HD22 ASN A 126 129.640 -1.315 -27.298 1.00 0.00 H new ATOM 1609 N GLY A 127 133.184 -2.534 -26.327 1.00 0.00 N ATOM 1610 CA GLY A 127 134.342 -2.535 -27.265 1.00 0.00 C ATOM 1611 C GLY A 127 135.444 -1.629 -26.716 1.00 0.00 C ATOM 1612 O GLY A 127 136.205 -1.040 -27.459 1.00 0.00 O ATOM 0 H GLY A 127 133.126 -3.342 -25.708 1.00 0.00 H new ATOM 0 HA2 GLY A 127 134.720 -3.549 -27.392 1.00 0.00 H new ATOM 0 HA3 GLY A 127 134.027 -2.187 -28.249 1.00 0.00 H new ATOM 1616 N LYS A 128 135.537 -1.513 -25.420 1.00 0.00 N ATOM 1617 CA LYS A 128 136.591 -0.645 -24.821 1.00 0.00 C ATOM 1618 C LYS A 128 137.092 -1.251 -23.504 1.00 0.00 C ATOM 1619 O LYS A 128 136.387 -1.234 -22.514 1.00 0.00 O ATOM 1620 CB LYS A 128 135.897 0.692 -24.559 1.00 0.00 C ATOM 1621 CG LYS A 128 136.522 1.776 -25.439 1.00 0.00 C ATOM 1622 CD LYS A 128 135.707 3.065 -25.315 1.00 0.00 C ATOM 1623 CE LYS A 128 134.550 3.033 -26.315 1.00 0.00 C ATOM 1624 NZ LYS A 128 133.615 4.098 -25.856 1.00 0.00 N ATOM 0 H LYS A 128 134.928 -1.982 -24.749 1.00 0.00 H new ATOM 0 HA LYS A 128 137.458 -0.538 -25.474 1.00 0.00 H new ATOM 0 HB2 LYS A 128 134.831 0.607 -24.771 1.00 0.00 H new ATOM 0 HB3 LYS A 128 135.993 0.963 -23.508 1.00 0.00 H new ATOM 0 HG2 LYS A 128 137.554 1.955 -25.137 1.00 0.00 H new ATOM 0 HG3 LYS A 128 136.547 1.447 -26.478 1.00 0.00 H new ATOM 0 HD2 LYS A 128 135.322 3.169 -24.300 1.00 0.00 H new ATOM 0 HD3 LYS A 128 136.343 3.930 -25.505 1.00 0.00 H new ATOM 0 HE2 LYS A 128 134.900 3.225 -27.329 1.00 0.00 H new ATOM 0 HE3 LYS A 128 134.063 2.058 -26.325 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 132.794 4.138 -26.493 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 133.294 3.885 -24.890 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 134.104 5.016 -25.864 1.00 0.00 H new ATOM 1638 N PRO A 129 138.292 -1.770 -23.531 1.00 0.00 N ATOM 1639 CA PRO A 129 138.875 -2.382 -22.312 1.00 0.00 C ATOM 1640 C PRO A 129 138.788 -1.405 -21.136 1.00 0.00 C ATOM 1641 O PRO A 129 139.489 -0.415 -21.087 1.00 0.00 O ATOM 1642 CB PRO A 129 140.329 -2.649 -22.695 1.00 0.00 C ATOM 1643 CG PRO A 129 140.344 -2.696 -24.190 1.00 0.00 C ATOM 1644 CD PRO A 129 139.208 -1.834 -24.676 1.00 0.00 C ATOM 0 HA PRO A 129 138.356 -3.287 -21.997 1.00 0.00 H new ATOM 0 HB2 PRO A 129 140.985 -1.863 -22.320 1.00 0.00 H new ATOM 0 HB3 PRO A 129 140.681 -3.588 -22.269 1.00 0.00 H new ATOM 0 HG2 PRO A 129 141.296 -2.331 -24.577 1.00 0.00 H new ATOM 0 HG3 PRO A 129 140.228 -3.720 -24.544 1.00 0.00 H new ATOM 0 HD2 PRO A 129 139.556 -0.842 -24.964 1.00 0.00 H new ATOM 0 HD3 PRO A 129 138.724 -2.269 -25.550 1.00 0.00 H new ATOM 1652 N PHE A 130 137.929 -1.673 -20.191 1.00 0.00 N ATOM 1653 CA PHE A 130 137.796 -0.756 -19.022 1.00 0.00 C ATOM 1654 C PHE A 130 138.329 -1.426 -17.753 1.00 0.00 C ATOM 1655 O PHE A 130 137.837 -2.451 -17.327 1.00 0.00 O ATOM 1656 CB PHE A 130 136.296 -0.489 -18.894 1.00 0.00 C ATOM 1657 CG PHE A 130 136.027 0.250 -17.606 1.00 0.00 C ATOM 1658 CD1 PHE A 130 136.699 1.447 -17.334 1.00 0.00 C ATOM 1659 CD2 PHE A 130 135.106 -0.262 -16.684 1.00 0.00 C ATOM 1660 CE1 PHE A 130 136.450 2.133 -16.139 1.00 0.00 C ATOM 1661 CE2 PHE A 130 134.858 0.424 -15.489 1.00 0.00 C ATOM 1662 CZ PHE A 130 135.530 1.622 -15.217 1.00 0.00 C ATOM 0 H PHE A 130 137.314 -2.486 -20.177 1.00 0.00 H new ATOM 0 HA PHE A 130 138.366 0.163 -19.157 1.00 0.00 H new ATOM 0 HB2 PHE A 130 135.946 0.098 -19.743 1.00 0.00 H new ATOM 0 HB3 PHE A 130 135.745 -1.430 -18.908 1.00 0.00 H new ATOM 0 HD1 PHE A 130 137.409 1.841 -18.045 1.00 0.00 H new ATOM 0 HD2 PHE A 130 134.587 -1.186 -16.895 1.00 0.00 H new ATOM 0 HE1 PHE A 130 136.968 3.057 -15.929 1.00 0.00 H new ATOM 0 HE2 PHE A 130 134.148 0.029 -14.777 1.00 0.00 H new ATOM 0 HZ PHE A 130 135.338 2.152 -14.296 1.00 0.00 H new ATOM 1672 N LYS A 131 139.330 -0.851 -17.143 1.00 0.00 N ATOM 1673 CA LYS A 131 139.893 -1.452 -15.899 1.00 0.00 C ATOM 1674 C LYS A 131 139.476 -0.626 -14.679 1.00 0.00 C ATOM 1675 O LYS A 131 139.825 0.530 -14.552 1.00 0.00 O ATOM 1676 CB LYS A 131 141.409 -1.406 -16.086 1.00 0.00 C ATOM 1677 CG LYS A 131 141.952 -2.831 -16.208 1.00 0.00 C ATOM 1678 CD LYS A 131 141.253 -3.546 -17.367 1.00 0.00 C ATOM 1679 CE LYS A 131 142.283 -4.334 -18.178 1.00 0.00 C ATOM 1680 NZ LYS A 131 141.482 -5.302 -18.978 1.00 0.00 N ATOM 0 H LYS A 131 139.783 0.009 -17.452 1.00 0.00 H new ATOM 0 HA LYS A 131 139.535 -2.468 -15.732 1.00 0.00 H new ATOM 0 HB2 LYS A 131 141.659 -0.833 -16.979 1.00 0.00 H new ATOM 0 HB3 LYS A 131 141.875 -0.899 -15.241 1.00 0.00 H new ATOM 0 HG2 LYS A 131 143.029 -2.808 -16.377 1.00 0.00 H new ATOM 0 HG3 LYS A 131 141.787 -3.375 -15.278 1.00 0.00 H new ATOM 0 HD2 LYS A 131 140.486 -4.218 -16.983 1.00 0.00 H new ATOM 0 HD3 LYS A 131 140.750 -2.820 -18.006 1.00 0.00 H new ATOM 0 HE2 LYS A 131 142.866 -3.676 -18.822 1.00 0.00 H new ATOM 0 HE3 LYS A 131 142.989 -4.849 -17.526 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 142.119 -5.881 -19.562 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 140.943 -5.919 -18.338 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 140.824 -4.783 -19.594 1.00 0.00 H new ATOM 1694 N TYR A 132 138.732 -1.209 -13.778 1.00 0.00 N ATOM 1695 CA TYR A 132 138.296 -0.454 -12.567 1.00 0.00 C ATOM 1696 C TYR A 132 138.675 -1.227 -11.301 1.00 0.00 C ATOM 1697 O TYR A 132 138.265 -2.353 -11.106 1.00 0.00 O ATOM 1698 CB TYR A 132 136.777 -0.350 -12.694 1.00 0.00 C ATOM 1699 CG TYR A 132 136.296 0.925 -12.039 1.00 0.00 C ATOM 1700 CD1 TYR A 132 136.858 2.155 -12.402 1.00 0.00 C ATOM 1701 CD2 TYR A 132 135.286 0.873 -11.072 1.00 0.00 C ATOM 1702 CE1 TYR A 132 136.407 3.335 -11.797 1.00 0.00 C ATOM 1703 CE2 TYR A 132 134.835 2.053 -10.468 1.00 0.00 C ATOM 1704 CZ TYR A 132 135.395 3.283 -10.830 1.00 0.00 C ATOM 1705 OH TYR A 132 134.950 4.446 -10.236 1.00 0.00 O ATOM 0 H TYR A 132 138.407 -2.175 -13.828 1.00 0.00 H new ATOM 0 HA TYR A 132 138.768 0.526 -12.497 1.00 0.00 H new ATOM 0 HB2 TYR A 132 136.489 -0.361 -13.745 1.00 0.00 H new ATOM 0 HB3 TYR A 132 136.303 -1.212 -12.225 1.00 0.00 H new ATOM 0 HD1 TYR A 132 137.638 2.194 -13.148 1.00 0.00 H new ATOM 0 HD2 TYR A 132 134.855 -0.077 -10.792 1.00 0.00 H new ATOM 0 HE1 TYR A 132 136.839 4.285 -12.076 1.00 0.00 H new ATOM 0 HE2 TYR A 132 134.055 2.014 -9.722 1.00 0.00 H new ATOM 0 HH TYR A 132 135.693 4.877 -9.764 1.00 0.00 H new ATOM 1715 N ASP A 133 139.456 -0.636 -10.438 1.00 0.00 N ATOM 1716 CA ASP A 133 139.855 -1.346 -9.189 1.00 0.00 C ATOM 1717 C ASP A 133 140.482 -0.366 -8.195 1.00 0.00 C ATOM 1718 O ASP A 133 141.677 -0.148 -8.195 1.00 0.00 O ATOM 1719 CB ASP A 133 140.884 -2.385 -9.636 1.00 0.00 C ATOM 1720 CG ASP A 133 141.266 -3.269 -8.446 1.00 0.00 C ATOM 1721 OD1 ASP A 133 140.368 -3.822 -7.833 1.00 0.00 O ATOM 1722 OD2 ASP A 133 142.449 -3.375 -8.168 1.00 0.00 O ATOM 0 H ASP A 133 139.834 0.305 -10.543 1.00 0.00 H new ATOM 0 HA ASP A 133 139.003 -1.803 -8.687 1.00 0.00 H new ATOM 0 HB2 ASP A 133 140.474 -2.996 -10.440 1.00 0.00 H new ATOM 0 HB3 ASP A 133 141.769 -1.888 -10.033 1.00 0.00 H new ATOM 1727 N HIS A 134 139.688 0.224 -7.343 1.00 0.00 N ATOM 1728 CA HIS A 134 140.249 1.185 -6.348 1.00 0.00 C ATOM 1729 C HIS A 134 139.353 1.253 -5.108 1.00 0.00 C ATOM 1730 O HIS A 134 138.502 0.412 -4.896 1.00 0.00 O ATOM 1731 CB HIS A 134 140.277 2.534 -7.066 1.00 0.00 C ATOM 1732 CG HIS A 134 141.634 3.162 -6.896 1.00 0.00 C ATOM 1733 ND1 HIS A 134 141.872 4.174 -5.979 1.00 0.00 N ATOM 1734 CD2 HIS A 134 142.836 2.931 -7.518 1.00 0.00 C ATOM 1735 CE1 HIS A 134 143.171 4.511 -6.075 1.00 0.00 C ATOM 1736 NE2 HIS A 134 143.805 3.784 -6.998 1.00 0.00 N ATOM 0 H HIS A 134 138.679 0.084 -7.292 1.00 0.00 H new ATOM 0 HA HIS A 134 141.240 0.887 -6.005 1.00 0.00 H new ATOM 0 HB2 HIS A 134 140.056 2.400 -8.125 1.00 0.00 H new ATOM 0 HB3 HIS A 134 139.507 3.190 -6.661 1.00 0.00 H new ATOM 0 HD2 HIS A 134 143.004 2.198 -8.293 1.00 0.00 H new ATOM 0 HE1 HIS A 134 143.644 5.277 -5.478 1.00 0.00 H new ATOM 0 HE2 HIS A 134 144.788 3.841 -7.265 1.00 0.00 H new ATOM 1744 N HIS A 135 139.539 2.252 -4.288 1.00 0.00 N ATOM 1745 CA HIS A 135 138.700 2.379 -3.061 1.00 0.00 C ATOM 1746 C HIS A 135 137.946 3.711 -3.078 1.00 0.00 C ATOM 1747 O HIS A 135 138.395 4.698 -2.530 1.00 0.00 O ATOM 1748 CB HIS A 135 139.692 2.336 -1.897 1.00 0.00 C ATOM 1749 CG HIS A 135 138.939 2.203 -0.602 1.00 0.00 C ATOM 1750 ND1 HIS A 135 139.217 1.200 0.314 1.00 0.00 N ATOM 1751 CD2 HIS A 135 137.916 2.937 -0.055 1.00 0.00 C ATOM 1752 CE1 HIS A 135 138.378 1.356 1.354 1.00 0.00 C ATOM 1753 NE2 HIS A 135 137.564 2.401 1.181 1.00 0.00 N ATOM 0 H HIS A 135 140.236 2.986 -4.415 1.00 0.00 H new ATOM 0 HA HIS A 135 137.952 1.590 -2.985 1.00 0.00 H new ATOM 0 HB2 HIS A 135 140.377 1.497 -2.020 1.00 0.00 H new ATOM 0 HB3 HIS A 135 140.297 3.243 -1.887 1.00 0.00 H new ATOM 0 HD1 HIS A 135 139.928 0.475 0.217 1.00 0.00 H new ATOM 0 HD2 HIS A 135 137.454 3.799 -0.514 1.00 0.00 H new ATOM 0 HE1 HIS A 135 138.364 0.715 2.223 1.00 0.00 H new ATOM 1761 N TYR A 136 136.802 3.745 -3.704 1.00 0.00 N ATOM 1762 CA TYR A 136 136.016 5.012 -3.760 1.00 0.00 C ATOM 1763 C TYR A 136 135.143 5.154 -2.510 1.00 0.00 C ATOM 1764 O TYR A 136 135.158 4.316 -1.631 1.00 0.00 O ATOM 1765 CB TYR A 136 135.151 4.883 -5.013 1.00 0.00 C ATOM 1766 CG TYR A 136 135.969 5.255 -6.226 1.00 0.00 C ATOM 1767 CD1 TYR A 136 136.336 6.589 -6.440 1.00 0.00 C ATOM 1768 CD2 TYR A 136 136.362 4.266 -7.135 1.00 0.00 C ATOM 1769 CE1 TYR A 136 137.095 6.934 -7.565 1.00 0.00 C ATOM 1770 CE2 TYR A 136 137.122 4.612 -8.259 1.00 0.00 C ATOM 1771 CZ TYR A 136 137.487 5.945 -8.475 1.00 0.00 C ATOM 1772 OH TYR A 136 138.237 6.286 -9.582 1.00 0.00 O ATOM 0 H TYR A 136 136.376 2.950 -4.180 1.00 0.00 H new ATOM 0 HA TYR A 136 136.655 5.894 -3.795 1.00 0.00 H new ATOM 0 HB2 TYR A 136 134.781 3.862 -5.109 1.00 0.00 H new ATOM 0 HB3 TYR A 136 134.279 5.533 -4.935 1.00 0.00 H new ATOM 0 HD1 TYR A 136 136.034 7.352 -5.738 1.00 0.00 H new ATOM 0 HD2 TYR A 136 136.079 3.237 -6.970 1.00 0.00 H new ATOM 0 HE1 TYR A 136 137.378 7.963 -7.731 1.00 0.00 H new ATOM 0 HE2 TYR A 136 137.427 3.849 -8.960 1.00 0.00 H new ATOM 0 HH TYR A 136 138.425 5.482 -10.110 1.00 0.00 H new ATOM 1782 N ASN A 137 134.381 6.212 -2.424 1.00 0.00 N ATOM 1783 CA ASN A 137 133.509 6.408 -1.229 1.00 0.00 C ATOM 1784 C ASN A 137 132.266 7.218 -1.606 1.00 0.00 C ATOM 1785 O ASN A 137 132.162 7.747 -2.695 1.00 0.00 O ATOM 1786 CB ASN A 137 134.373 7.185 -0.236 1.00 0.00 C ATOM 1787 CG ASN A 137 134.842 8.490 -0.882 1.00 0.00 C ATOM 1788 OD1 ASN A 137 134.393 8.845 -1.954 1.00 0.00 O ATOM 1789 ND2 ASN A 137 135.731 9.224 -0.273 1.00 0.00 N ATOM 0 H ASN A 137 134.325 6.948 -3.128 1.00 0.00 H new ATOM 0 HA ASN A 137 133.157 5.463 -0.815 1.00 0.00 H new ATOM 0 HB2 ASN A 137 133.804 7.398 0.669 1.00 0.00 H new ATOM 0 HB3 ASN A 137 135.233 6.585 0.062 1.00 0.00 H new ATOM 0 HD21 ASN A 137 136.049 10.096 -0.696 1.00 0.00 H new ATOM 0 HD22 ASN A 137 136.108 8.927 0.627 1.00 0.00 H new ATOM 1796 N ILE A 138 131.320 7.320 -0.711 1.00 0.00 N ATOM 1797 CA ILE A 138 130.084 8.097 -1.018 1.00 0.00 C ATOM 1798 C ILE A 138 129.421 8.569 0.278 1.00 0.00 C ATOM 1799 O ILE A 138 129.697 8.062 1.348 1.00 0.00 O ATOM 1800 CB ILE A 138 129.174 7.120 -1.764 1.00 0.00 C ATOM 1801 CG1 ILE A 138 129.436 5.697 -1.266 1.00 0.00 C ATOM 1802 CG2 ILE A 138 129.467 7.195 -3.264 1.00 0.00 C ATOM 1803 CD1 ILE A 138 128.410 4.744 -1.882 1.00 0.00 C ATOM 0 H ILE A 138 131.349 6.900 0.218 1.00 0.00 H new ATOM 0 HA ILE A 138 130.293 8.988 -1.610 1.00 0.00 H new ATOM 0 HB ILE A 138 128.132 7.383 -1.582 1.00 0.00 H new ATOM 0 HG12 ILE A 138 130.445 5.386 -1.536 1.00 0.00 H new ATOM 0 HG13 ILE A 138 129.372 5.663 -0.178 1.00 0.00 H new ATOM 0 HG21 ILE A 138 128.819 6.499 -3.797 1.00 0.00 H new ATOM 0 HG22 ILE A 138 129.282 8.208 -3.621 1.00 0.00 H new ATOM 0 HG23 ILE A 138 130.509 6.931 -3.445 1.00 0.00 H new ATOM 0 HD11 ILE A 138 128.596 3.730 -1.528 1.00 0.00 H new ATOM 0 HD12 ILE A 138 127.406 5.052 -1.590 1.00 0.00 H new ATOM 0 HD13 ILE A 138 128.496 4.770 -2.968 1.00 0.00 H new ATOM 1815 N THR A 139 128.553 9.539 0.192 1.00 0.00 N ATOM 1816 CA THR A 139 127.877 10.048 1.421 1.00 0.00 C ATOM 1817 C THR A 139 126.561 9.303 1.660 1.00 0.00 C ATOM 1818 O THR A 139 125.672 9.314 0.834 1.00 0.00 O ATOM 1819 CB THR A 139 127.607 11.525 1.139 1.00 0.00 C ATOM 1820 OG1 THR A 139 128.829 12.176 0.817 1.00 0.00 O ATOM 1821 CG2 THR A 139 126.989 12.176 2.378 1.00 0.00 C ATOM 0 H THR A 139 128.282 10.002 -0.676 1.00 0.00 H new ATOM 0 HA THR A 139 128.487 9.903 2.312 1.00 0.00 H new ATOM 0 HB THR A 139 126.916 11.616 0.301 1.00 0.00 H new ATOM 0 HG1 THR A 139 129.582 11.611 1.089 1.00 0.00 H new ATOM 0 HG21 THR A 139 126.796 13.230 2.177 1.00 0.00 H new ATOM 0 HG22 THR A 139 126.052 11.676 2.623 1.00 0.00 H new ATOM 0 HG23 THR A 139 127.678 12.087 3.218 1.00 0.00 H new ATOM 1829 N TYR A 140 126.426 8.664 2.791 1.00 0.00 N ATOM 1830 CA TYR A 140 125.162 7.931 3.084 1.00 0.00 C ATOM 1831 C TYR A 140 124.175 8.861 3.796 1.00 0.00 C ATOM 1832 O TYR A 140 124.562 9.821 4.431 1.00 0.00 O ATOM 1833 CB TYR A 140 125.572 6.779 4.002 1.00 0.00 C ATOM 1834 CG TYR A 140 126.016 5.604 3.166 1.00 0.00 C ATOM 1835 CD1 TYR A 140 127.328 5.548 2.679 1.00 0.00 C ATOM 1836 CD2 TYR A 140 125.118 4.569 2.877 1.00 0.00 C ATOM 1837 CE1 TYR A 140 127.742 4.458 1.905 1.00 0.00 C ATOM 1838 CE2 TYR A 140 125.532 3.479 2.103 1.00 0.00 C ATOM 1839 CZ TYR A 140 126.844 3.423 1.616 1.00 0.00 C ATOM 1840 OH TYR A 140 127.251 2.348 0.853 1.00 0.00 O ATOM 0 H TYR A 140 127.135 8.618 3.523 1.00 0.00 H new ATOM 0 HA TYR A 140 124.671 7.571 2.180 1.00 0.00 H new ATOM 0 HB2 TYR A 140 126.380 7.095 4.662 1.00 0.00 H new ATOM 0 HB3 TYR A 140 124.735 6.491 4.638 1.00 0.00 H new ATOM 0 HD1 TYR A 140 128.021 6.346 2.901 1.00 0.00 H new ATOM 0 HD2 TYR A 140 124.106 4.612 3.251 1.00 0.00 H new ATOM 0 HE1 TYR A 140 128.754 4.415 1.531 1.00 0.00 H new ATOM 0 HE2 TYR A 140 124.839 2.681 1.881 1.00 0.00 H new ATOM 0 HH TYR A 140 126.506 1.720 0.748 1.00 0.00 H new ATOM 1850 N LYS A 141 122.904 8.588 3.691 1.00 0.00 N ATOM 1851 CA LYS A 141 121.900 9.463 4.363 1.00 0.00 C ATOM 1852 C LYS A 141 120.720 8.632 4.873 1.00 0.00 C ATOM 1853 O LYS A 141 119.828 8.284 4.127 1.00 0.00 O ATOM 1854 CB LYS A 141 121.437 10.440 3.279 1.00 0.00 C ATOM 1855 CG LYS A 141 121.763 11.876 3.703 1.00 0.00 C ATOM 1856 CD LYS A 141 120.472 12.693 3.801 1.00 0.00 C ATOM 1857 CE LYS A 141 120.346 13.279 5.209 1.00 0.00 C ATOM 1858 NZ LYS A 141 120.672 14.725 5.056 1.00 0.00 N ATOM 0 H LYS A 141 122.517 7.800 3.171 1.00 0.00 H new ATOM 0 HA LYS A 141 122.319 9.978 5.228 1.00 0.00 H new ATOM 0 HB2 LYS A 141 121.929 10.209 2.334 1.00 0.00 H new ATOM 0 HB3 LYS A 141 120.365 10.334 3.114 1.00 0.00 H new ATOM 0 HG2 LYS A 141 122.277 11.873 4.664 1.00 0.00 H new ATOM 0 HG3 LYS A 141 122.440 12.333 2.981 1.00 0.00 H new ATOM 0 HD2 LYS A 141 120.478 13.494 3.061 1.00 0.00 H new ATOM 0 HD3 LYS A 141 119.612 12.062 3.580 1.00 0.00 H new ATOM 0 HE2 LYS A 141 119.340 13.141 5.605 1.00 0.00 H new ATOM 0 HE3 LYS A 141 121.031 12.791 5.902 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 120.607 15.195 5.981 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 121.638 14.826 4.684 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 119.999 15.165 4.396 1.00 0.00 H new ATOM 1872 N PHE A 142 120.707 8.319 6.140 1.00 0.00 N ATOM 1873 CA PHE A 142 119.581 7.517 6.699 1.00 0.00 C ATOM 1874 C PHE A 142 118.486 8.453 7.223 1.00 0.00 C ATOM 1875 O PHE A 142 118.764 9.512 7.751 1.00 0.00 O ATOM 1876 CB PHE A 142 120.195 6.711 7.845 1.00 0.00 C ATOM 1877 CG PHE A 142 121.107 5.649 7.279 1.00 0.00 C ATOM 1878 CD1 PHE A 142 120.573 4.436 6.825 1.00 0.00 C ATOM 1879 CD2 PHE A 142 122.486 5.876 7.209 1.00 0.00 C ATOM 1880 CE1 PHE A 142 121.419 3.451 6.301 1.00 0.00 C ATOM 1881 CE2 PHE A 142 123.333 4.892 6.684 1.00 0.00 C ATOM 1882 CZ PHE A 142 122.800 3.679 6.231 1.00 0.00 C ATOM 0 H PHE A 142 121.427 8.584 6.812 1.00 0.00 H new ATOM 0 HA PHE A 142 119.120 6.869 5.953 1.00 0.00 H new ATOM 0 HB2 PHE A 142 120.754 7.370 8.509 1.00 0.00 H new ATOM 0 HB3 PHE A 142 119.408 6.250 8.442 1.00 0.00 H new ATOM 0 HD1 PHE A 142 119.509 4.261 6.879 1.00 0.00 H new ATOM 0 HD2 PHE A 142 122.897 6.811 7.560 1.00 0.00 H new ATOM 0 HE1 PHE A 142 121.007 2.516 5.951 1.00 0.00 H new ATOM 0 HE2 PHE A 142 124.397 5.069 6.629 1.00 0.00 H new ATOM 0 HZ PHE A 142 123.453 2.919 5.828 1.00 0.00 H new ATOM 1892 N ASN A 143 117.245 8.076 7.078 1.00 0.00 N ATOM 1893 CA ASN A 143 116.138 8.951 7.565 1.00 0.00 C ATOM 1894 C ASN A 143 115.120 8.133 8.366 1.00 0.00 C ATOM 1895 O ASN A 143 114.280 7.450 7.809 1.00 0.00 O ATOM 1896 CB ASN A 143 115.494 9.515 6.297 1.00 0.00 C ATOM 1897 CG ASN A 143 116.585 9.865 5.283 1.00 0.00 C ATOM 1898 OD1 ASN A 143 116.768 9.092 4.248 1.00 0.00 O flip ATOM 1899 ND2 ASN A 143 117.276 10.853 5.433 1.00 0.00 N flip ATOM 0 H ASN A 143 116.949 7.202 6.644 1.00 0.00 H new ATOM 0 HA ASN A 143 116.498 9.738 8.227 1.00 0.00 H new ATOM 0 HB2 ASN A 143 114.806 8.785 5.870 1.00 0.00 H new ATOM 0 HB3 ASN A 143 114.908 10.402 6.538 1.00 0.00 H new ATOM 0 HD21 ASN A 143 117.133 11.457 6.242 1.00 0.00 H new ATOM 0 HD22 ASN A 143 117.999 11.078 4.750 1.00 0.00 H new ATOM 1906 N GLY A 144 115.189 8.205 9.670 1.00 0.00 N ATOM 1907 CA GLY A 144 114.229 7.438 10.516 1.00 0.00 C ATOM 1908 C GLY A 144 114.243 8.005 11.941 1.00 0.00 C ATOM 1909 O GLY A 144 114.377 9.199 12.127 1.00 0.00 O ATOM 0 H GLY A 144 115.870 8.763 10.185 1.00 0.00 H new ATOM 0 HA2 GLY A 144 113.225 7.503 10.097 1.00 0.00 H new ATOM 0 HA3 GLY A 144 114.501 6.383 10.530 1.00 0.00 H new ATOM 1913 N PRO A 145 114.099 7.130 12.904 1.00 0.00 N ATOM 1914 CA PRO A 145 114.095 7.562 14.325 1.00 0.00 C ATOM 1915 C PRO A 145 115.445 8.177 14.706 1.00 0.00 C ATOM 1916 O PRO A 145 116.490 7.680 14.337 1.00 0.00 O ATOM 1917 CB PRO A 145 113.848 6.273 15.111 1.00 0.00 C ATOM 1918 CG PRO A 145 114.134 5.153 14.159 1.00 0.00 C ATOM 1919 CD PRO A 145 113.933 5.681 12.764 1.00 0.00 C ATOM 0 HA PRO A 145 113.342 8.324 14.527 1.00 0.00 H new ATOM 0 HB2 PRO A 145 114.496 6.218 15.985 1.00 0.00 H new ATOM 0 HB3 PRO A 145 112.821 6.226 15.472 1.00 0.00 H new ATOM 0 HG2 PRO A 145 115.154 4.791 14.288 1.00 0.00 H new ATOM 0 HG3 PRO A 145 113.470 4.310 14.349 1.00 0.00 H new ATOM 0 HD2 PRO A 145 114.661 5.261 12.070 1.00 0.00 H new ATOM 0 HD3 PRO A 145 112.945 5.428 12.380 1.00 0.00 H new