USER MOD reduce.3.24.130724 H: found=0, std=0, add=1028, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1026 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 62 LYS NZ :NH3+ 153:sc= 0.0844 (180deg=0) USER MOD Set 1.2: A 120 ASN : amide:sc= 0.513 K(o=0.6,f=0) USER MOD Set 2.1: A 32 GLN : amide:sc= 0.197 K(o=0.4,f=-0.48) USER MOD Set 2.2: A 123 THR OG1 : rot -87:sc= 0.201 USER MOD Set 3.1: A 29 MET CE :methyl 177:sc= -0.69 (180deg=-0.709) USER MOD Set 3.2: A 112 MET CE :methyl -163:sc= -0.218 (180deg=-1.25) USER MOD Set 4.1: A 18 LYS NZ :NH3+ 144:sc= 0.9 (180deg=0) USER MOD Set 4.2: A 118 ASN : amide:sc= 0.792 K(o=1.7,f=-10!) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 3 GLN : amide:sc= -0.951 K(o=-0.95,f=-5!) USER MOD Single : A 9 GLN : amide:sc= -0.0903 K(o=-0.09,f=-1.4) USER MOD Single : A 12 LYS NZ :NH3+ -177:sc= -0.159 (180deg=-0.181) USER MOD Single : A 17 GLN : amide:sc= -0.151 K(o=-0.15,f=-2.5!) USER MOD Single : A 20 LYS NZ :NH3+ 168:sc=-0.00708 (180deg=-0.135) USER MOD Single : A 23 GLN : amide:sc= 0 K(o=0,f=-0.72) USER MOD Single : A 26 HIS : no HD1:sc= 0 X(o=0,f=-0.016) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 38 GLN : amide:sc= -0.312 K(o=-0.31,f=-0.91) USER MOD Single : A 40 CYS SG : rot -28:sc= 0.106 USER MOD Single : A 42 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 43 GLN : amide:sc= 0.102 X(o=0.1,f=-0.2) USER MOD Single : A 45 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 MET CE :methyl -175:sc= -0.44 (180deg=-0.459) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ -129:sc= 0.126 (180deg=-0.0693) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot -125:sc= 0.306 USER MOD Single : A 59 LYS NZ :NH3+ -106:sc= 1.05 (180deg=-0.0271) USER MOD Single : A 63 ASN : amide:sc= -0.27 K(o=-0.27,f=-3.5!) USER MOD Single : A 64 SER OG : rot -119:sc= -0.0887 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 71 GLN : amide:sc= -0.1 K(o=-0.1,f=-0.91) USER MOD Single : A 72 SER OG : rot 82:sc= 0.935 USER MOD Single : A 74 SER OG : rot 56:sc= 0.521 USER MOD Single : A 75 GLN : amide:sc= -0.092 X(o=-0.092,f=-0.038) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 MET CE :methyl 160:sc= -0.617 (180deg=-1.22) USER MOD Single : A 81 GLN : amide:sc= -0.341 X(o=-0.34,f=0) USER MOD Single : A 83 GLN :FLIP amide:sc= -0.0521 F(o=-1.3,f=-0.052) USER MOD Single : A 89 MET CE :methyl 173:sc= -2.1 (180deg=-2.29) USER MOD Single : A 90 GLN : amide:sc= 0.0271 K(o=0.027,f=-5.6!) USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 94 ASN : amide:sc= -0.0633 X(o=-0.063,f=-0.063) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 MET CE :methyl -138:sc= 0 (180deg=-0.624) USER MOD Single : A 104 ASN :FLIP amide:sc= -0.0298 F(o=-0.66,f=-0.03) USER MOD Single : A 109 ASN : amide:sc= 0.354 X(o=0.35,f=-0.039) USER MOD Single : A 110 LYS NZ :NH3+ -129:sc= 0.642 (180deg=-0.537) USER MOD Single : A 111 THR OG1 : rot -40:sc= -1.11! USER MOD Single : A 116 SER OG : rot 4:sc= 0.0598 USER MOD Single : A 128 THR OG1 : rot -71:sc= 1.55 USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 1.300 0.917 0.610 1.00 0.00 N ATOM 2 CA PRO A 1 1.394 0.640 -0.842 1.00 0.00 C ATOM 3 C PRO A 1 1.000 -0.821 -1.184 1.00 0.00 C ATOM 4 O PRO A 1 0.782 -1.138 -2.357 1.00 0.00 O ATOM 5 CB PRO A 1 2.836 0.970 -1.302 1.00 0.00 C ATOM 6 CG PRO A 1 3.578 1.242 -0.015 1.00 0.00 C ATOM 7 CD PRO A 1 2.678 0.793 1.134 1.00 0.00 C ATOM 0 H2 PRO A 1 0.673 0.256 1.069 1.00 0.00 H new ATOM 0 H3 PRO A 1 0.926 1.850 0.781 1.00 0.00 H new ATOM 0 HA PRO A 1 0.683 1.268 -1.379 1.00 0.00 H new ATOM 0 HB2 PRO A 1 3.280 0.139 -1.850 1.00 0.00 H new ATOM 0 HB3 PRO A 1 2.855 1.836 -1.964 1.00 0.00 H new ATOM 0 HG2 PRO A 1 4.524 0.701 0.004 1.00 0.00 H new ATOM 0 HG3 PRO A 1 3.815 2.302 0.075 1.00 0.00 H new ATOM 0 HD2 PRO A 1 2.897 -0.233 1.430 1.00 0.00 H new ATOM 0 HD3 PRO A 1 2.823 1.417 2.016 1.00 0.00 H new ATOM 15 N GLN A 2 0.872 -1.689 -0.152 1.00 0.00 N ATOM 16 CA GLN A 2 0.670 -3.135 -0.340 1.00 0.00 C ATOM 17 C GLN A 2 -0.728 -3.425 -0.881 1.00 0.00 C ATOM 18 O GLN A 2 -0.881 -4.267 -1.755 1.00 0.00 O ATOM 19 CB GLN A 2 0.904 -3.903 0.982 1.00 0.00 C ATOM 20 CG GLN A 2 2.361 -3.891 1.480 1.00 0.00 C ATOM 21 CD GLN A 2 2.571 -4.676 2.781 1.00 0.00 C ATOM 22 OE1 GLN A 2 1.680 -4.751 3.633 1.00 0.00 O ATOM 23 NE2 GLN A 2 3.739 -5.282 2.937 1.00 0.00 N ATOM 0 H GLN A 2 0.906 -1.403 0.826 1.00 0.00 H new ATOM 0 HA GLN A 2 1.401 -3.480 -1.072 1.00 0.00 H new ATOM 0 HB2 GLN A 2 0.266 -3.473 1.754 1.00 0.00 H new ATOM 0 HB3 GLN A 2 0.588 -4.938 0.847 1.00 0.00 H new ATOM 0 HG2 GLN A 2 3.004 -4.308 0.706 1.00 0.00 H new ATOM 0 HG3 GLN A 2 2.675 -2.859 1.633 1.00 0.00 H new ATOM 0 HE21 GLN A 2 4.456 -5.202 2.216 1.00 0.00 H new ATOM 0 HE22 GLN A 2 3.921 -5.829 3.778 1.00 0.00 H new ATOM 32 N GLN A 3 -1.739 -2.710 -0.361 1.00 0.00 N ATOM 33 CA GLN A 3 -3.135 -2.842 -0.828 1.00 0.00 C ATOM 34 C GLN A 3 -3.270 -2.444 -2.311 1.00 0.00 C ATOM 35 O GLN A 3 -4.004 -3.077 -3.082 1.00 0.00 O ATOM 36 CB GLN A 3 -4.130 -2.000 0.037 1.00 0.00 C ATOM 37 CG GLN A 3 -3.905 -0.462 0.082 1.00 0.00 C ATOM 38 CD GLN A 3 -2.686 -0.034 0.892 1.00 0.00 C ATOM 39 OE1 GLN A 3 -1.589 0.087 0.360 1.00 0.00 O ATOM 40 NE2 GLN A 3 -2.868 0.149 2.194 1.00 0.00 N ATOM 0 H GLN A 3 -1.617 -2.029 0.389 1.00 0.00 H new ATOM 0 HA GLN A 3 -3.397 -3.894 -0.717 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -5.139 -2.183 -0.333 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -4.092 -2.377 1.059 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -3.799 -0.091 -0.938 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -4.792 0.012 0.503 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -3.797 0.039 2.599 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -2.078 0.400 2.789 1.00 0.00 H new ATOM 49 N LEU A 4 -2.517 -1.406 -2.689 1.00 0.00 N ATOM 50 CA LEU A 4 -2.607 -0.772 -4.009 1.00 0.00 C ATOM 51 C LEU A 4 -1.949 -1.663 -5.085 1.00 0.00 C ATOM 52 O LEU A 4 -2.454 -1.769 -6.209 1.00 0.00 O ATOM 53 CB LEU A 4 -1.972 0.648 -3.925 1.00 0.00 C ATOM 54 CG LEU A 4 -2.382 1.682 -5.030 1.00 0.00 C ATOM 55 CD1 LEU A 4 -2.118 3.123 -4.549 1.00 0.00 C ATOM 56 CD2 LEU A 4 -1.663 1.427 -6.376 1.00 0.00 C ATOM 0 H LEU A 4 -1.820 -0.977 -2.080 1.00 0.00 H new ATOM 0 HA LEU A 4 -3.649 -0.658 -4.308 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -2.224 1.074 -2.954 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -0.888 0.536 -3.953 1.00 0.00 H new ATOM 0 HG LEU A 4 -3.450 1.551 -5.205 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -2.409 3.826 -5.329 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -2.701 3.319 -3.649 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -1.058 3.244 -4.328 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -1.983 2.171 -7.106 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -0.585 1.500 -6.232 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -1.914 0.431 -6.740 1.00 0.00 H new ATOM 68 N VAL A 5 -0.829 -2.310 -4.730 1.00 0.00 N ATOM 69 CA VAL A 5 -0.155 -3.253 -5.633 1.00 0.00 C ATOM 70 C VAL A 5 -0.887 -4.611 -5.626 1.00 0.00 C ATOM 71 O VAL A 5 -0.946 -5.279 -6.655 1.00 0.00 O ATOM 72 CB VAL A 5 1.372 -3.428 -5.284 1.00 0.00 C ATOM 73 CG1 VAL A 5 1.591 -4.108 -3.912 1.00 0.00 C ATOM 74 CG2 VAL A 5 2.121 -4.180 -6.405 1.00 0.00 C ATOM 0 H VAL A 5 -0.372 -2.197 -3.825 1.00 0.00 H new ATOM 0 HA VAL A 5 -0.198 -2.835 -6.639 1.00 0.00 H new ATOM 0 HB VAL A 5 1.793 -2.425 -5.209 1.00 0.00 H new ATOM 0 HG11 VAL A 5 2.660 -4.205 -3.720 1.00 0.00 H new ATOM 0 HG12 VAL A 5 1.135 -3.502 -3.129 1.00 0.00 H new ATOM 0 HG13 VAL A 5 1.133 -5.097 -3.919 1.00 0.00 H new ATOM 0 HG21 VAL A 5 3.172 -4.284 -6.134 1.00 0.00 H new ATOM 0 HG22 VAL A 5 1.680 -5.168 -6.538 1.00 0.00 H new ATOM 0 HG23 VAL A 5 2.041 -3.619 -7.336 1.00 0.00 H new ATOM 84 N GLU A 6 -1.496 -4.965 -4.469 1.00 0.00 N ATOM 85 CA GLU A 6 -2.199 -6.253 -4.286 1.00 0.00 C ATOM 86 C GLU A 6 -3.354 -6.378 -5.269 1.00 0.00 C ATOM 87 O GLU A 6 -3.450 -7.371 -5.975 1.00 0.00 O ATOM 88 CB GLU A 6 -2.761 -6.408 -2.847 1.00 0.00 C ATOM 89 CG GLU A 6 -3.441 -7.769 -2.566 1.00 0.00 C ATOM 90 CD GLU A 6 -4.222 -7.808 -1.243 1.00 0.00 C ATOM 91 OE1 GLU A 6 -3.590 -7.909 -0.172 1.00 0.00 O ATOM 92 OE2 GLU A 6 -5.470 -7.731 -1.271 1.00 0.00 O ATOM 0 H GLU A 6 -1.513 -4.368 -3.642 1.00 0.00 H new ATOM 0 HA GLU A 6 -1.464 -7.038 -4.465 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -1.947 -6.270 -2.136 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -3.482 -5.611 -2.665 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -4.121 -8.002 -3.386 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -2.680 -8.549 -2.552 1.00 0.00 H new ATOM 99 N ARG A 7 -4.207 -5.328 -5.323 1.00 0.00 N ATOM 100 CA ARG A 7 -5.390 -5.295 -6.211 1.00 0.00 C ATOM 101 C ARG A 7 -4.964 -5.481 -7.674 1.00 0.00 C ATOM 102 O ARG A 7 -5.585 -6.236 -8.416 1.00 0.00 O ATOM 103 CB ARG A 7 -6.189 -3.965 -6.019 1.00 0.00 C ATOM 104 CG ARG A 7 -5.472 -2.666 -6.514 1.00 0.00 C ATOM 105 CD ARG A 7 -5.898 -2.204 -7.930 1.00 0.00 C ATOM 106 NE ARG A 7 -7.332 -1.890 -8.011 1.00 0.00 N ATOM 107 CZ ARG A 7 -7.887 -0.733 -7.613 1.00 0.00 C ATOM 108 NH1 ARG A 7 -7.139 0.217 -7.042 1.00 0.00 N ATOM 109 NH2 ARG A 7 -9.193 -0.546 -7.748 1.00 0.00 N ATOM 0 H ARG A 7 -4.095 -4.487 -4.757 1.00 0.00 H new ATOM 0 HA ARG A 7 -6.050 -6.120 -5.943 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -7.140 -4.055 -6.543 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -6.419 -3.850 -4.960 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -5.673 -1.862 -5.806 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -4.395 -2.834 -6.508 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -5.320 -1.324 -8.211 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -5.659 -2.986 -8.651 1.00 0.00 H new ATOM 0 HE ARG A 7 -7.951 -2.603 -8.398 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -6.139 0.066 -6.906 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -7.568 1.093 -6.743 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -9.774 -1.280 -8.153 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -9.616 0.332 -7.446 1.00 0.00 H new ATOM 123 N LEU A 8 -3.829 -4.838 -8.029 1.00 0.00 N ATOM 124 CA LEU A 8 -3.288 -4.838 -9.392 1.00 0.00 C ATOM 125 C LEU A 8 -2.896 -6.289 -9.761 1.00 0.00 C ATOM 126 O LEU A 8 -3.180 -6.759 -10.857 1.00 0.00 O ATOM 127 CB LEU A 8 -2.067 -3.856 -9.468 1.00 0.00 C ATOM 128 CG LEU A 8 -1.653 -3.296 -10.882 1.00 0.00 C ATOM 129 CD1 LEU A 8 -0.653 -2.119 -10.744 1.00 0.00 C ATOM 130 CD2 LEU A 8 -1.061 -4.379 -11.813 1.00 0.00 C ATOM 0 H LEU A 8 -3.265 -4.304 -7.368 1.00 0.00 H new ATOM 0 HA LEU A 8 -4.029 -4.489 -10.111 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -2.283 -3.005 -8.822 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -1.202 -4.366 -9.045 1.00 0.00 H new ATOM 0 HG LEU A 8 -2.574 -2.939 -11.344 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -0.384 -1.752 -11.734 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -1.115 -1.314 -10.172 1.00 0.00 H new ATOM 0 HD13 LEU A 8 0.244 -2.462 -10.229 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -0.796 -3.930 -12.770 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -0.170 -4.806 -11.353 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -1.799 -5.165 -11.973 1.00 0.00 H new ATOM 142 N GLN A 9 -2.298 -6.987 -8.775 1.00 0.00 N ATOM 143 CA GLN A 9 -1.823 -8.378 -8.906 1.00 0.00 C ATOM 144 C GLN A 9 -2.993 -9.390 -8.952 1.00 0.00 C ATOM 145 O GLN A 9 -2.981 -10.328 -9.763 1.00 0.00 O ATOM 146 CB GLN A 9 -0.844 -8.688 -7.747 1.00 0.00 C ATOM 147 CG GLN A 9 0.454 -7.848 -7.789 1.00 0.00 C ATOM 148 CD GLN A 9 1.286 -7.915 -6.503 1.00 0.00 C ATOM 149 OE1 GLN A 9 0.752 -8.088 -5.409 1.00 0.00 O ATOM 150 NE2 GLN A 9 2.597 -7.775 -6.625 1.00 0.00 N ATOM 0 H GLN A 9 -2.129 -6.593 -7.850 1.00 0.00 H new ATOM 0 HA GLN A 9 -1.299 -8.482 -9.856 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -1.350 -8.511 -6.798 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -0.583 -9.746 -7.777 1.00 0.00 H new ATOM 0 HG2 GLN A 9 1.067 -8.188 -8.624 1.00 0.00 H new ATOM 0 HG3 GLN A 9 0.195 -6.808 -7.987 1.00 0.00 H new ATOM 0 HE21 GLN A 9 3.011 -7.633 -7.546 1.00 0.00 H new ATOM 0 HE22 GLN A 9 3.193 -7.809 -5.798 1.00 0.00 H new ATOM 159 N GLU A 10 -4.018 -9.154 -8.118 1.00 0.00 N ATOM 160 CA GLU A 10 -5.189 -10.048 -7.991 1.00 0.00 C ATOM 161 C GLU A 10 -6.095 -9.952 -9.226 1.00 0.00 C ATOM 162 O GLU A 10 -6.858 -10.878 -9.523 1.00 0.00 O ATOM 163 CB GLU A 10 -6.003 -9.726 -6.704 1.00 0.00 C ATOM 164 CG GLU A 10 -5.240 -9.937 -5.378 1.00 0.00 C ATOM 165 CD GLU A 10 -4.535 -11.298 -5.300 1.00 0.00 C ATOM 166 OE1 GLU A 10 -5.231 -12.333 -5.198 1.00 0.00 O ATOM 167 OE2 GLU A 10 -3.286 -11.344 -5.359 1.00 0.00 O ATOM 0 H GLU A 10 -4.062 -8.337 -7.509 1.00 0.00 H new ATOM 0 HA GLU A 10 -4.814 -11.069 -7.917 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -6.336 -8.689 -6.753 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -6.898 -10.348 -6.693 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -4.501 -9.144 -5.261 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -5.938 -9.848 -4.546 1.00 0.00 H new ATOM 174 N GLU A 11 -6.013 -8.814 -9.927 1.00 0.00 N ATOM 175 CA GLU A 11 -6.692 -8.613 -11.211 1.00 0.00 C ATOM 176 C GLU A 11 -5.850 -9.210 -12.355 1.00 0.00 C ATOM 177 O GLU A 11 -6.370 -9.985 -13.160 1.00 0.00 O ATOM 178 CB GLU A 11 -6.959 -7.104 -11.448 1.00 0.00 C ATOM 179 CG GLU A 11 -7.938 -6.457 -10.449 1.00 0.00 C ATOM 180 CD GLU A 11 -8.169 -4.964 -10.723 1.00 0.00 C ATOM 181 OE1 GLU A 11 -7.328 -4.131 -10.303 1.00 0.00 O ATOM 182 OE2 GLU A 11 -9.152 -4.624 -11.404 1.00 0.00 O ATOM 0 H GLU A 11 -5.473 -8.006 -9.618 1.00 0.00 H new ATOM 0 HA GLU A 11 -7.653 -9.128 -11.188 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -6.010 -6.570 -11.403 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -7.351 -6.973 -12.457 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -8.893 -6.981 -10.492 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -7.552 -6.580 -9.437 1.00 0.00 H new ATOM 189 N LYS A 12 -4.529 -8.891 -12.367 1.00 0.00 N ATOM 190 CA LYS A 12 -3.631 -9.182 -13.523 1.00 0.00 C ATOM 191 C LYS A 12 -3.375 -10.667 -13.721 1.00 0.00 C ATOM 192 O LYS A 12 -3.039 -11.080 -14.819 1.00 0.00 O ATOM 193 CB LYS A 12 -2.270 -8.443 -13.402 1.00 0.00 C ATOM 194 CG LYS A 12 -1.285 -9.068 -12.386 1.00 0.00 C ATOM 195 CD LYS A 12 0.052 -8.302 -12.276 1.00 0.00 C ATOM 196 CE LYS A 12 0.885 -8.384 -13.559 1.00 0.00 C ATOM 197 NZ LYS A 12 1.352 -9.759 -13.851 1.00 0.00 N ATOM 0 H LYS A 12 -4.059 -8.431 -11.588 1.00 0.00 H new ATOM 0 HA LYS A 12 -4.167 -8.811 -14.397 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -1.795 -8.422 -14.383 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -2.458 -7.408 -13.116 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -1.759 -9.100 -11.405 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -1.082 -10.099 -12.676 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -0.151 -7.256 -12.045 1.00 0.00 H new ATOM 0 HD3 LYS A 12 0.631 -8.706 -11.445 1.00 0.00 H new ATOM 0 HE2 LYS A 12 0.290 -8.021 -14.397 1.00 0.00 H new ATOM 0 HE3 LYS A 12 1.747 -7.723 -13.470 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 1.952 -9.749 -14.700 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 1.901 -10.118 -13.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 0.532 -10.377 -14.014 1.00 0.00 H new ATOM 211 N ARG A 13 -3.558 -11.450 -12.650 1.00 0.00 N ATOM 212 CA ARG A 13 -3.192 -12.876 -12.608 1.00 0.00 C ATOM 213 C ARG A 13 -3.857 -13.733 -13.728 1.00 0.00 C ATOM 214 O ARG A 13 -3.354 -14.817 -14.053 1.00 0.00 O ATOM 215 CB ARG A 13 -3.546 -13.438 -11.210 1.00 0.00 C ATOM 216 CG ARG A 13 -5.058 -13.437 -10.899 1.00 0.00 C ATOM 217 CD ARG A 13 -5.374 -13.878 -9.462 1.00 0.00 C ATOM 218 NE ARG A 13 -6.814 -14.109 -9.271 1.00 0.00 N ATOM 219 CZ ARG A 13 -7.415 -14.315 -8.092 1.00 0.00 C ATOM 220 NH1 ARG A 13 -6.761 -14.155 -6.950 1.00 0.00 N ATOM 221 NH2 ARG A 13 -8.682 -14.661 -8.067 1.00 0.00 N ATOM 0 H ARG A 13 -3.968 -11.111 -11.780 1.00 0.00 H new ATOM 0 HA ARG A 13 -2.120 -12.942 -12.794 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -3.170 -14.458 -11.134 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -3.029 -12.850 -10.452 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -5.456 -12.436 -11.062 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -5.568 -14.101 -11.598 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -4.825 -14.791 -9.232 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -5.031 -13.115 -8.763 1.00 0.00 H new ATOM 0 HE ARG A 13 -7.403 -14.113 -10.104 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -5.782 -13.870 -6.959 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -7.237 -14.317 -6.063 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -9.198 -14.770 -8.940 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -9.150 -14.820 -7.175 1.00 0.00 H new ATOM 235 N ILE A 14 -4.961 -13.222 -14.334 1.00 0.00 N ATOM 236 CA ILE A 14 -5.691 -13.919 -15.435 1.00 0.00 C ATOM 237 C ILE A 14 -4.826 -14.030 -16.720 1.00 0.00 C ATOM 238 O ILE A 14 -5.158 -14.783 -17.647 1.00 0.00 O ATOM 239 CB ILE A 14 -7.080 -13.226 -15.788 1.00 0.00 C ATOM 240 CG1 ILE A 14 -6.937 -11.971 -16.730 1.00 0.00 C ATOM 241 CG2 ILE A 14 -7.855 -12.864 -14.500 1.00 0.00 C ATOM 242 CD1 ILE A 14 -6.128 -10.812 -16.198 1.00 0.00 C ATOM 0 H ILE A 14 -5.370 -12.323 -14.078 1.00 0.00 H new ATOM 0 HA ILE A 14 -5.900 -14.920 -15.059 1.00 0.00 H new ATOM 0 HB ILE A 14 -7.651 -13.962 -16.353 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -6.487 -12.299 -17.667 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -7.937 -11.608 -16.967 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -8.801 -12.392 -14.765 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -8.050 -13.770 -13.926 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -7.261 -12.175 -13.900 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -6.105 -10.013 -16.939 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -6.583 -10.442 -15.279 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -5.110 -11.143 -15.991 1.00 0.00 H new ATOM 254 N GLU A 15 -3.718 -13.259 -16.750 1.00 0.00 N ATOM 255 CA GLU A 15 -2.816 -13.159 -17.900 1.00 0.00 C ATOM 256 C GLU A 15 -2.017 -14.456 -18.136 1.00 0.00 C ATOM 257 O GLU A 15 -1.444 -14.639 -19.210 1.00 0.00 O ATOM 258 CB GLU A 15 -1.865 -11.960 -17.723 1.00 0.00 C ATOM 259 CG GLU A 15 -0.792 -12.135 -16.628 1.00 0.00 C ATOM 260 CD GLU A 15 0.193 -10.967 -16.589 1.00 0.00 C ATOM 261 OE1 GLU A 15 -0.215 -9.850 -16.233 1.00 0.00 O ATOM 262 OE2 GLU A 15 1.373 -11.146 -16.953 1.00 0.00 O ATOM 0 H GLU A 15 -3.427 -12.683 -15.960 1.00 0.00 H new ATOM 0 HA GLU A 15 -3.432 -13.003 -18.785 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -1.366 -11.768 -18.673 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -2.459 -11.076 -17.491 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -1.279 -12.229 -15.657 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -0.246 -13.062 -16.802 1.00 0.00 H new ATOM 269 N ALA A 16 -2.004 -15.360 -17.135 1.00 0.00 N ATOM 270 CA ALA A 16 -1.415 -16.713 -17.274 1.00 0.00 C ATOM 271 C ALA A 16 -2.069 -17.485 -18.446 1.00 0.00 C ATOM 272 O ALA A 16 -1.474 -18.414 -19.007 1.00 0.00 O ATOM 273 CB ALA A 16 -1.561 -17.493 -15.960 1.00 0.00 C ATOM 0 H ALA A 16 -2.398 -15.177 -16.212 1.00 0.00 H new ATOM 0 HA ALA A 16 -0.354 -16.604 -17.498 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -1.124 -18.485 -16.075 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -1.045 -16.960 -15.161 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -2.617 -17.588 -15.709 1.00 0.00 H new ATOM 279 N GLN A 17 -3.314 -17.095 -18.783 1.00 0.00 N ATOM 280 CA GLN A 17 -4.012 -17.559 -19.988 1.00 0.00 C ATOM 281 C GLN A 17 -4.061 -16.436 -21.053 1.00 0.00 C ATOM 282 O GLN A 17 -3.821 -16.687 -22.227 1.00 0.00 O ATOM 283 CB GLN A 17 -5.445 -18.031 -19.620 1.00 0.00 C ATOM 284 CG GLN A 17 -6.210 -18.743 -20.759 1.00 0.00 C ATOM 285 CD GLN A 17 -5.526 -20.031 -21.237 1.00 0.00 C ATOM 286 OE1 GLN A 17 -4.716 -20.022 -22.167 1.00 0.00 O ATOM 287 NE2 GLN A 17 -5.849 -21.150 -20.601 1.00 0.00 N ATOM 0 H GLN A 17 -3.863 -16.445 -18.220 1.00 0.00 H new ATOM 0 HA GLN A 17 -3.465 -18.402 -20.411 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -5.381 -18.707 -18.767 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -6.025 -17.166 -19.298 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -7.218 -18.980 -20.418 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -6.312 -18.059 -21.602 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -6.522 -21.125 -19.835 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -5.424 -22.035 -20.878 1.00 0.00 H new ATOM 296 N LYS A 18 -4.323 -15.189 -20.611 1.00 0.00 N ATOM 297 CA LYS A 18 -4.664 -14.049 -21.513 1.00 0.00 C ATOM 298 C LYS A 18 -3.479 -13.611 -22.423 1.00 0.00 C ATOM 299 O LYS A 18 -3.708 -13.124 -23.539 1.00 0.00 O ATOM 300 CB LYS A 18 -5.178 -12.831 -20.676 1.00 0.00 C ATOM 301 CG LYS A 18 -6.265 -11.965 -21.366 1.00 0.00 C ATOM 302 CD LYS A 18 -7.652 -12.659 -21.415 1.00 0.00 C ATOM 303 CE LYS A 18 -8.210 -12.959 -20.004 1.00 0.00 C ATOM 304 NZ LYS A 18 -9.556 -13.576 -20.041 1.00 0.00 N ATOM 0 H LYS A 18 -4.307 -14.935 -19.623 1.00 0.00 H new ATOM 0 HA LYS A 18 -5.454 -14.403 -22.176 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -5.577 -13.202 -19.732 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -4.328 -12.193 -20.434 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -6.358 -11.017 -20.835 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -5.945 -11.732 -22.382 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -8.355 -12.023 -21.953 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -7.570 -13.590 -21.976 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -7.524 -13.625 -19.480 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -8.255 -12.033 -19.431 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -9.640 -14.273 -19.273 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -10.279 -12.839 -19.920 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -9.695 -14.051 -20.956 1.00 0.00 H new ATOM 318 N ARG A 19 -2.227 -13.804 -21.948 1.00 0.00 N ATOM 319 CA ARG A 19 -0.999 -13.397 -22.693 1.00 0.00 C ATOM 320 C ARG A 19 -0.709 -14.308 -23.908 1.00 0.00 C ATOM 321 O ARG A 19 0.271 -14.067 -24.634 1.00 0.00 O ATOM 322 CB ARG A 19 0.255 -13.396 -21.778 1.00 0.00 C ATOM 323 CG ARG A 19 0.244 -12.417 -20.593 1.00 0.00 C ATOM 324 CD ARG A 19 0.140 -10.932 -20.980 1.00 0.00 C ATOM 325 NE ARG A 19 0.301 -10.073 -19.787 1.00 0.00 N ATOM 326 CZ ARG A 19 0.451 -8.739 -19.777 1.00 0.00 C ATOM 327 NH1 ARG A 19 0.395 -8.027 -20.891 1.00 0.00 N ATOM 328 NH2 ARG A 19 0.641 -8.122 -18.619 1.00 0.00 N ATOM 0 H ARG A 19 -2.033 -14.241 -21.047 1.00 0.00 H new ATOM 0 HA ARG A 19 -1.202 -12.387 -23.048 1.00 0.00 H new ATOM 0 HB2 ARG A 19 0.391 -14.404 -21.386 1.00 0.00 H new ATOM 0 HB3 ARG A 19 1.126 -13.174 -22.395 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -0.594 -12.667 -19.942 1.00 0.00 H new ATOM 0 HG3 ARG A 19 1.154 -12.563 -20.012 1.00 0.00 H new ATOM 0 HD2 ARG A 19 0.905 -10.688 -21.717 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -0.826 -10.739 -21.447 1.00 0.00 H new ATOM 0 HE ARG A 19 0.298 -10.541 -18.881 1.00 0.00 H new ATOM 0 HH11 ARG A 19 0.235 -8.491 -21.785 1.00 0.00 H new ATOM 0 HH12 ARG A 19 0.512 -7.014 -20.855 1.00 0.00 H new ATOM 0 HH21 ARG A 19 0.671 -8.660 -17.753 1.00 0.00 H new ATOM 0 HH22 ARG A 19 0.757 -7.109 -18.594 1.00 0.00 H new ATOM 342 N LYS A 20 -1.537 -15.361 -24.111 1.00 0.00 N ATOM 343 CA LYS A 20 -1.437 -16.250 -25.292 1.00 0.00 C ATOM 344 C LYS A 20 -1.562 -15.444 -26.602 1.00 0.00 C ATOM 345 O LYS A 20 -0.985 -15.834 -27.626 1.00 0.00 O ATOM 346 CB LYS A 20 -2.504 -17.371 -25.215 1.00 0.00 C ATOM 347 CG LYS A 20 -3.971 -16.901 -25.341 1.00 0.00 C ATOM 348 CD LYS A 20 -4.978 -18.008 -24.954 1.00 0.00 C ATOM 349 CE LYS A 20 -6.433 -17.587 -25.181 1.00 0.00 C ATOM 350 NZ LYS A 20 -6.721 -17.386 -26.625 1.00 0.00 N ATOM 0 H LYS A 20 -2.286 -15.616 -23.467 1.00 0.00 H new ATOM 0 HA LYS A 20 -0.453 -16.719 -25.290 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -2.303 -18.095 -26.005 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -2.388 -17.894 -24.266 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -4.128 -16.031 -24.703 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -4.161 -16.582 -26.366 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -4.768 -18.905 -25.537 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -4.839 -18.270 -23.905 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -7.101 -18.349 -24.778 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -6.636 -16.665 -24.636 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -7.748 -17.303 -26.766 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -6.255 -16.517 -26.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -6.362 -18.198 -27.167 1.00 0.00 H new ATOM 364 N GLU A 21 -2.339 -14.325 -26.523 1.00 0.00 N ATOM 365 CA GLU A 21 -2.319 -13.213 -27.495 1.00 0.00 C ATOM 366 C GLU A 21 -2.936 -13.580 -28.862 1.00 0.00 C ATOM 367 O GLU A 21 -2.760 -14.690 -29.380 1.00 0.00 O ATOM 368 CB GLU A 21 -0.861 -12.669 -27.642 1.00 0.00 C ATOM 369 CG GLU A 21 -0.669 -11.451 -28.566 1.00 0.00 C ATOM 370 CD GLU A 21 -1.447 -10.212 -28.103 1.00 0.00 C ATOM 371 OE1 GLU A 21 -0.949 -9.471 -27.221 1.00 0.00 O ATOM 372 OE2 GLU A 21 -2.550 -9.965 -28.624 1.00 0.00 O ATOM 0 H GLU A 21 -3.005 -14.177 -25.765 1.00 0.00 H new ATOM 0 HA GLU A 21 -2.958 -12.423 -27.100 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -0.494 -12.405 -26.650 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -0.231 -13.479 -28.010 1.00 0.00 H new ATOM 0 HG2 GLU A 21 0.392 -11.207 -28.619 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -0.986 -11.715 -29.575 1.00 0.00 H new ATOM 379 N ARG A 22 -3.682 -12.625 -29.433 1.00 0.00 N ATOM 380 CA ARG A 22 -4.158 -12.688 -30.819 1.00 0.00 C ATOM 381 C ARG A 22 -4.163 -11.258 -31.372 1.00 0.00 C ATOM 382 O ARG A 22 -4.764 -10.370 -30.753 1.00 0.00 O ATOM 383 CB ARG A 22 -5.567 -13.336 -30.921 1.00 0.00 C ATOM 384 CG ARG A 22 -5.992 -13.769 -32.356 1.00 0.00 C ATOM 385 CD ARG A 22 -5.482 -15.181 -32.772 1.00 0.00 C ATOM 386 NE ARG A 22 -4.006 -15.315 -32.844 1.00 0.00 N ATOM 387 CZ ARG A 22 -3.336 -16.093 -33.723 1.00 0.00 C ATOM 388 NH1 ARG A 22 -3.979 -16.780 -34.654 1.00 0.00 N ATOM 389 NH2 ARG A 22 -2.013 -16.165 -33.670 1.00 0.00 N ATOM 0 H ARG A 22 -3.974 -11.781 -28.941 1.00 0.00 H new ATOM 0 HA ARG A 22 -3.494 -13.322 -31.407 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -5.596 -14.210 -30.271 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -6.304 -12.630 -30.538 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -7.080 -13.754 -32.421 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -5.620 -13.035 -33.071 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -5.865 -15.914 -32.061 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -5.903 -15.431 -33.746 1.00 0.00 H new ATOM 0 HE ARG A 22 -3.453 -14.777 -32.177 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -4.996 -16.727 -34.716 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -3.458 -17.362 -35.309 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -1.501 -15.633 -32.966 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -1.507 -16.752 -34.333 1.00 0.00 H new ATOM 403 N GLN A 23 -3.497 -11.066 -32.526 1.00 0.00 N ATOM 404 CA GLN A 23 -3.177 -9.735 -33.089 1.00 0.00 C ATOM 405 C GLN A 23 -4.420 -8.823 -33.220 1.00 0.00 C ATOM 406 O GLN A 23 -4.590 -7.893 -32.424 1.00 0.00 O ATOM 407 CB GLN A 23 -2.453 -9.910 -34.444 1.00 0.00 C ATOM 408 CG GLN A 23 -1.950 -8.612 -35.097 1.00 0.00 C ATOM 409 CD GLN A 23 -1.123 -8.852 -36.359 1.00 0.00 C ATOM 410 OE1 GLN A 23 -0.454 -9.883 -36.491 1.00 0.00 O ATOM 411 NE2 GLN A 23 -1.151 -7.913 -37.287 1.00 0.00 N ATOM 0 H GLN A 23 -3.161 -11.838 -33.102 1.00 0.00 H new ATOM 0 HA GLN A 23 -2.513 -9.226 -32.390 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -1.603 -10.576 -34.299 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -3.132 -10.406 -35.138 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -2.805 -7.983 -35.345 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -1.347 -8.060 -34.375 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -1.714 -7.074 -37.147 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -0.610 -8.027 -38.144 1.00 0.00 H new ATOM 420 N GLU A 24 -5.285 -9.094 -34.209 1.00 0.00 N ATOM 421 CA GLU A 24 -6.537 -8.345 -34.398 1.00 0.00 C ATOM 422 C GLU A 24 -7.683 -9.308 -34.786 1.00 0.00 C ATOM 423 O GLU A 24 -7.653 -9.949 -35.836 1.00 0.00 O ATOM 424 CB GLU A 24 -6.325 -7.156 -35.405 1.00 0.00 C ATOM 425 CG GLU A 24 -5.360 -7.404 -36.601 1.00 0.00 C ATOM 426 CD GLU A 24 -5.925 -8.326 -37.690 1.00 0.00 C ATOM 427 OE1 GLU A 24 -6.921 -7.944 -38.342 1.00 0.00 O ATOM 428 OE2 GLU A 24 -5.376 -9.422 -37.912 1.00 0.00 O ATOM 0 H GLU A 24 -5.138 -9.833 -34.896 1.00 0.00 H new ATOM 0 HA GLU A 24 -6.839 -7.882 -33.458 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -7.298 -6.876 -35.808 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -5.954 -6.299 -34.843 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -5.104 -6.445 -37.051 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -4.434 -7.835 -36.221 1.00 0.00 H new ATOM 435 N ALA A 25 -8.666 -9.434 -33.877 1.00 0.00 N ATOM 436 CA ALA A 25 -9.815 -10.349 -34.018 1.00 0.00 C ATOM 437 C ALA A 25 -10.997 -9.808 -33.181 1.00 0.00 C ATOM 438 O ALA A 25 -11.094 -8.598 -32.960 1.00 0.00 O ATOM 439 CB ALA A 25 -9.384 -11.772 -33.597 1.00 0.00 C ATOM 0 H ALA A 25 -8.686 -8.896 -33.011 1.00 0.00 H new ATOM 0 HA ALA A 25 -10.149 -10.405 -35.054 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -10.229 -12.453 -33.699 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -8.567 -12.109 -34.236 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -9.051 -11.759 -32.559 1.00 0.00 H new ATOM 445 N HIS A 26 -11.889 -10.711 -32.690 1.00 0.00 N ATOM 446 CA HIS A 26 -13.019 -10.347 -31.788 1.00 0.00 C ATOM 447 C HIS A 26 -12.527 -9.818 -30.408 1.00 0.00 C ATOM 448 O HIS A 26 -13.335 -9.424 -29.558 1.00 0.00 O ATOM 449 CB HIS A 26 -13.966 -11.558 -31.586 1.00 0.00 C ATOM 450 CG HIS A 26 -13.402 -12.665 -30.724 1.00 0.00 C ATOM 451 ND1 HIS A 26 -12.532 -13.622 -31.195 1.00 0.00 N ATOM 452 CD2 HIS A 26 -13.595 -12.952 -29.412 1.00 0.00 C ATOM 453 CE1 HIS A 26 -12.206 -14.435 -30.213 1.00 0.00 C ATOM 454 NE2 HIS A 26 -12.836 -14.054 -29.120 1.00 0.00 N ATOM 0 H HIS A 26 -11.846 -11.707 -32.906 1.00 0.00 H new ATOM 0 HA HIS A 26 -13.565 -9.538 -32.273 1.00 0.00 H new ATOM 0 HB2 HIS A 26 -14.895 -11.205 -31.138 1.00 0.00 H new ATOM 0 HB3 HIS A 26 -14.220 -11.970 -32.563 1.00 0.00 H new ATOM 0 HD2 HIS A 26 -14.230 -12.412 -28.725 1.00 0.00 H new ATOM 0 HE1 HIS A 26 -11.533 -15.276 -30.290 1.00 0.00 H new ATOM 0 HE2 HIS A 26 -12.769 -14.505 -28.208 1.00 0.00 H new ATOM 463 N LEU A 27 -11.191 -9.832 -30.212 1.00 0.00 N ATOM 464 CA LEU A 27 -10.505 -9.214 -29.055 1.00 0.00 C ATOM 465 C LEU A 27 -10.769 -7.683 -28.986 1.00 0.00 C ATOM 466 O LEU A 27 -10.478 -7.075 -27.977 1.00 0.00 O ATOM 467 CB LEU A 27 -8.973 -9.511 -29.112 1.00 0.00 C ATOM 468 CG LEU A 27 -8.511 -10.981 -28.822 1.00 0.00 C ATOM 469 CD1 LEU A 27 -8.980 -11.457 -27.437 1.00 0.00 C ATOM 470 CD2 LEU A 27 -8.933 -11.962 -29.933 1.00 0.00 C ATOM 0 H LEU A 27 -10.547 -10.280 -30.864 1.00 0.00 H new ATOM 0 HA LEU A 27 -10.913 -9.656 -28.146 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -8.613 -9.234 -30.103 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -8.476 -8.855 -28.398 1.00 0.00 H new ATOM 0 HG LEU A 27 -7.421 -10.970 -28.815 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -8.642 -12.480 -27.270 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -8.563 -10.807 -26.668 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -10.068 -11.422 -27.390 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -8.588 -12.965 -29.683 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -10.019 -11.964 -30.024 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -8.490 -11.652 -30.880 1.00 0.00 H new ATOM 482 N TYR A 28 -11.333 -7.120 -30.074 1.00 0.00 N ATOM 483 CA TYR A 28 -11.854 -5.726 -30.241 1.00 0.00 C ATOM 484 C TYR A 28 -12.975 -5.277 -29.243 1.00 0.00 C ATOM 485 O TYR A 28 -13.843 -4.511 -29.641 1.00 0.00 O ATOM 486 CB TYR A 28 -12.246 -5.467 -31.726 1.00 0.00 C ATOM 487 CG TYR A 28 -11.095 -4.940 -32.609 1.00 0.00 C ATOM 488 CD1 TYR A 28 -9.888 -5.634 -32.712 1.00 0.00 C ATOM 489 CD2 TYR A 28 -11.211 -3.734 -33.311 1.00 0.00 C ATOM 490 CE1 TYR A 28 -8.851 -5.155 -33.490 1.00 0.00 C ATOM 491 CE2 TYR A 28 -10.175 -3.255 -34.088 1.00 0.00 C ATOM 492 CZ TYR A 28 -8.995 -3.968 -34.171 1.00 0.00 C ATOM 493 OH TYR A 28 -7.959 -3.486 -34.944 1.00 0.00 O ATOM 0 H TYR A 28 -11.450 -7.660 -30.931 1.00 0.00 H new ATOM 0 HA TYR A 28 -11.019 -5.082 -29.965 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -12.622 -6.395 -32.157 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -13.065 -4.749 -31.752 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -9.762 -6.562 -32.174 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -12.128 -3.168 -33.243 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -7.929 -5.712 -33.563 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -10.287 -2.327 -34.629 1.00 0.00 H new ATOM 0 HH TYR A 28 -8.226 -2.638 -35.357 1.00 0.00 H new ATOM 503 N MET A 29 -13.002 -5.845 -28.021 1.00 0.00 N ATOM 504 CA MET A 29 -13.970 -5.551 -26.926 1.00 0.00 C ATOM 505 C MET A 29 -14.467 -4.082 -26.907 1.00 0.00 C ATOM 506 O MET A 29 -13.670 -3.141 -26.922 1.00 0.00 O ATOM 507 CB MET A 29 -13.280 -5.918 -25.573 1.00 0.00 C ATOM 508 CG MET A 29 -13.922 -5.380 -24.278 1.00 0.00 C ATOM 509 SD MET A 29 -13.433 -3.677 -23.909 1.00 0.00 S ATOM 510 CE MET A 29 -14.241 -3.394 -22.342 1.00 0.00 C ATOM 0 H MET A 29 -12.322 -6.555 -27.750 1.00 0.00 H new ATOM 0 HA MET A 29 -14.865 -6.150 -27.093 1.00 0.00 H new ATOM 0 HB2 MET A 29 -13.237 -7.005 -25.501 1.00 0.00 H new ATOM 0 HB3 MET A 29 -12.251 -5.560 -25.612 1.00 0.00 H new ATOM 0 HG2 MET A 29 -15.007 -5.430 -24.368 1.00 0.00 H new ATOM 0 HG3 MET A 29 -13.641 -6.023 -23.444 1.00 0.00 H new ATOM 0 HE1 MET A 29 -13.981 -2.402 -21.973 1.00 0.00 H new ATOM 0 HE2 MET A 29 -15.321 -3.461 -22.472 1.00 0.00 H new ATOM 0 HE3 MET A 29 -13.915 -4.146 -21.623 1.00 0.00 H new ATOM 520 N GLN A 30 -15.797 -3.927 -26.877 1.00 0.00 N ATOM 521 CA GLN A 30 -16.470 -2.623 -26.872 1.00 0.00 C ATOM 522 C GLN A 30 -16.619 -2.115 -25.441 1.00 0.00 C ATOM 523 O GLN A 30 -16.827 -2.900 -24.508 1.00 0.00 O ATOM 524 CB GLN A 30 -17.859 -2.761 -27.545 1.00 0.00 C ATOM 525 CG GLN A 30 -17.791 -3.037 -29.062 1.00 0.00 C ATOM 526 CD GLN A 30 -19.114 -3.518 -29.663 1.00 0.00 C ATOM 527 OE1 GLN A 30 -20.194 -3.158 -29.191 1.00 0.00 O ATOM 528 NE2 GLN A 30 -19.045 -4.338 -30.705 1.00 0.00 N ATOM 0 H GLN A 30 -16.444 -4.715 -26.855 1.00 0.00 H new ATOM 0 HA GLN A 30 -15.872 -1.903 -27.431 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -18.408 -3.570 -27.062 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -18.427 -1.846 -27.377 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -17.480 -2.126 -29.574 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -17.023 -3.787 -29.251 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -18.136 -4.619 -31.074 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -19.901 -4.687 -31.137 1.00 0.00 H new ATOM 537 N VAL A 31 -16.514 -0.796 -25.285 1.00 0.00 N ATOM 538 CA VAL A 31 -16.667 -0.128 -23.994 1.00 0.00 C ATOM 539 C VAL A 31 -17.555 1.128 -24.173 1.00 0.00 C ATOM 540 O VAL A 31 -17.308 1.960 -25.054 1.00 0.00 O ATOM 541 CB VAL A 31 -15.250 0.200 -23.377 1.00 0.00 C ATOM 542 CG1 VAL A 31 -14.433 1.164 -24.249 1.00 0.00 C ATOM 543 CG2 VAL A 31 -15.345 0.683 -21.916 1.00 0.00 C ATOM 0 H VAL A 31 -16.319 -0.157 -26.056 1.00 0.00 H new ATOM 0 HA VAL A 31 -17.168 -0.785 -23.283 1.00 0.00 H new ATOM 0 HB VAL A 31 -14.702 -0.742 -23.363 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -13.469 1.354 -23.777 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -14.274 0.720 -25.232 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -14.975 2.103 -24.359 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -14.345 0.895 -21.537 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -15.950 1.588 -21.871 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -15.807 -0.093 -21.306 1.00 0.00 H new ATOM 553 N GLN A 32 -18.632 1.196 -23.375 1.00 0.00 N ATOM 554 CA GLN A 32 -19.574 2.321 -23.349 1.00 0.00 C ATOM 555 C GLN A 32 -19.033 3.431 -22.453 1.00 0.00 C ATOM 556 O GLN A 32 -18.929 3.256 -21.236 1.00 0.00 O ATOM 557 CB GLN A 32 -20.973 1.849 -22.844 1.00 0.00 C ATOM 558 CG GLN A 32 -21.935 1.420 -23.956 1.00 0.00 C ATOM 559 CD GLN A 32 -23.308 0.989 -23.443 1.00 0.00 C ATOM 560 OE1 GLN A 32 -23.786 1.484 -22.419 1.00 0.00 O ATOM 561 NE2 GLN A 32 -23.952 0.066 -24.144 1.00 0.00 N ATOM 0 H GLN A 32 -18.875 0.455 -22.718 1.00 0.00 H new ATOM 0 HA GLN A 32 -19.687 2.708 -24.362 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -20.835 1.014 -22.157 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -21.432 2.657 -22.275 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -22.061 2.246 -24.655 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -21.489 0.596 -24.513 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -23.528 -0.323 -24.986 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -24.871 -0.255 -23.841 1.00 0.00 H new ATOM 570 N ILE A 33 -18.671 4.563 -23.064 1.00 0.00 N ATOM 571 CA ILE A 33 -18.149 5.730 -22.339 1.00 0.00 C ATOM 572 C ILE A 33 -19.104 6.910 -22.520 1.00 0.00 C ATOM 573 O ILE A 33 -19.677 7.097 -23.599 1.00 0.00 O ATOM 574 CB ILE A 33 -16.705 6.146 -22.834 1.00 0.00 C ATOM 575 CG1 ILE A 33 -15.776 4.906 -22.943 1.00 0.00 C ATOM 576 CG2 ILE A 33 -16.075 7.221 -21.903 1.00 0.00 C ATOM 577 CD1 ILE A 33 -15.582 4.179 -21.637 1.00 0.00 C ATOM 0 H ILE A 33 -18.731 4.698 -24.073 1.00 0.00 H new ATOM 0 HA ILE A 33 -18.073 5.456 -21.287 1.00 0.00 H new ATOM 0 HB ILE A 33 -16.812 6.583 -23.827 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -16.192 4.214 -23.676 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -14.804 5.223 -23.320 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -15.083 7.485 -22.271 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -16.707 8.109 -21.893 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -15.993 6.823 -20.892 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -14.922 3.325 -21.790 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -15.137 4.855 -20.907 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -16.547 3.830 -21.268 1.00 0.00 H new ATOM 589 N VAL A 34 -19.294 7.678 -21.447 1.00 0.00 N ATOM 590 CA VAL A 34 -19.967 8.983 -21.487 1.00 0.00 C ATOM 591 C VAL A 34 -19.165 9.986 -20.651 1.00 0.00 C ATOM 592 O VAL A 34 -18.676 9.659 -19.561 1.00 0.00 O ATOM 593 CB VAL A 34 -21.461 8.938 -20.975 1.00 0.00 C ATOM 594 CG1 VAL A 34 -22.428 8.482 -22.095 1.00 0.00 C ATOM 595 CG2 VAL A 34 -21.584 8.033 -19.726 1.00 0.00 C ATOM 0 H VAL A 34 -18.982 7.411 -20.513 1.00 0.00 H new ATOM 0 HA VAL A 34 -20.009 9.289 -22.532 1.00 0.00 H new ATOM 0 HB VAL A 34 -21.748 9.950 -20.689 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -23.447 8.462 -21.710 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -22.370 9.178 -22.932 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -22.148 7.484 -22.433 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -22.621 8.016 -19.390 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -21.267 7.021 -19.978 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -20.951 8.424 -18.930 1.00 0.00 H new ATOM 605 N ALA A 35 -19.017 11.197 -21.188 1.00 0.00 N ATOM 606 CA ALA A 35 -18.403 12.335 -20.495 1.00 0.00 C ATOM 607 C ALA A 35 -19.444 13.450 -20.368 1.00 0.00 C ATOM 608 O ALA A 35 -20.347 13.553 -21.211 1.00 0.00 O ATOM 609 CB ALA A 35 -17.163 12.819 -21.260 1.00 0.00 C ATOM 0 H ALA A 35 -19.325 11.421 -22.134 1.00 0.00 H new ATOM 0 HA ALA A 35 -18.077 12.034 -19.499 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -16.718 13.664 -20.734 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -16.437 12.009 -21.326 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -17.453 13.129 -22.264 1.00 0.00 H new ATOM 615 N GLU A 36 -19.336 14.277 -19.316 1.00 0.00 N ATOM 616 CA GLU A 36 -20.249 15.411 -19.107 1.00 0.00 C ATOM 617 C GLU A 36 -19.453 16.603 -18.559 1.00 0.00 C ATOM 618 O GLU A 36 -19.485 16.924 -17.372 1.00 0.00 O ATOM 619 CB GLU A 36 -21.446 14.998 -18.204 1.00 0.00 C ATOM 620 CG GLU A 36 -22.602 16.017 -18.179 1.00 0.00 C ATOM 621 CD GLU A 36 -23.894 15.467 -17.552 1.00 0.00 C ATOM 622 OE1 GLU A 36 -24.544 14.602 -18.184 1.00 0.00 O ATOM 623 OE2 GLU A 36 -24.267 15.894 -16.438 1.00 0.00 O ATOM 0 H GLU A 36 -18.622 14.180 -18.594 1.00 0.00 H new ATOM 0 HA GLU A 36 -20.690 15.720 -20.055 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -21.831 14.038 -18.547 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -21.085 14.851 -17.186 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -22.285 16.899 -17.623 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -22.812 16.341 -19.198 1.00 0.00 H new ATOM 630 N ASP A 37 -18.671 17.207 -19.464 1.00 0.00 N ATOM 631 CA ASP A 37 -17.856 18.416 -19.210 1.00 0.00 C ATOM 632 C ASP A 37 -18.674 19.707 -19.526 1.00 0.00 C ATOM 633 O ASP A 37 -18.134 20.817 -19.530 1.00 0.00 O ATOM 634 CB ASP A 37 -16.540 18.300 -20.047 1.00 0.00 C ATOM 635 CG ASP A 37 -15.559 19.486 -19.935 1.00 0.00 C ATOM 636 OD1 ASP A 37 -15.136 19.814 -18.808 1.00 0.00 O ATOM 637 OD2 ASP A 37 -15.193 20.073 -20.983 1.00 0.00 O ATOM 0 H ASP A 37 -18.581 16.864 -20.420 1.00 0.00 H new ATOM 0 HA ASP A 37 -17.586 18.490 -18.157 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -16.018 17.393 -19.742 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -16.810 18.176 -21.096 1.00 0.00 H new ATOM 642 N GLN A 38 -20.004 19.537 -19.739 1.00 0.00 N ATOM 643 CA GLN A 38 -20.957 20.632 -20.092 1.00 0.00 C ATOM 644 C GLN A 38 -20.927 21.817 -19.091 1.00 0.00 C ATOM 645 O GLN A 38 -21.293 22.945 -19.439 1.00 0.00 O ATOM 646 CB GLN A 38 -22.409 20.081 -20.147 1.00 0.00 C ATOM 647 CG GLN A 38 -22.976 19.659 -18.769 1.00 0.00 C ATOM 648 CD GLN A 38 -24.477 19.391 -18.762 1.00 0.00 C ATOM 649 OE1 GLN A 38 -25.226 19.959 -19.558 1.00 0.00 O ATOM 650 NE2 GLN A 38 -24.930 18.547 -17.852 1.00 0.00 N ATOM 0 H GLN A 38 -20.455 18.625 -19.671 1.00 0.00 H new ATOM 0 HA GLN A 38 -20.638 21.005 -21.065 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -23.059 20.842 -20.578 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -22.435 19.222 -20.818 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -22.457 18.760 -18.436 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -22.755 20.442 -18.043 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -24.281 18.094 -17.208 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -25.929 18.348 -17.793 1.00 0.00 H new ATOM 659 N PHE A 39 -20.507 21.525 -17.842 1.00 0.00 N ATOM 660 CA PHE A 39 -20.511 22.487 -16.720 1.00 0.00 C ATOM 661 C PHE A 39 -19.478 23.616 -16.944 1.00 0.00 C ATOM 662 O PHE A 39 -19.603 24.706 -16.374 1.00 0.00 O ATOM 663 CB PHE A 39 -20.232 21.742 -15.389 1.00 0.00 C ATOM 664 CG PHE A 39 -21.184 20.571 -15.115 1.00 0.00 C ATOM 665 CD1 PHE A 39 -22.418 20.777 -14.495 1.00 0.00 C ATOM 666 CD2 PHE A 39 -20.844 19.264 -15.479 1.00 0.00 C ATOM 667 CE1 PHE A 39 -23.275 19.718 -14.249 1.00 0.00 C ATOM 668 CE2 PHE A 39 -21.702 18.211 -15.232 1.00 0.00 C ATOM 669 CZ PHE A 39 -22.918 18.439 -14.616 1.00 0.00 C ATOM 0 H PHE A 39 -20.152 20.605 -17.582 1.00 0.00 H new ATOM 0 HA PHE A 39 -21.496 22.952 -16.667 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -19.208 21.368 -15.402 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -20.301 22.453 -14.566 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -22.708 21.776 -14.203 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -19.896 19.076 -15.961 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -24.226 19.895 -13.768 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -21.423 17.208 -15.520 1.00 0.00 H new ATOM 0 HZ PHE A 39 -23.588 17.615 -14.422 1.00 0.00 H new ATOM 679 N CYS A 40 -18.478 23.341 -17.805 1.00 0.00 N ATOM 680 CA CYS A 40 -17.444 24.317 -18.208 1.00 0.00 C ATOM 681 C CYS A 40 -18.037 25.466 -19.069 1.00 0.00 C ATOM 682 O CYS A 40 -17.381 26.491 -19.285 1.00 0.00 O ATOM 683 CB CYS A 40 -16.324 23.584 -18.982 1.00 0.00 C ATOM 684 SG CYS A 40 -14.925 24.631 -19.460 1.00 0.00 S ATOM 0 H CYS A 40 -18.364 22.428 -18.244 1.00 0.00 H new ATOM 0 HA CYS A 40 -17.033 24.772 -17.307 1.00 0.00 H new ATOM 0 HB2 CYS A 40 -15.953 22.764 -18.367 1.00 0.00 H new ATOM 0 HB3 CYS A 40 -16.752 23.141 -19.881 1.00 0.00 H new ATOM 0 HG CYS A 40 -15.329 25.859 -19.599 1.00 0.00 H new ATOM 690 N GLY A 41 -19.279 25.281 -19.563 1.00 0.00 N ATOM 691 CA GLY A 41 -19.978 26.304 -20.339 1.00 0.00 C ATOM 692 C GLY A 41 -21.488 26.124 -20.291 1.00 0.00 C ATOM 693 O GLY A 41 -22.077 26.166 -19.207 1.00 0.00 O ATOM 0 H GLY A 41 -19.814 24.423 -19.432 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -19.718 27.291 -19.955 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -19.641 26.266 -21.375 1.00 0.00 H new ATOM 697 N HIS A 42 -22.106 25.886 -21.468 1.00 0.00 N ATOM 698 CA HIS A 42 -23.573 25.756 -21.615 1.00 0.00 C ATOM 699 C HIS A 42 -23.937 25.190 -23.004 1.00 0.00 C ATOM 700 O HIS A 42 -24.966 24.509 -23.145 1.00 0.00 O ATOM 701 CB HIS A 42 -24.265 27.132 -21.388 1.00 0.00 C ATOM 702 CG HIS A 42 -25.776 27.117 -21.473 1.00 0.00 C ATOM 703 ND1 HIS A 42 -26.498 28.055 -22.178 1.00 0.00 N ATOM 704 CD2 HIS A 42 -26.695 26.288 -20.918 1.00 0.00 C ATOM 705 CE1 HIS A 42 -27.782 27.809 -22.059 1.00 0.00 C ATOM 706 NE2 HIS A 42 -27.934 26.744 -21.298 1.00 0.00 N ATOM 0 H HIS A 42 -21.600 25.778 -22.347 1.00 0.00 H new ATOM 0 HA HIS A 42 -23.932 25.058 -20.859 1.00 0.00 H new ATOM 0 HB2 HIS A 42 -23.976 27.508 -20.406 1.00 0.00 H new ATOM 0 HB3 HIS A 42 -23.883 27.838 -22.125 1.00 0.00 H new ATOM 0 HD2 HIS A 42 -26.491 25.430 -20.294 1.00 0.00 H new ATOM 0 HE1 HIS A 42 -28.579 28.383 -22.509 1.00 0.00 H new ATOM 0 HE2 HIS A 42 -28.826 26.326 -21.034 1.00 0.00 H new ATOM 715 N GLN A 43 -23.095 25.505 -24.012 1.00 0.00 N ATOM 716 CA GLN A 43 -23.233 25.047 -25.420 1.00 0.00 C ATOM 717 C GLN A 43 -24.415 25.746 -26.135 1.00 0.00 C ATOM 718 O GLN A 43 -24.201 26.586 -27.020 1.00 0.00 O ATOM 719 CB GLN A 43 -23.306 23.490 -25.522 1.00 0.00 C ATOM 720 CG GLN A 43 -22.018 22.753 -25.088 1.00 0.00 C ATOM 721 CD GLN A 43 -20.795 23.115 -25.942 1.00 0.00 C ATOM 722 OE1 GLN A 43 -20.054 24.040 -25.632 1.00 0.00 O ATOM 723 NE2 GLN A 43 -20.595 22.406 -27.042 1.00 0.00 N ATOM 0 H GLN A 43 -22.279 26.100 -23.870 1.00 0.00 H new ATOM 0 HA GLN A 43 -22.328 25.346 -25.949 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -24.134 23.138 -24.908 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -23.535 23.217 -26.552 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -21.807 22.988 -24.045 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -22.186 21.678 -25.144 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -21.227 21.641 -27.277 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -19.809 22.625 -27.654 1.00 0.00 H new ATOM 732 N GLY A 44 -25.654 25.403 -25.743 1.00 0.00 N ATOM 733 CA GLY A 44 -26.856 26.097 -26.226 1.00 0.00 C ATOM 734 C GLY A 44 -27.382 25.567 -27.560 1.00 0.00 C ATOM 735 O GLY A 44 -28.384 24.851 -27.592 1.00 0.00 O ATOM 0 H GLY A 44 -25.848 24.645 -25.089 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -27.641 26.008 -25.476 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -26.634 27.159 -26.330 1.00 0.00 H new ATOM 739 N ASN A 45 -26.684 25.897 -28.671 1.00 0.00 N ATOM 740 CA ASN A 45 -27.161 25.609 -30.048 1.00 0.00 C ATOM 741 C ASN A 45 -26.132 24.761 -30.832 1.00 0.00 C ATOM 742 O ASN A 45 -25.163 25.299 -31.385 1.00 0.00 O ATOM 743 CB ASN A 45 -27.457 26.941 -30.810 1.00 0.00 C ATOM 744 CG ASN A 45 -28.624 27.740 -30.209 1.00 0.00 C ATOM 745 OD1 ASN A 45 -29.776 27.587 -30.617 1.00 0.00 O ATOM 746 ND2 ASN A 45 -28.339 28.583 -29.226 1.00 0.00 N ATOM 0 H ASN A 45 -25.780 26.368 -28.642 1.00 0.00 H new ATOM 0 HA ASN A 45 -28.083 25.033 -29.970 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -26.561 27.561 -30.805 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -27.681 26.713 -31.852 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -29.083 29.125 -28.787 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -27.376 28.689 -28.909 1.00 0.00 H new ATOM 753 N ASP A 46 -26.341 23.424 -30.829 1.00 0.00 N ATOM 754 CA ASP A 46 -25.595 22.456 -31.674 1.00 0.00 C ATOM 755 C ASP A 46 -26.333 21.083 -31.619 1.00 0.00 C ATOM 756 O ASP A 46 -27.561 21.064 -31.786 1.00 0.00 O ATOM 757 CB ASP A 46 -24.090 22.386 -31.257 1.00 0.00 C ATOM 758 CG ASP A 46 -23.203 21.558 -32.209 1.00 0.00 C ATOM 759 OD1 ASP A 46 -23.053 21.943 -33.389 1.00 0.00 O ATOM 760 OD2 ASP A 46 -22.655 20.519 -31.783 1.00 0.00 O ATOM 0 H ASP A 46 -27.040 22.980 -30.234 1.00 0.00 H new ATOM 0 HA ASP A 46 -25.580 22.783 -32.714 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -23.694 23.400 -31.201 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -24.022 21.961 -30.255 1.00 0.00 H new ATOM 765 N MET A 47 -25.619 19.960 -31.359 1.00 0.00 N ATOM 766 CA MET A 47 -26.166 18.586 -31.448 1.00 0.00 C ATOM 767 C MET A 47 -25.053 17.598 -31.074 1.00 0.00 C ATOM 768 O MET A 47 -25.235 16.725 -30.221 1.00 0.00 O ATOM 769 CB MET A 47 -26.714 18.275 -32.886 1.00 0.00 C ATOM 770 CG MET A 47 -27.391 16.899 -33.068 1.00 0.00 C ATOM 771 SD MET A 47 -26.231 15.509 -33.133 1.00 0.00 S ATOM 772 CE MET A 47 -25.346 15.833 -34.663 1.00 0.00 C ATOM 0 H MET A 47 -24.638 19.984 -31.079 1.00 0.00 H new ATOM 0 HA MET A 47 -27.005 18.490 -30.759 1.00 0.00 H new ATOM 0 HB2 MET A 47 -27.432 19.050 -33.155 1.00 0.00 H new ATOM 0 HB3 MET A 47 -25.887 18.347 -33.592 1.00 0.00 H new ATOM 0 HG2 MET A 47 -28.089 16.738 -32.247 1.00 0.00 H new ATOM 0 HG3 MET A 47 -27.977 16.913 -33.987 1.00 0.00 H new ATOM 0 HE1 MET A 47 -24.664 15.008 -34.871 1.00 0.00 H new ATOM 0 HE2 MET A 47 -26.059 15.930 -35.482 1.00 0.00 H new ATOM 0 HE3 MET A 47 -24.778 16.758 -34.566 1.00 0.00 H new ATOM 782 N TYR A 48 -23.881 17.767 -31.718 1.00 0.00 N ATOM 783 CA TYR A 48 -22.708 16.890 -31.527 1.00 0.00 C ATOM 784 C TYR A 48 -21.743 17.543 -30.524 1.00 0.00 C ATOM 785 O TYR A 48 -20.536 17.674 -30.773 1.00 0.00 O ATOM 786 CB TYR A 48 -22.017 16.599 -32.897 1.00 0.00 C ATOM 787 CG TYR A 48 -21.378 15.196 -33.004 1.00 0.00 C ATOM 788 CD1 TYR A 48 -20.377 14.775 -32.118 1.00 0.00 C ATOM 789 CD2 TYR A 48 -21.784 14.286 -33.991 1.00 0.00 C ATOM 790 CE1 TYR A 48 -19.815 13.519 -32.211 1.00 0.00 C ATOM 791 CE2 TYR A 48 -21.219 13.028 -34.083 1.00 0.00 C ATOM 792 CZ TYR A 48 -20.238 12.650 -33.194 1.00 0.00 C ATOM 793 OH TYR A 48 -19.672 11.396 -33.289 1.00 0.00 O ATOM 0 H TYR A 48 -23.721 18.519 -32.388 1.00 0.00 H new ATOM 0 HA TYR A 48 -23.026 15.931 -31.119 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -22.753 16.711 -33.693 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -21.246 17.350 -33.068 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -20.038 15.449 -31.345 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -22.553 14.574 -34.693 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -19.046 13.217 -31.516 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -21.546 12.343 -34.851 1.00 0.00 H new ATOM 0 HH TYR A 48 -20.082 10.908 -34.033 1.00 0.00 H new ATOM 803 N ASP A 49 -22.313 17.977 -29.402 1.00 0.00 N ATOM 804 CA ASP A 49 -21.569 18.546 -28.280 1.00 0.00 C ATOM 805 C ASP A 49 -20.749 17.423 -27.639 1.00 0.00 C ATOM 806 O ASP A 49 -21.321 16.520 -27.044 1.00 0.00 O ATOM 807 CB ASP A 49 -22.571 19.185 -27.274 1.00 0.00 C ATOM 808 CG ASP A 49 -23.535 20.180 -27.954 1.00 0.00 C ATOM 809 OD1 ASP A 49 -23.150 21.349 -28.153 1.00 0.00 O ATOM 810 OD2 ASP A 49 -24.673 19.793 -28.322 1.00 0.00 O ATOM 0 H ASP A 49 -23.320 17.943 -29.244 1.00 0.00 H new ATOM 0 HA ASP A 49 -20.888 19.332 -28.608 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -23.148 18.397 -26.791 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -22.016 19.700 -26.490 1.00 0.00 H new ATOM 815 N GLU A 50 -19.414 17.476 -27.803 1.00 0.00 N ATOM 816 CA GLU A 50 -18.500 16.352 -27.484 1.00 0.00 C ATOM 817 C GLU A 50 -18.485 16.014 -25.974 1.00 0.00 C ATOM 818 O GLU A 50 -18.119 14.902 -25.581 1.00 0.00 O ATOM 819 CB GLU A 50 -17.067 16.676 -27.981 1.00 0.00 C ATOM 820 CG GLU A 50 -16.964 16.953 -29.498 1.00 0.00 C ATOM 821 CD GLU A 50 -15.526 17.226 -29.990 1.00 0.00 C ATOM 822 OE1 GLU A 50 -14.815 16.259 -30.360 1.00 0.00 O ATOM 823 OE2 GLU A 50 -15.095 18.404 -30.011 1.00 0.00 O ATOM 0 H GLU A 50 -18.933 18.301 -28.162 1.00 0.00 H new ATOM 0 HA GLU A 50 -18.874 15.470 -28.003 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -16.696 17.546 -27.439 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -16.412 15.842 -27.731 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -17.367 16.098 -30.041 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -17.590 17.811 -29.744 1.00 0.00 H new ATOM 830 N GLU A 51 -18.883 16.993 -25.145 1.00 0.00 N ATOM 831 CA GLU A 51 -18.975 16.845 -23.687 1.00 0.00 C ATOM 832 C GLU A 51 -20.379 16.394 -23.250 1.00 0.00 C ATOM 833 O GLU A 51 -20.645 16.282 -22.055 1.00 0.00 O ATOM 834 CB GLU A 51 -18.632 18.182 -22.986 1.00 0.00 C ATOM 835 CG GLU A 51 -19.494 19.409 -23.386 1.00 0.00 C ATOM 836 CD GLU A 51 -19.023 20.119 -24.668 1.00 0.00 C ATOM 837 OE1 GLU A 51 -18.056 20.894 -24.595 1.00 0.00 O ATOM 838 OE2 GLU A 51 -19.592 19.881 -25.749 1.00 0.00 O ATOM 0 H GLU A 51 -19.153 17.920 -25.475 1.00 0.00 H new ATOM 0 HA GLU A 51 -18.257 16.079 -23.395 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -18.722 18.037 -21.909 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -17.587 18.417 -23.190 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -20.526 19.085 -23.521 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -19.490 20.125 -22.565 1.00 0.00 H new ATOM 845 N LYS A 52 -21.280 16.186 -24.210 1.00 0.00 N ATOM 846 CA LYS A 52 -22.671 15.806 -23.926 1.00 0.00 C ATOM 847 C LYS A 52 -23.181 14.728 -24.912 1.00 0.00 C ATOM 848 O LYS A 52 -24.387 14.446 -24.954 1.00 0.00 O ATOM 849 CB LYS A 52 -23.578 17.080 -23.942 1.00 0.00 C ATOM 850 CG LYS A 52 -24.842 16.958 -23.060 1.00 0.00 C ATOM 851 CD LYS A 52 -24.508 16.977 -21.550 1.00 0.00 C ATOM 852 CE LYS A 52 -25.711 16.611 -20.663 1.00 0.00 C ATOM 853 NZ LYS A 52 -26.095 15.187 -20.810 1.00 0.00 N ATOM 0 H LYS A 52 -21.071 16.275 -25.204 1.00 0.00 H new ATOM 0 HA LYS A 52 -22.715 15.361 -22.932 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -22.993 17.935 -23.605 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -23.881 17.286 -24.969 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -25.523 17.778 -23.290 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -25.364 16.032 -23.303 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -23.694 16.279 -21.355 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -24.150 17.969 -21.275 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -25.468 16.815 -19.620 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -26.559 17.244 -20.923 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -27.115 15.121 -21.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -25.565 14.764 -21.599 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -25.875 14.676 -19.932 1.00 0.00 H new ATOM 867 N VAL A 53 -22.261 14.119 -25.695 1.00 0.00 N ATOM 868 CA VAL A 53 -22.617 13.038 -26.647 1.00 0.00 C ATOM 869 C VAL A 53 -23.059 11.757 -25.911 1.00 0.00 C ATOM 870 O VAL A 53 -22.734 11.553 -24.732 1.00 0.00 O ATOM 871 CB VAL A 53 -21.443 12.695 -27.656 1.00 0.00 C ATOM 872 CG1 VAL A 53 -21.228 13.832 -28.678 1.00 0.00 C ATOM 873 CG2 VAL A 53 -20.127 12.361 -26.901 1.00 0.00 C ATOM 0 H VAL A 53 -21.269 14.356 -25.688 1.00 0.00 H new ATOM 0 HA VAL A 53 -23.454 13.422 -27.229 1.00 0.00 H new ATOM 0 HB VAL A 53 -21.740 11.805 -28.211 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -20.416 13.565 -29.354 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -22.143 13.984 -29.251 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -20.973 14.751 -28.151 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -19.342 12.131 -27.622 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -19.826 13.218 -26.298 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -20.288 11.500 -26.252 1.00 0.00 H new ATOM 883 N LYS A 54 -23.808 10.910 -26.641 1.00 0.00 N ATOM 884 CA LYS A 54 -24.349 9.628 -26.133 1.00 0.00 C ATOM 885 C LYS A 54 -23.229 8.596 -25.829 1.00 0.00 C ATOM 886 O LYS A 54 -22.034 8.906 -25.950 1.00 0.00 O ATOM 887 CB LYS A 54 -25.375 9.021 -27.150 1.00 0.00 C ATOM 888 CG LYS A 54 -24.780 8.469 -28.485 1.00 0.00 C ATOM 889 CD LYS A 54 -24.430 9.554 -29.530 1.00 0.00 C ATOM 890 CE LYS A 54 -25.671 10.295 -30.066 1.00 0.00 C ATOM 891 NZ LYS A 54 -25.316 11.335 -31.060 1.00 0.00 N ATOM 0 H LYS A 54 -24.060 11.095 -27.612 1.00 0.00 H new ATOM 0 HA LYS A 54 -24.858 9.848 -25.194 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -25.911 8.212 -26.654 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -26.110 9.788 -27.394 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -23.880 7.898 -28.258 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -25.495 7.775 -28.927 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -23.748 10.276 -29.082 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -23.902 9.091 -30.363 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -26.352 9.577 -30.522 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -26.204 10.756 -29.235 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -26.181 11.807 -31.393 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -24.687 12.036 -30.619 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -24.831 10.893 -31.867 1.00 0.00 H new ATOM 905 N TYR A 55 -23.640 7.366 -25.433 1.00 0.00 N ATOM 906 CA TYR A 55 -22.719 6.240 -25.195 1.00 0.00 C ATOM 907 C TYR A 55 -21.893 5.926 -26.448 1.00 0.00 C ATOM 908 O TYR A 55 -22.408 5.387 -27.433 1.00 0.00 O ATOM 909 CB TYR A 55 -23.486 4.979 -24.705 1.00 0.00 C ATOM 910 CG TYR A 55 -23.722 4.985 -23.194 1.00 0.00 C ATOM 911 CD1 TYR A 55 -22.628 4.947 -22.336 1.00 0.00 C ATOM 912 CD2 TYR A 55 -24.994 5.061 -22.630 1.00 0.00 C ATOM 913 CE1 TYR A 55 -22.782 4.973 -20.981 1.00 0.00 C ATOM 914 CE2 TYR A 55 -25.159 5.087 -21.258 1.00 0.00 C ATOM 915 CZ TYR A 55 -24.049 5.048 -20.437 1.00 0.00 C ATOM 916 OH TYR A 55 -24.211 5.077 -19.066 1.00 0.00 O ATOM 0 H TYR A 55 -24.620 7.133 -25.271 1.00 0.00 H new ATOM 0 HA TYR A 55 -22.030 6.540 -24.405 1.00 0.00 H new ATOM 0 HB2 TYR A 55 -24.445 4.919 -25.219 1.00 0.00 H new ATOM 0 HB3 TYR A 55 -22.922 4.087 -24.978 1.00 0.00 H new ATOM 0 HD1 TYR A 55 -21.633 4.896 -22.753 1.00 0.00 H new ATOM 0 HD2 TYR A 55 -25.861 5.100 -23.273 1.00 0.00 H new ATOM 0 HE1 TYR A 55 -21.916 4.935 -20.336 1.00 0.00 H new ATOM 0 HE2 TYR A 55 -26.150 5.137 -20.831 1.00 0.00 H new ATOM 0 HH TYR A 55 -25.165 5.132 -18.850 1.00 0.00 H new ATOM 926 N THR A 56 -20.620 6.330 -26.390 1.00 0.00 N ATOM 927 CA THR A 56 -19.642 6.088 -27.439 1.00 0.00 C ATOM 928 C THR A 56 -19.069 4.662 -27.283 1.00 0.00 C ATOM 929 O THR A 56 -18.815 4.199 -26.163 1.00 0.00 O ATOM 930 CB THR A 56 -18.520 7.179 -27.406 1.00 0.00 C ATOM 931 OG1 THR A 56 -17.681 7.076 -28.565 1.00 0.00 O ATOM 932 CG2 THR A 56 -17.661 7.109 -26.146 1.00 0.00 C ATOM 0 H THR A 56 -20.240 6.844 -25.595 1.00 0.00 H new ATOM 0 HA THR A 56 -20.123 6.157 -28.415 1.00 0.00 H new ATOM 0 HB THR A 56 -19.030 8.143 -27.402 1.00 0.00 H new ATOM 0 HG1 THR A 56 -16.747 6.977 -28.285 1.00 0.00 H new ATOM 0 HG21 THR A 56 -16.901 7.889 -26.180 1.00 0.00 H new ATOM 0 HG22 THR A 56 -18.291 7.254 -25.268 1.00 0.00 H new ATOM 0 HG23 THR A 56 -17.177 6.134 -26.089 1.00 0.00 H new ATOM 940 N VAL A 57 -18.912 3.978 -28.416 1.00 0.00 N ATOM 941 CA VAL A 57 -18.483 2.573 -28.490 1.00 0.00 C ATOM 942 C VAL A 57 -17.031 2.517 -28.983 1.00 0.00 C ATOM 943 O VAL A 57 -16.764 2.717 -30.175 1.00 0.00 O ATOM 944 CB VAL A 57 -19.434 1.768 -29.456 1.00 0.00 C ATOM 945 CG1 VAL A 57 -19.026 0.283 -29.560 1.00 0.00 C ATOM 946 CG2 VAL A 57 -20.912 1.914 -29.011 1.00 0.00 C ATOM 0 H VAL A 57 -19.083 4.392 -29.333 1.00 0.00 H new ATOM 0 HA VAL A 57 -18.540 2.117 -27.502 1.00 0.00 H new ATOM 0 HB VAL A 57 -19.331 2.196 -30.453 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -19.707 -0.235 -30.235 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -18.009 0.211 -29.945 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -19.074 -0.177 -28.573 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -21.554 1.352 -29.690 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -21.027 1.527 -27.999 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -21.196 2.966 -29.032 1.00 0.00 H new ATOM 956 N PHE A 58 -16.087 2.308 -28.047 1.00 0.00 N ATOM 957 CA PHE A 58 -14.661 2.131 -28.380 1.00 0.00 C ATOM 958 C PHE A 58 -14.339 0.638 -28.408 1.00 0.00 C ATOM 959 O PHE A 58 -14.454 -0.049 -27.391 1.00 0.00 O ATOM 960 CB PHE A 58 -13.739 2.893 -27.381 1.00 0.00 C ATOM 961 CG PHE A 58 -13.938 4.408 -27.382 1.00 0.00 C ATOM 962 CD1 PHE A 58 -14.120 5.102 -28.578 1.00 0.00 C ATOM 963 CD2 PHE A 58 -13.958 5.134 -26.193 1.00 0.00 C ATOM 964 CE1 PHE A 58 -14.316 6.464 -28.585 1.00 0.00 C ATOM 965 CE2 PHE A 58 -14.157 6.498 -26.204 1.00 0.00 C ATOM 966 CZ PHE A 58 -14.337 7.161 -27.397 1.00 0.00 C ATOM 0 H PHE A 58 -16.288 2.257 -27.048 1.00 0.00 H new ATOM 0 HA PHE A 58 -14.470 2.558 -29.364 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -13.919 2.514 -26.375 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -12.699 2.673 -27.623 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -14.107 4.562 -29.513 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -13.816 4.623 -25.252 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -14.453 6.986 -29.521 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -14.172 7.048 -25.275 1.00 0.00 H new ATOM 0 HZ PHE A 58 -14.495 8.229 -27.402 1.00 0.00 H new ATOM 976 N LYS A 59 -13.966 0.142 -29.595 1.00 0.00 N ATOM 977 CA LYS A 59 -13.665 -1.277 -29.816 1.00 0.00 C ATOM 978 C LYS A 59 -12.137 -1.460 -29.864 1.00 0.00 C ATOM 979 O LYS A 59 -11.462 -1.033 -30.809 1.00 0.00 O ATOM 980 CB LYS A 59 -14.390 -1.825 -31.098 1.00 0.00 C ATOM 981 CG LYS A 59 -13.996 -1.247 -32.486 1.00 0.00 C ATOM 982 CD LYS A 59 -14.426 0.214 -32.721 1.00 0.00 C ATOM 983 CE LYS A 59 -15.939 0.446 -32.550 1.00 0.00 C ATOM 984 NZ LYS A 59 -16.316 1.850 -32.842 1.00 0.00 N ATOM 0 H LYS A 59 -13.864 0.717 -30.432 1.00 0.00 H new ATOM 0 HA LYS A 59 -14.052 -1.871 -28.988 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -14.230 -2.903 -31.132 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -15.460 -1.665 -30.966 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -12.914 -1.316 -32.599 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -14.438 -1.871 -33.263 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -13.887 0.859 -32.027 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -14.132 0.513 -33.727 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -16.487 -0.223 -33.213 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -16.233 0.195 -31.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -16.526 2.345 -31.952 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -15.529 2.327 -33.327 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -17.158 1.864 -33.453 1.00 0.00 H new ATOM 998 N VAL A 60 -11.592 -2.072 -28.800 1.00 0.00 N ATOM 999 CA VAL A 60 -10.136 -2.181 -28.567 1.00 0.00 C ATOM 1000 C VAL A 60 -9.792 -3.569 -27.998 1.00 0.00 C ATOM 1001 O VAL A 60 -10.671 -4.293 -27.496 1.00 0.00 O ATOM 1002 CB VAL A 60 -9.609 -1.048 -27.590 1.00 0.00 C ATOM 1003 CG1 VAL A 60 -9.616 0.348 -28.265 1.00 0.00 C ATOM 1004 CG2 VAL A 60 -10.431 -1.021 -26.281 1.00 0.00 C ATOM 0 H VAL A 60 -12.152 -2.510 -28.069 1.00 0.00 H new ATOM 0 HA VAL A 60 -9.638 -2.049 -29.528 1.00 0.00 H new ATOM 0 HB VAL A 60 -8.575 -1.290 -27.346 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -9.248 1.094 -27.561 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -8.972 0.330 -29.145 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -10.633 0.602 -28.565 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -10.050 -0.236 -25.628 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -11.478 -0.824 -26.513 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -10.346 -1.984 -25.778 1.00 0.00 H new ATOM 1014 N LEU A 61 -8.498 -3.928 -28.088 1.00 0.00 N ATOM 1015 CA LEU A 61 -7.985 -5.230 -27.642 1.00 0.00 C ATOM 1016 C LEU A 61 -8.057 -5.360 -26.103 1.00 0.00 C ATOM 1017 O LEU A 61 -7.382 -4.629 -25.368 1.00 0.00 O ATOM 1018 CB LEU A 61 -6.553 -5.441 -28.189 1.00 0.00 C ATOM 1019 CG LEU A 61 -6.442 -5.440 -29.750 1.00 0.00 C ATOM 1020 CD1 LEU A 61 -4.979 -5.462 -30.217 1.00 0.00 C ATOM 1021 CD2 LEU A 61 -7.237 -6.610 -30.375 1.00 0.00 C ATOM 0 H LEU A 61 -7.778 -3.318 -28.475 1.00 0.00 H new ATOM 0 HA LEU A 61 -8.615 -6.023 -28.045 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -5.908 -4.657 -27.792 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -6.171 -6.390 -27.812 1.00 0.00 H new ATOM 0 HG LEU A 61 -6.886 -4.508 -30.099 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -4.945 -5.461 -31.306 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -4.462 -4.581 -29.837 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -4.490 -6.360 -29.840 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -7.138 -6.579 -31.460 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -6.845 -7.556 -30.002 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -8.289 -6.521 -30.104 1.00 0.00 H new ATOM 1033 N LYS A 62 -8.919 -6.294 -25.654 1.00 0.00 N ATOM 1034 CA LYS A 62 -9.188 -6.586 -24.234 1.00 0.00 C ATOM 1035 C LYS A 62 -7.929 -7.087 -23.499 1.00 0.00 C ATOM 1036 O LYS A 62 -7.700 -6.771 -22.325 1.00 0.00 O ATOM 1037 CB LYS A 62 -10.332 -7.635 -24.134 1.00 0.00 C ATOM 1038 CG LYS A 62 -10.073 -8.972 -24.890 1.00 0.00 C ATOM 1039 CD LYS A 62 -11.247 -9.988 -24.794 1.00 0.00 C ATOM 1040 CE LYS A 62 -12.546 -9.482 -25.450 1.00 0.00 C ATOM 1041 NZ LYS A 62 -13.672 -10.431 -25.288 1.00 0.00 N ATOM 0 H LYS A 62 -9.461 -6.881 -26.287 1.00 0.00 H new ATOM 0 HA LYS A 62 -9.493 -5.660 -23.746 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -10.507 -7.859 -23.082 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -11.248 -7.188 -24.521 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -9.880 -8.753 -25.940 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -9.171 -9.435 -24.490 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -10.949 -10.923 -25.268 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -11.441 -10.211 -23.745 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -12.819 -8.521 -25.013 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -12.370 -9.311 -26.512 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -14.572 -9.910 -25.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -13.654 -11.126 -26.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -13.582 -10.924 -24.377 1.00 0.00 H new ATOM 1055 N ASN A 63 -7.112 -7.841 -24.236 1.00 0.00 N ATOM 1056 CA ASN A 63 -5.868 -8.466 -23.736 1.00 0.00 C ATOM 1057 C ASN A 63 -4.656 -7.528 -23.907 1.00 0.00 C ATOM 1058 O ASN A 63 -3.504 -7.959 -23.768 1.00 0.00 O ATOM 1059 CB ASN A 63 -5.655 -9.803 -24.484 1.00 0.00 C ATOM 1060 CG ASN A 63 -5.606 -9.624 -26.006 1.00 0.00 C ATOM 1061 OD1 ASN A 63 -6.639 -9.491 -26.643 1.00 0.00 O ATOM 1062 ND2 ASN A 63 -4.430 -9.622 -26.590 1.00 0.00 N ATOM 0 H ASN A 63 -7.293 -8.044 -25.219 1.00 0.00 H new ATOM 0 HA ASN A 63 -5.963 -8.657 -22.667 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -4.726 -10.261 -24.145 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -6.461 -10.491 -24.228 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -4.363 -9.507 -27.601 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -3.583 -9.735 -26.032 1.00 0.00 H new ATOM 1069 N SER A 64 -4.938 -6.251 -24.202 1.00 0.00 N ATOM 1070 CA SER A 64 -3.933 -5.180 -24.259 1.00 0.00 C ATOM 1071 C SER A 64 -4.066 -4.275 -23.026 1.00 0.00 C ATOM 1072 O SER A 64 -5.118 -4.253 -22.370 1.00 0.00 O ATOM 1073 CB SER A 64 -4.101 -4.335 -25.536 1.00 0.00 C ATOM 1074 OG SER A 64 -3.117 -3.312 -25.603 1.00 0.00 O ATOM 0 H SER A 64 -5.883 -5.929 -24.410 1.00 0.00 H new ATOM 0 HA SER A 64 -2.945 -5.640 -24.274 1.00 0.00 H new ATOM 0 HB2 SER A 64 -4.024 -4.977 -26.414 1.00 0.00 H new ATOM 0 HB3 SER A 64 -5.096 -3.889 -25.553 1.00 0.00 H new ATOM 0 HG SER A 64 -3.556 -2.436 -25.613 1.00 0.00 H new ATOM 1080 N SER A 65 -2.993 -3.506 -22.759 1.00 0.00 N ATOM 1081 CA SER A 65 -2.918 -2.559 -21.639 1.00 0.00 C ATOM 1082 C SER A 65 -4.007 -1.471 -21.751 1.00 0.00 C ATOM 1083 O SER A 65 -4.333 -1.010 -22.859 1.00 0.00 O ATOM 1084 CB SER A 65 -1.511 -1.909 -21.595 1.00 0.00 C ATOM 1085 OG SER A 65 -1.222 -1.228 -22.809 1.00 0.00 O ATOM 0 H SER A 65 -2.145 -3.528 -23.325 1.00 0.00 H new ATOM 0 HA SER A 65 -3.091 -3.109 -20.714 1.00 0.00 H new ATOM 0 HB2 SER A 65 -1.456 -1.210 -20.761 1.00 0.00 H new ATOM 0 HB3 SER A 65 -0.758 -2.677 -21.417 1.00 0.00 H new ATOM 0 HG SER A 65 -0.330 -0.826 -22.754 1.00 0.00 H new ATOM 1091 N LEU A 66 -4.545 -1.066 -20.583 1.00 0.00 N ATOM 1092 CA LEU A 66 -5.569 -0.005 -20.467 1.00 0.00 C ATOM 1093 C LEU A 66 -4.967 1.353 -20.933 1.00 0.00 C ATOM 1094 O LEU A 66 -5.696 2.230 -21.367 1.00 0.00 O ATOM 1095 CB LEU A 66 -6.087 0.052 -18.987 1.00 0.00 C ATOM 1096 CG LEU A 66 -7.482 0.743 -18.683 1.00 0.00 C ATOM 1097 CD1 LEU A 66 -7.463 2.266 -18.804 1.00 0.00 C ATOM 1098 CD2 LEU A 66 -8.619 0.163 -19.526 1.00 0.00 C ATOM 0 H LEU A 66 -4.279 -1.469 -19.685 1.00 0.00 H new ATOM 0 HA LEU A 66 -6.421 -0.223 -21.111 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -6.141 -0.972 -18.618 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -5.330 0.565 -18.394 1.00 0.00 H new ATOM 0 HG LEU A 66 -7.671 0.511 -17.635 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -8.454 2.661 -18.581 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -6.741 2.678 -18.099 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -7.181 2.547 -19.819 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -9.551 0.671 -19.279 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -8.397 0.306 -20.584 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -8.720 -0.902 -19.317 1.00 0.00 H new ATOM 1110 N ALA A 67 -3.619 1.473 -20.871 1.00 0.00 N ATOM 1111 CA ALA A 67 -2.861 2.674 -21.319 1.00 0.00 C ATOM 1112 C ALA A 67 -3.213 3.099 -22.768 1.00 0.00 C ATOM 1113 O ALA A 67 -3.270 4.304 -23.070 1.00 0.00 O ATOM 1114 CB ALA A 67 -1.351 2.405 -21.188 1.00 0.00 C ATOM 0 H ALA A 67 -3.019 0.734 -20.506 1.00 0.00 H new ATOM 0 HA ALA A 67 -3.149 3.505 -20.675 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -0.795 3.283 -21.516 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -1.109 2.190 -20.147 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -1.078 1.551 -21.808 1.00 0.00 H new ATOM 1120 N GLU A 68 -3.465 2.104 -23.649 1.00 0.00 N ATOM 1121 CA GLU A 68 -3.882 2.366 -25.045 1.00 0.00 C ATOM 1122 C GLU A 68 -5.302 2.942 -25.096 1.00 0.00 C ATOM 1123 O GLU A 68 -5.598 3.821 -25.914 1.00 0.00 O ATOM 1124 CB GLU A 68 -3.808 1.101 -25.937 1.00 0.00 C ATOM 1125 CG GLU A 68 -2.398 0.495 -26.096 1.00 0.00 C ATOM 1126 CD GLU A 68 -2.238 -0.287 -27.411 1.00 0.00 C ATOM 1127 OE1 GLU A 68 -2.843 -1.368 -27.555 1.00 0.00 O ATOM 1128 OE2 GLU A 68 -1.541 0.197 -28.326 1.00 0.00 O ATOM 0 H GLU A 68 -3.387 1.114 -23.418 1.00 0.00 H new ATOM 0 HA GLU A 68 -3.176 3.097 -25.440 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -4.468 0.341 -25.519 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -4.194 1.349 -26.926 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -1.657 1.293 -26.059 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -2.194 -0.168 -25.255 1.00 0.00 H new ATOM 1135 N PHE A 69 -6.169 2.446 -24.212 1.00 0.00 N ATOM 1136 CA PHE A 69 -7.541 2.945 -24.085 1.00 0.00 C ATOM 1137 C PHE A 69 -7.541 4.408 -23.569 1.00 0.00 C ATOM 1138 O PHE A 69 -8.312 5.240 -24.063 1.00 0.00 O ATOM 1139 CB PHE A 69 -8.355 2.007 -23.158 1.00 0.00 C ATOM 1140 CG PHE A 69 -9.726 2.547 -22.772 1.00 0.00 C ATOM 1141 CD1 PHE A 69 -10.692 2.794 -23.743 1.00 0.00 C ATOM 1142 CD2 PHE A 69 -10.038 2.824 -21.444 1.00 0.00 C ATOM 1143 CE1 PHE A 69 -11.915 3.308 -23.392 1.00 0.00 C ATOM 1144 CE2 PHE A 69 -11.265 3.337 -21.099 1.00 0.00 C ATOM 1145 CZ PHE A 69 -12.203 3.570 -22.071 1.00 0.00 C ATOM 0 H PHE A 69 -5.942 1.690 -23.566 1.00 0.00 H new ATOM 0 HA PHE A 69 -8.018 2.948 -25.065 1.00 0.00 H new ATOM 0 HB2 PHE A 69 -8.482 1.045 -23.654 1.00 0.00 H new ATOM 0 HB3 PHE A 69 -7.780 1.824 -22.250 1.00 0.00 H new ATOM 0 HD1 PHE A 69 -10.478 2.580 -24.780 1.00 0.00 H new ATOM 0 HD2 PHE A 69 -9.305 2.633 -20.674 1.00 0.00 H new ATOM 0 HE1 PHE A 69 -12.654 3.508 -24.154 1.00 0.00 H new ATOM 0 HE2 PHE A 69 -11.490 3.556 -20.066 1.00 0.00 H new ATOM 0 HZ PHE A 69 -13.173 3.961 -21.800 1.00 0.00 H new ATOM 1155 N VAL A 70 -6.642 4.708 -22.607 1.00 0.00 N ATOM 1156 CA VAL A 70 -6.505 6.052 -22.008 1.00 0.00 C ATOM 1157 C VAL A 70 -6.089 7.086 -23.073 1.00 0.00 C ATOM 1158 O VAL A 70 -6.721 8.136 -23.202 1.00 0.00 O ATOM 1159 CB VAL A 70 -5.454 6.071 -20.835 1.00 0.00 C ATOM 1160 CG1 VAL A 70 -5.265 7.482 -20.274 1.00 0.00 C ATOM 1161 CG2 VAL A 70 -5.828 5.102 -19.707 1.00 0.00 C ATOM 0 H VAL A 70 -5.990 4.024 -22.224 1.00 0.00 H new ATOM 0 HA VAL A 70 -7.482 6.314 -21.601 1.00 0.00 H new ATOM 0 HB VAL A 70 -4.509 5.737 -21.264 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -4.533 7.458 -19.467 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -4.911 8.144 -21.065 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -6.216 7.852 -19.891 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -5.074 5.150 -18.921 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -6.799 5.379 -19.296 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -5.877 4.087 -20.101 1.00 0.00 H new ATOM 1171 N GLN A 71 -5.038 6.751 -23.849 1.00 0.00 N ATOM 1172 CA GLN A 71 -4.474 7.661 -24.868 1.00 0.00 C ATOM 1173 C GLN A 71 -5.486 7.897 -26.011 1.00 0.00 C ATOM 1174 O GLN A 71 -5.585 9.006 -26.533 1.00 0.00 O ATOM 1175 CB GLN A 71 -3.111 7.127 -25.403 1.00 0.00 C ATOM 1176 CG GLN A 71 -3.196 5.866 -26.285 1.00 0.00 C ATOM 1177 CD GLN A 71 -1.834 5.322 -26.715 1.00 0.00 C ATOM 1178 OE1 GLN A 71 -1.235 4.508 -26.019 1.00 0.00 O ATOM 1179 NE2 GLN A 71 -1.330 5.775 -27.853 1.00 0.00 N ATOM 0 H GLN A 71 -4.560 5.852 -23.789 1.00 0.00 H new ATOM 0 HA GLN A 71 -4.280 8.625 -24.397 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -2.629 7.919 -25.976 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -2.465 6.912 -24.552 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -3.732 5.089 -25.741 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -3.783 6.095 -27.175 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -1.853 6.452 -28.409 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -0.419 5.447 -28.173 1.00 0.00 H new ATOM 1188 N SER A 72 -6.273 6.852 -26.351 1.00 0.00 N ATOM 1189 CA SER A 72 -7.348 6.952 -27.361 1.00 0.00 C ATOM 1190 C SER A 72 -8.463 7.894 -26.870 1.00 0.00 C ATOM 1191 O SER A 72 -8.927 8.773 -27.604 1.00 0.00 O ATOM 1192 CB SER A 72 -7.933 5.555 -27.664 1.00 0.00 C ATOM 1193 OG SER A 72 -6.953 4.702 -28.233 1.00 0.00 O ATOM 0 H SER A 72 -6.182 5.924 -25.937 1.00 0.00 H new ATOM 0 HA SER A 72 -6.921 7.362 -28.277 1.00 0.00 H new ATOM 0 HB2 SER A 72 -8.316 5.111 -26.745 1.00 0.00 H new ATOM 0 HB3 SER A 72 -8.777 5.651 -28.348 1.00 0.00 H new ATOM 0 HG SER A 72 -6.398 4.321 -27.521 1.00 0.00 H new ATOM 1199 N LEU A 73 -8.840 7.717 -25.594 1.00 0.00 N ATOM 1200 CA LEU A 73 -9.933 8.466 -24.956 1.00 0.00 C ATOM 1201 C LEU A 73 -9.525 9.944 -24.743 1.00 0.00 C ATOM 1202 O LEU A 73 -10.364 10.858 -24.789 1.00 0.00 O ATOM 1203 CB LEU A 73 -10.345 7.783 -23.604 1.00 0.00 C ATOM 1204 CG LEU A 73 -11.874 7.555 -23.371 1.00 0.00 C ATOM 1205 CD1 LEU A 73 -12.157 7.027 -21.945 1.00 0.00 C ATOM 1206 CD2 LEU A 73 -12.685 8.814 -23.668 1.00 0.00 C ATOM 0 H LEU A 73 -8.391 7.045 -24.972 1.00 0.00 H new ATOM 0 HA LEU A 73 -10.801 8.454 -25.615 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -9.844 6.817 -23.544 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -9.963 8.392 -22.785 1.00 0.00 H new ATOM 0 HG LEU A 73 -12.196 6.788 -24.076 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -13.229 6.880 -21.818 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -11.641 6.078 -21.799 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -11.801 7.750 -21.212 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -13.743 8.615 -23.494 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -12.356 9.622 -23.014 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -12.537 9.105 -24.708 1.00 0.00 H new ATOM 1218 N SER A 74 -8.223 10.155 -24.533 1.00 0.00 N ATOM 1219 CA SER A 74 -7.643 11.482 -24.308 1.00 0.00 C ATOM 1220 C SER A 74 -7.672 12.319 -25.590 1.00 0.00 C ATOM 1221 O SER A 74 -7.998 13.510 -25.565 1.00 0.00 O ATOM 1222 CB SER A 74 -6.201 11.322 -23.797 1.00 0.00 C ATOM 1223 OG SER A 74 -5.576 12.569 -23.543 1.00 0.00 O ATOM 0 H SER A 74 -7.535 9.402 -24.514 1.00 0.00 H new ATOM 0 HA SER A 74 -8.237 12.008 -23.560 1.00 0.00 H new ATOM 0 HB2 SER A 74 -6.206 10.728 -22.883 1.00 0.00 H new ATOM 0 HB3 SER A 74 -5.617 10.769 -24.533 1.00 0.00 H new ATOM 0 HG SER A 74 -6.121 13.086 -22.914 1.00 0.00 H new ATOM 1229 N GLN A 75 -7.341 11.664 -26.710 1.00 0.00 N ATOM 1230 CA GLN A 75 -7.291 12.302 -28.031 1.00 0.00 C ATOM 1231 C GLN A 75 -8.705 12.593 -28.577 1.00 0.00 C ATOM 1232 O GLN A 75 -8.902 13.578 -29.295 1.00 0.00 O ATOM 1233 CB GLN A 75 -6.497 11.412 -29.020 1.00 0.00 C ATOM 1234 CG GLN A 75 -5.005 11.238 -28.681 1.00 0.00 C ATOM 1235 CD GLN A 75 -4.226 12.552 -28.674 1.00 0.00 C ATOM 1236 OE1 GLN A 75 -3.691 12.976 -29.698 1.00 0.00 O ATOM 1237 NE2 GLN A 75 -4.165 13.211 -27.527 1.00 0.00 N ATOM 0 H GLN A 75 -7.100 10.673 -26.725 1.00 0.00 H new ATOM 0 HA GLN A 75 -6.780 13.259 -27.924 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -6.964 10.428 -29.055 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -6.580 11.840 -30.019 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -4.915 10.766 -27.703 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -4.552 10.560 -29.405 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -4.619 12.832 -26.696 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -3.664 14.098 -27.474 1.00 0.00 H new ATOM 1246 N THR A 76 -9.691 11.738 -28.229 1.00 0.00 N ATOM 1247 CA THR A 76 -11.057 11.862 -28.776 1.00 0.00 C ATOM 1248 C THR A 76 -11.894 12.932 -28.029 1.00 0.00 C ATOM 1249 O THR A 76 -12.569 13.738 -28.673 1.00 0.00 O ATOM 1250 CB THR A 76 -11.813 10.485 -28.817 1.00 0.00 C ATOM 1251 OG1 THR A 76 -13.044 10.617 -29.552 1.00 0.00 O ATOM 1252 CG2 THR A 76 -12.121 9.922 -27.433 1.00 0.00 C ATOM 0 H THR A 76 -9.567 10.962 -27.578 1.00 0.00 H new ATOM 0 HA THR A 76 -10.937 12.199 -29.806 1.00 0.00 H new ATOM 0 HB THR A 76 -11.140 9.785 -29.311 1.00 0.00 H new ATOM 0 HG1 THR A 76 -13.507 9.753 -29.573 1.00 0.00 H new ATOM 0 HG21 THR A 76 -12.643 8.971 -27.535 1.00 0.00 H new ATOM 0 HG22 THR A 76 -11.190 9.768 -26.887 1.00 0.00 H new ATOM 0 HG23 THR A 76 -12.750 10.624 -26.886 1.00 0.00 H new ATOM 1260 N MET A 77 -11.836 12.963 -26.677 1.00 0.00 N ATOM 1261 CA MET A 77 -12.698 13.869 -25.864 1.00 0.00 C ATOM 1262 C MET A 77 -11.930 15.095 -25.359 1.00 0.00 C ATOM 1263 O MET A 77 -12.550 16.071 -24.928 1.00 0.00 O ATOM 1264 CB MET A 77 -13.350 13.114 -24.667 1.00 0.00 C ATOM 1265 CG MET A 77 -14.194 11.900 -25.068 1.00 0.00 C ATOM 1266 SD MET A 77 -15.350 11.396 -23.779 1.00 0.00 S ATOM 1267 CE MET A 77 -16.041 9.894 -24.468 1.00 0.00 C ATOM 0 H MET A 77 -11.209 12.378 -26.125 1.00 0.00 H new ATOM 0 HA MET A 77 -13.490 14.219 -26.526 1.00 0.00 H new ATOM 0 HB2 MET A 77 -12.563 12.786 -23.988 1.00 0.00 H new ATOM 0 HB3 MET A 77 -13.979 13.811 -24.113 1.00 0.00 H new ATOM 0 HG2 MET A 77 -14.749 12.133 -25.977 1.00 0.00 H new ATOM 0 HG3 MET A 77 -13.533 11.066 -25.304 1.00 0.00 H new ATOM 0 HE1 MET A 77 -16.481 9.297 -23.670 1.00 0.00 H new ATOM 0 HE2 MET A 77 -16.810 10.148 -25.197 1.00 0.00 H new ATOM 0 HE3 MET A 77 -15.253 9.322 -24.957 1.00 0.00 H new ATOM 1277 N GLY A 78 -10.590 15.042 -25.411 1.00 0.00 N ATOM 1278 CA GLY A 78 -9.752 16.150 -24.931 1.00 0.00 C ATOM 1279 C GLY A 78 -9.560 16.153 -23.413 1.00 0.00 C ATOM 1280 O GLY A 78 -9.202 17.181 -22.826 1.00 0.00 O ATOM 0 H GLY A 78 -10.066 14.248 -25.779 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -8.776 16.093 -25.413 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -10.203 17.095 -25.235 1.00 0.00 H new ATOM 1284 N PHE A 79 -9.832 15.007 -22.776 1.00 0.00 N ATOM 1285 CA PHE A 79 -9.573 14.790 -21.337 1.00 0.00 C ATOM 1286 C PHE A 79 -8.110 14.341 -21.187 1.00 0.00 C ATOM 1287 O PHE A 79 -7.753 13.330 -21.780 1.00 0.00 O ATOM 1288 CB PHE A 79 -10.557 13.719 -20.763 1.00 0.00 C ATOM 1289 CG PHE A 79 -11.992 14.210 -20.531 1.00 0.00 C ATOM 1290 CD1 PHE A 79 -12.637 15.045 -21.442 1.00 0.00 C ATOM 1291 CD2 PHE A 79 -12.690 13.842 -19.379 1.00 0.00 C ATOM 1292 CE1 PHE A 79 -13.923 15.491 -21.214 1.00 0.00 C ATOM 1293 CE2 PHE A 79 -13.977 14.291 -19.154 1.00 0.00 C ATOM 1294 CZ PHE A 79 -14.588 15.116 -20.064 1.00 0.00 C ATOM 0 H PHE A 79 -10.240 14.197 -23.242 1.00 0.00 H new ATOM 0 HA PHE A 79 -9.736 15.709 -20.774 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -10.586 12.871 -21.448 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -10.158 13.352 -19.817 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -12.122 15.348 -22.341 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -12.217 13.197 -18.653 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -14.408 16.133 -21.934 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -14.503 13.992 -18.260 1.00 0.00 H new ATOM 0 HZ PHE A 79 -15.591 15.473 -19.880 1.00 0.00 H new ATOM 1304 N PRO A 80 -7.250 15.068 -20.393 1.00 0.00 N ATOM 1305 CA PRO A 80 -5.800 14.747 -20.262 1.00 0.00 C ATOM 1306 C PRO A 80 -5.581 13.297 -19.787 1.00 0.00 C ATOM 1307 O PRO A 80 -6.153 12.897 -18.767 1.00 0.00 O ATOM 1308 CB PRO A 80 -5.278 15.784 -19.225 1.00 0.00 C ATOM 1309 CG PRO A 80 -6.507 16.269 -18.513 1.00 0.00 C ATOM 1310 CD PRO A 80 -7.615 16.232 -19.541 1.00 0.00 C ATOM 0 HA PRO A 80 -5.269 14.810 -21.212 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -4.573 15.328 -18.530 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -4.756 16.605 -19.716 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -6.743 15.632 -17.660 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -6.364 17.278 -18.127 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -8.592 16.100 -19.076 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -7.659 17.155 -20.118 1.00 0.00 H new ATOM 1318 N GLN A 81 -4.770 12.532 -20.558 1.00 0.00 N ATOM 1319 CA GLN A 81 -4.564 11.084 -20.343 1.00 0.00 C ATOM 1320 C GLN A 81 -4.115 10.772 -18.902 1.00 0.00 C ATOM 1321 O GLN A 81 -4.655 9.871 -18.262 1.00 0.00 O ATOM 1322 CB GLN A 81 -3.566 10.483 -21.383 1.00 0.00 C ATOM 1323 CG GLN A 81 -2.211 11.211 -21.521 1.00 0.00 C ATOM 1324 CD GLN A 81 -1.194 10.503 -22.429 1.00 0.00 C ATOM 1325 OE1 GLN A 81 0.015 10.602 -22.221 1.00 0.00 O ATOM 1326 NE2 GLN A 81 -1.665 9.796 -23.451 1.00 0.00 N ATOM 0 H GLN A 81 -4.241 12.905 -21.346 1.00 0.00 H new ATOM 0 HA GLN A 81 -5.531 10.604 -20.494 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -3.372 9.445 -21.113 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -4.051 10.473 -22.359 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -2.390 12.213 -21.910 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -1.774 11.328 -20.529 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -2.671 9.728 -23.604 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -1.020 9.321 -24.083 1.00 0.00 H new ATOM 1335 N ASP A 82 -3.191 11.588 -18.384 1.00 0.00 N ATOM 1336 CA ASP A 82 -2.598 11.412 -17.045 1.00 0.00 C ATOM 1337 C ASP A 82 -3.643 11.592 -15.920 1.00 0.00 C ATOM 1338 O ASP A 82 -3.451 11.091 -14.805 1.00 0.00 O ATOM 1339 CB ASP A 82 -1.424 12.406 -16.867 1.00 0.00 C ATOM 1340 CG ASP A 82 -0.359 12.265 -17.974 1.00 0.00 C ATOM 1341 OD1 ASP A 82 -0.528 12.880 -19.051 1.00 0.00 O ATOM 1342 OD2 ASP A 82 0.629 11.516 -17.787 1.00 0.00 O ATOM 0 H ASP A 82 -2.827 12.399 -18.884 1.00 0.00 H new ATOM 0 HA ASP A 82 -2.226 10.390 -16.969 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -1.811 13.425 -16.867 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -0.958 12.243 -15.895 1.00 0.00 H new ATOM 1347 N GLN A 83 -4.755 12.300 -16.226 1.00 0.00 N ATOM 1348 CA GLN A 83 -5.825 12.598 -15.251 1.00 0.00 C ATOM 1349 C GLN A 83 -7.154 11.880 -15.629 1.00 0.00 C ATOM 1350 O GLN A 83 -8.183 12.120 -14.997 1.00 0.00 O ATOM 1351 CB GLN A 83 -6.014 14.146 -15.144 1.00 0.00 C ATOM 1352 CG GLN A 83 -6.779 14.626 -13.880 1.00 0.00 C ATOM 1353 CD GLN A 83 -7.070 16.131 -13.838 1.00 0.00 C ATOM 1354 OE1 GLN A 83 -7.357 16.729 -14.988 1.00 0.00 O flip ATOM 1355 NE2 GLN A 83 -7.072 16.749 -12.772 1.00 0.00 N flip ATOM 0 H GLN A 83 -4.934 12.680 -17.156 1.00 0.00 H new ATOM 0 HA GLN A 83 -5.532 12.214 -14.274 1.00 0.00 H new ATOM 0 HB2 GLN A 83 -5.032 14.619 -15.158 1.00 0.00 H new ATOM 0 HB3 GLN A 83 -6.548 14.494 -16.028 1.00 0.00 H new ATOM 0 HG2 GLN A 83 -7.723 14.086 -13.817 1.00 0.00 H new ATOM 0 HG3 GLN A 83 -6.199 14.358 -12.997 1.00 0.00 H new ATOM 0 HE21 GLN A 83 -6.848 16.266 -11.902 1.00 0.00 H new ATOM 0 HE22 GLN A 83 -7.298 17.744 -12.760 1.00 0.00 H new ATOM 1364 N ILE A 84 -7.134 10.988 -16.660 1.00 0.00 N ATOM 1365 CA ILE A 84 -8.321 10.171 -17.001 1.00 0.00 C ATOM 1366 C ILE A 84 -8.597 9.172 -15.863 1.00 0.00 C ATOM 1367 O ILE A 84 -7.818 8.242 -15.625 1.00 0.00 O ATOM 1368 CB ILE A 84 -8.208 9.414 -18.393 1.00 0.00 C ATOM 1369 CG1 ILE A 84 -8.215 10.441 -19.577 1.00 0.00 C ATOM 1370 CG2 ILE A 84 -9.329 8.352 -18.570 1.00 0.00 C ATOM 1371 CD1 ILE A 84 -8.425 9.851 -20.970 1.00 0.00 C ATOM 0 H ILE A 84 -6.322 10.823 -17.255 1.00 0.00 H new ATOM 0 HA ILE A 84 -9.156 10.862 -17.113 1.00 0.00 H new ATOM 0 HB ILE A 84 -7.258 8.879 -18.401 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -9.000 11.174 -19.392 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -7.268 10.980 -19.571 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -9.214 7.859 -19.535 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -9.258 7.612 -17.773 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -10.303 8.840 -18.526 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -8.412 10.651 -21.710 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -7.627 9.141 -21.189 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -9.386 9.339 -21.007 1.00 0.00 H new ATOM 1383 N ARG A 85 -9.670 9.453 -15.115 1.00 0.00 N ATOM 1384 CA ARG A 85 -10.211 8.569 -14.079 1.00 0.00 C ATOM 1385 C ARG A 85 -11.446 7.862 -14.647 1.00 0.00 C ATOM 1386 O ARG A 85 -12.193 8.434 -15.449 1.00 0.00 O ATOM 1387 CB ARG A 85 -10.574 9.379 -12.806 1.00 0.00 C ATOM 1388 CG ARG A 85 -9.362 9.981 -12.068 1.00 0.00 C ATOM 1389 CD ARG A 85 -9.777 10.908 -10.912 1.00 0.00 C ATOM 1390 NE ARG A 85 -8.609 11.376 -10.137 1.00 0.00 N ATOM 1391 CZ ARG A 85 -8.233 12.654 -9.971 1.00 0.00 C ATOM 1392 NH1 ARG A 85 -8.823 13.637 -10.640 1.00 0.00 N ATOM 1393 NH2 ARG A 85 -7.230 12.932 -9.158 1.00 0.00 N ATOM 0 H ARG A 85 -10.197 10.320 -15.216 1.00 0.00 H new ATOM 0 HA ARG A 85 -9.464 7.829 -13.792 1.00 0.00 H new ATOM 0 HB2 ARG A 85 -11.252 10.186 -13.084 1.00 0.00 H new ATOM 0 HB3 ARG A 85 -11.116 8.729 -12.119 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -8.741 9.175 -11.678 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -8.750 10.540 -12.776 1.00 0.00 H new ATOM 0 HD2 ARG A 85 -10.316 11.767 -11.311 1.00 0.00 H new ATOM 0 HD3 ARG A 85 -10.464 10.379 -10.251 1.00 0.00 H new ATOM 0 HE ARG A 85 -8.036 10.662 -9.687 1.00 0.00 H new ATOM 0 HH11 ARG A 85 -9.577 13.428 -11.294 1.00 0.00 H new ATOM 0 HH12 ARG A 85 -8.523 14.602 -10.500 1.00 0.00 H new ATOM 0 HH21 ARG A 85 -6.750 12.179 -8.664 1.00 0.00 H new ATOM 0 HH22 ARG A 85 -6.935 13.899 -9.024 1.00 0.00 H new ATOM 1407 N LEU A 86 -11.648 6.615 -14.232 1.00 0.00 N ATOM 1408 CA LEU A 86 -12.702 5.745 -14.764 1.00 0.00 C ATOM 1409 C LEU A 86 -13.529 5.176 -13.610 1.00 0.00 C ATOM 1410 O LEU A 86 -12.965 4.724 -12.623 1.00 0.00 O ATOM 1411 CB LEU A 86 -12.041 4.603 -15.574 1.00 0.00 C ATOM 1412 CG LEU A 86 -11.243 5.018 -16.850 1.00 0.00 C ATOM 1413 CD1 LEU A 86 -10.555 3.793 -17.484 1.00 0.00 C ATOM 1414 CD2 LEU A 86 -12.150 5.751 -17.870 1.00 0.00 C ATOM 0 H LEU A 86 -11.081 6.172 -13.509 1.00 0.00 H new ATOM 0 HA LEU A 86 -13.366 6.312 -15.416 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -11.365 4.063 -14.911 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -12.821 3.903 -15.873 1.00 0.00 H new ATOM 0 HG LEU A 86 -10.466 5.720 -16.548 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -10.004 4.104 -18.372 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -9.865 3.351 -16.765 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -11.309 3.057 -17.764 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -11.563 6.026 -18.747 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -12.965 5.093 -18.171 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -12.560 6.651 -17.411 1.00 0.00 H new ATOM 1426 N TRP A 87 -14.858 5.215 -13.728 1.00 0.00 N ATOM 1427 CA TRP A 87 -15.781 4.653 -12.722 1.00 0.00 C ATOM 1428 C TRP A 87 -16.564 3.482 -13.347 1.00 0.00 C ATOM 1429 O TRP A 87 -17.379 3.713 -14.243 1.00 0.00 O ATOM 1430 CB TRP A 87 -16.750 5.753 -12.200 1.00 0.00 C ATOM 1431 CG TRP A 87 -16.082 6.802 -11.337 1.00 0.00 C ATOM 1432 CD1 TRP A 87 -15.238 7.804 -11.743 1.00 0.00 C ATOM 1433 CD2 TRP A 87 -16.221 6.948 -9.918 1.00 0.00 C ATOM 1434 NE1 TRP A 87 -14.832 8.542 -10.662 1.00 0.00 N ATOM 1435 CE2 TRP A 87 -15.423 8.037 -9.531 1.00 0.00 C ATOM 1436 CE3 TRP A 87 -16.941 6.254 -8.935 1.00 0.00 C ATOM 1437 CZ2 TRP A 87 -15.324 8.450 -8.204 1.00 0.00 C ATOM 1438 CZ3 TRP A 87 -16.844 6.670 -7.620 1.00 0.00 C ATOM 1439 CH2 TRP A 87 -16.036 7.757 -7.264 1.00 0.00 C ATOM 0 H TRP A 87 -15.333 5.638 -14.525 1.00 0.00 H new ATOM 0 HA TRP A 87 -15.209 4.282 -11.872 1.00 0.00 H new ATOM 0 HB2 TRP A 87 -17.219 6.244 -13.053 1.00 0.00 H new ATOM 0 HB3 TRP A 87 -17.547 5.279 -11.627 1.00 0.00 H new ATOM 0 HD1 TRP A 87 -14.938 7.985 -12.764 1.00 0.00 H new ATOM 0 HE1 TRP A 87 -14.194 9.337 -10.693 1.00 0.00 H new ATOM 0 HE3 TRP A 87 -17.560 5.410 -9.200 1.00 0.00 H new ATOM 0 HZ2 TRP A 87 -14.705 9.290 -7.927 1.00 0.00 H new ATOM 0 HZ3 TRP A 87 -17.400 6.148 -6.855 1.00 0.00 H new ATOM 0 HH2 TRP A 87 -15.974 8.054 -6.227 1.00 0.00 H new ATOM 1450 N PRO A 88 -16.327 2.203 -12.904 1.00 0.00 N ATOM 1451 CA PRO A 88 -17.060 1.027 -13.437 1.00 0.00 C ATOM 1452 C PRO A 88 -18.517 1.050 -12.939 1.00 0.00 C ATOM 1453 O PRO A 88 -18.730 1.197 -11.734 1.00 0.00 O ATOM 1454 CB PRO A 88 -16.260 -0.178 -12.875 1.00 0.00 C ATOM 1455 CG PRO A 88 -15.659 0.333 -11.595 1.00 0.00 C ATOM 1456 CD PRO A 88 -15.371 1.807 -11.827 1.00 0.00 C ATOM 0 HA PRO A 88 -17.126 0.995 -14.525 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -16.908 -1.035 -12.694 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -15.489 -0.503 -13.574 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -16.346 0.196 -10.760 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -14.746 -0.209 -11.349 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -15.529 2.391 -10.920 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -14.337 1.967 -12.134 1.00 0.00 H new ATOM 1464 N MET A 89 -19.475 0.893 -13.883 1.00 0.00 N ATOM 1465 CA MET A 89 -20.941 1.112 -13.686 1.00 0.00 C ATOM 1466 C MET A 89 -21.455 0.698 -12.277 1.00 0.00 C ATOM 1467 O MET A 89 -21.105 -0.376 -11.757 1.00 0.00 O ATOM 1468 CB MET A 89 -21.742 0.347 -14.791 1.00 0.00 C ATOM 1469 CG MET A 89 -21.914 -1.172 -14.539 1.00 0.00 C ATOM 1470 SD MET A 89 -22.203 -2.130 -16.030 1.00 0.00 S ATOM 1471 CE MET A 89 -20.564 -2.066 -16.726 1.00 0.00 C ATOM 0 H MET A 89 -19.250 0.602 -14.834 1.00 0.00 H new ATOM 0 HA MET A 89 -21.106 2.186 -13.767 1.00 0.00 H new ATOM 0 HB2 MET A 89 -22.729 0.799 -14.882 1.00 0.00 H new ATOM 0 HB3 MET A 89 -21.238 0.487 -15.747 1.00 0.00 H new ATOM 0 HG2 MET A 89 -21.021 -1.551 -14.043 1.00 0.00 H new ATOM 0 HG3 MET A 89 -22.748 -1.324 -13.854 1.00 0.00 H new ATOM 0 HE1 MET A 89 -20.515 -2.715 -17.601 1.00 0.00 H new ATOM 0 HE2 MET A 89 -20.333 -1.042 -17.020 1.00 0.00 H new ATOM 0 HE3 MET A 89 -19.840 -2.402 -15.984 1.00 0.00 H new ATOM 1481 N GLN A 90 -22.254 1.580 -11.652 1.00 0.00 N ATOM 1482 CA GLN A 90 -22.862 1.303 -10.346 1.00 0.00 C ATOM 1483 C GLN A 90 -24.203 2.060 -10.224 1.00 0.00 C ATOM 1484 O GLN A 90 -24.262 3.273 -10.431 1.00 0.00 O ATOM 1485 CB GLN A 90 -21.882 1.642 -9.161 1.00 0.00 C ATOM 1486 CG GLN A 90 -21.621 3.144 -8.873 1.00 0.00 C ATOM 1487 CD GLN A 90 -20.803 3.926 -9.914 1.00 0.00 C ATOM 1488 OE1 GLN A 90 -21.034 5.116 -10.128 1.00 0.00 O ATOM 1489 NE2 GLN A 90 -19.820 3.295 -10.529 1.00 0.00 N ATOM 0 H GLN A 90 -22.493 2.494 -12.036 1.00 0.00 H new ATOM 0 HA GLN A 90 -23.064 0.234 -10.276 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -22.277 1.186 -8.253 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -20.924 1.165 -9.366 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -22.585 3.639 -8.760 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -21.109 3.220 -7.914 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -19.647 2.308 -10.336 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -19.233 3.794 -11.198 1.00 0.00 H new ATOM 1498 N ALA A 91 -25.284 1.320 -9.909 1.00 0.00 N ATOM 1499 CA ALA A 91 -26.639 1.887 -9.737 1.00 0.00 C ATOM 1500 C ALA A 91 -26.778 2.617 -8.376 1.00 0.00 C ATOM 1501 O ALA A 91 -27.792 3.277 -8.123 1.00 0.00 O ATOM 1502 CB ALA A 91 -27.685 0.775 -9.883 1.00 0.00 C ATOM 0 H ALA A 91 -25.244 0.311 -9.766 1.00 0.00 H new ATOM 0 HA ALA A 91 -26.808 2.632 -10.515 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -28.683 1.195 -9.756 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -27.604 0.327 -10.873 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -27.513 0.012 -9.124 1.00 0.00 H new ATOM 1508 N ARG A 92 -25.757 2.441 -7.494 1.00 0.00 N ATOM 1509 CA ARG A 92 -25.570 3.221 -6.238 1.00 0.00 C ATOM 1510 C ARG A 92 -26.679 2.977 -5.192 1.00 0.00 C ATOM 1511 O ARG A 92 -26.750 3.695 -4.193 1.00 0.00 O ATOM 1512 CB ARG A 92 -25.427 4.744 -6.549 1.00 0.00 C ATOM 1513 CG ARG A 92 -24.223 5.090 -7.447 1.00 0.00 C ATOM 1514 CD ARG A 92 -24.103 6.591 -7.762 1.00 0.00 C ATOM 1515 NE ARG A 92 -22.953 6.880 -8.641 1.00 0.00 N ATOM 1516 CZ ARG A 92 -22.488 8.104 -8.940 1.00 0.00 C ATOM 1517 NH1 ARG A 92 -23.058 9.201 -8.433 1.00 0.00 N ATOM 1518 NH2 ARG A 92 -21.447 8.215 -9.756 1.00 0.00 N ATOM 0 H ARG A 92 -25.028 1.742 -7.638 1.00 0.00 H new ATOM 0 HA ARG A 92 -24.645 2.859 -5.790 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -26.340 5.093 -7.032 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -25.335 5.289 -5.610 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -23.308 4.755 -6.959 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -24.306 4.536 -8.382 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -25.020 6.936 -8.239 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -23.998 7.150 -6.832 1.00 0.00 H new ATOM 0 HE ARG A 92 -22.471 6.083 -9.056 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -23.860 9.117 -7.808 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -22.691 10.123 -8.671 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -21.013 7.378 -10.146 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -21.081 9.137 -9.994 1.00 0.00 H new ATOM 1532 N SER A 93 -27.506 1.939 -5.387 1.00 0.00 N ATOM 1533 CA SER A 93 -28.633 1.642 -4.484 1.00 0.00 C ATOM 1534 C SER A 93 -28.185 0.673 -3.368 1.00 0.00 C ATOM 1535 O SER A 93 -28.898 -0.272 -3.010 1.00 0.00 O ATOM 1536 CB SER A 93 -29.781 1.059 -5.337 1.00 0.00 C ATOM 1537 OG SER A 93 -30.109 1.932 -6.413 1.00 0.00 O ATOM 0 H SER A 93 -27.416 1.287 -6.166 1.00 0.00 H new ATOM 0 HA SER A 93 -28.983 2.546 -3.986 1.00 0.00 H new ATOM 0 HB2 SER A 93 -29.489 0.085 -5.730 1.00 0.00 H new ATOM 0 HB3 SER A 93 -30.660 0.900 -4.712 1.00 0.00 H new ATOM 0 HG SER A 93 -30.837 1.542 -6.941 1.00 0.00 H new ATOM 1543 N ASN A 94 -27.012 0.972 -2.780 1.00 0.00 N ATOM 1544 CA ASN A 94 -26.394 0.159 -1.718 1.00 0.00 C ATOM 1545 C ASN A 94 -25.571 1.073 -0.795 1.00 0.00 C ATOM 1546 O ASN A 94 -24.729 1.839 -1.277 1.00 0.00 O ATOM 1547 CB ASN A 94 -25.455 -0.939 -2.298 1.00 0.00 C ATOM 1548 CG ASN A 94 -26.145 -1.949 -3.218 1.00 0.00 C ATOM 1549 OD1 ASN A 94 -26.697 -2.947 -2.759 1.00 0.00 O ATOM 1550 ND2 ASN A 94 -26.105 -1.707 -4.523 1.00 0.00 N ATOM 0 H ASN A 94 -26.462 1.793 -3.032 1.00 0.00 H new ATOM 0 HA ASN A 94 -27.196 -0.333 -1.168 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -24.650 -0.455 -2.851 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -24.994 -1.478 -1.470 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -26.540 -2.358 -5.176 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -25.639 -0.870 -4.872 1.00 0.00 H new ATOM 1557 N GLY A 95 -25.828 0.991 0.520 1.00 0.00 N ATOM 1558 CA GLY A 95 -25.032 1.713 1.520 1.00 0.00 C ATOM 1559 C GLY A 95 -23.697 1.023 1.802 1.00 0.00 C ATOM 1560 O GLY A 95 -22.684 1.689 2.052 1.00 0.00 O ATOM 0 H GLY A 95 -26.583 0.430 0.914 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -24.848 2.729 1.171 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -25.601 1.793 2.446 1.00 0.00 H new ATOM 1564 N THR A 96 -23.710 -0.326 1.760 1.00 0.00 N ATOM 1565 CA THR A 96 -22.512 -1.159 1.973 1.00 0.00 C ATOM 1566 C THR A 96 -21.525 -1.007 0.796 1.00 0.00 C ATOM 1567 O THR A 96 -20.325 -0.765 1.009 1.00 0.00 O ATOM 1568 CB THR A 96 -22.905 -2.661 2.154 1.00 0.00 C ATOM 1569 OG1 THR A 96 -23.834 -2.798 3.241 1.00 0.00 O ATOM 1570 CG2 THR A 96 -21.687 -3.567 2.414 1.00 0.00 C ATOM 0 H THR A 96 -24.555 -0.868 1.577 1.00 0.00 H new ATOM 0 HA THR A 96 -22.023 -0.816 2.885 1.00 0.00 H new ATOM 0 HB THR A 96 -23.362 -2.982 1.218 1.00 0.00 H new ATOM 0 HG1 THR A 96 -24.077 -3.742 3.347 1.00 0.00 H new ATOM 0 HG21 THR A 96 -22.019 -4.598 2.532 1.00 0.00 H new ATOM 0 HG22 THR A 96 -20.998 -3.502 1.572 1.00 0.00 H new ATOM 0 HG23 THR A 96 -21.180 -3.243 3.323 1.00 0.00 H new ATOM 1578 N LYS A 97 -22.044 -1.149 -0.445 1.00 0.00 N ATOM 1579 CA LYS A 97 -21.235 -0.985 -1.663 1.00 0.00 C ATOM 1580 C LYS A 97 -20.821 0.485 -1.815 1.00 0.00 C ATOM 1581 O LYS A 97 -21.630 1.340 -2.199 1.00 0.00 O ATOM 1582 CB LYS A 97 -21.995 -1.454 -2.931 1.00 0.00 C ATOM 1583 CG LYS A 97 -21.170 -1.347 -4.236 1.00 0.00 C ATOM 1584 CD LYS A 97 -21.994 -1.666 -5.500 1.00 0.00 C ATOM 1585 CE LYS A 97 -21.124 -1.743 -6.767 1.00 0.00 C ATOM 1586 NZ LYS A 97 -21.897 -2.203 -7.949 1.00 0.00 N ATOM 0 H LYS A 97 -23.022 -1.377 -0.624 1.00 0.00 H new ATOM 0 HA LYS A 97 -20.349 -1.611 -1.561 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -22.305 -2.490 -2.794 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -22.903 -0.861 -3.038 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -20.763 -0.339 -4.320 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -20.322 -2.030 -4.180 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -22.513 -2.614 -5.362 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -22.758 -0.901 -5.634 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -20.697 -0.761 -6.973 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -20.290 -2.423 -6.593 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -21.272 -2.240 -8.779 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -22.283 -3.151 -7.764 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -22.678 -1.541 -8.132 1.00 0.00 H new ATOM 1600 N ARG A 98 -19.569 0.763 -1.452 1.00 0.00 N ATOM 1601 CA ARG A 98 -18.948 2.069 -1.634 1.00 0.00 C ATOM 1602 C ARG A 98 -18.239 2.083 -3.005 1.00 0.00 C ATOM 1603 O ARG A 98 -17.286 1.315 -3.198 1.00 0.00 O ATOM 1604 CB ARG A 98 -17.945 2.324 -0.478 1.00 0.00 C ATOM 1605 CG ARG A 98 -17.277 3.714 -0.502 1.00 0.00 C ATOM 1606 CD ARG A 98 -16.243 3.896 0.624 1.00 0.00 C ATOM 1607 NE ARG A 98 -16.824 3.732 1.971 1.00 0.00 N ATOM 1608 CZ ARG A 98 -16.115 3.614 3.108 1.00 0.00 C ATOM 1609 NH1 ARG A 98 -14.783 3.614 3.088 1.00 0.00 N ATOM 1610 NH2 ARG A 98 -16.753 3.493 4.262 1.00 0.00 N ATOM 0 H ARG A 98 -18.952 0.077 -1.018 1.00 0.00 H new ATOM 0 HA ARG A 98 -19.695 2.863 -1.614 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -18.467 2.202 0.471 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -17.167 1.561 -0.514 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -16.789 3.861 -1.465 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -18.044 4.483 -0.413 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -15.438 3.173 0.491 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -15.798 4.888 0.544 1.00 0.00 H new ATOM 0 HE ARG A 98 -17.841 3.706 2.045 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -14.286 3.704 2.202 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -14.260 3.524 3.959 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -17.773 3.490 4.283 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -16.225 3.403 5.130 1.00 0.00 H new ATOM 1624 N PRO A 99 -18.710 2.918 -3.994 1.00 0.00 N ATOM 1625 CA PRO A 99 -18.078 2.996 -5.328 1.00 0.00 C ATOM 1626 C PRO A 99 -16.686 3.639 -5.259 1.00 0.00 C ATOM 1627 O PRO A 99 -16.366 4.357 -4.303 1.00 0.00 O ATOM 1628 CB PRO A 99 -19.055 3.870 -6.172 1.00 0.00 C ATOM 1629 CG PRO A 99 -20.289 4.025 -5.328 1.00 0.00 C ATOM 1630 CD PRO A 99 -19.852 3.854 -3.893 1.00 0.00 C ATOM 0 HA PRO A 99 -17.921 2.008 -5.761 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -18.614 4.840 -6.403 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -19.288 3.391 -7.123 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -20.743 5.004 -5.481 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -21.039 3.281 -5.596 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -19.556 4.803 -3.447 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -20.652 3.447 -3.275 1.00 0.00 H new ATOM 1638 N ALA A 100 -15.866 3.361 -6.271 1.00 0.00 N ATOM 1639 CA ALA A 100 -14.538 3.967 -6.419 1.00 0.00 C ATOM 1640 C ALA A 100 -14.155 4.024 -7.900 1.00 0.00 C ATOM 1641 O ALA A 100 -14.722 3.296 -8.728 1.00 0.00 O ATOM 1642 CB ALA A 100 -13.487 3.189 -5.601 1.00 0.00 C ATOM 0 H ALA A 100 -16.103 2.706 -7.017 1.00 0.00 H new ATOM 0 HA ALA A 100 -14.569 4.985 -6.030 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -12.510 3.656 -5.726 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -13.764 3.202 -4.547 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -13.443 2.158 -5.952 1.00 0.00 H new ATOM 1648 N MET A 101 -13.208 4.911 -8.227 1.00 0.00 N ATOM 1649 CA MET A 101 -12.578 4.955 -9.555 1.00 0.00 C ATOM 1650 C MET A 101 -11.482 3.872 -9.615 1.00 0.00 C ATOM 1651 O MET A 101 -11.119 3.300 -8.576 1.00 0.00 O ATOM 1652 CB MET A 101 -11.983 6.372 -9.844 1.00 0.00 C ATOM 1653 CG MET A 101 -10.674 6.717 -9.098 1.00 0.00 C ATOM 1654 SD MET A 101 -10.818 6.685 -7.291 1.00 0.00 S ATOM 1655 CE MET A 101 -11.828 8.130 -6.966 1.00 0.00 C ATOM 0 H MET A 101 -12.856 5.618 -7.581 1.00 0.00 H new ATOM 0 HA MET A 101 -13.327 4.759 -10.322 1.00 0.00 H new ATOM 0 HB2 MET A 101 -11.802 6.458 -10.915 1.00 0.00 H new ATOM 0 HB3 MET A 101 -12.733 7.120 -9.587 1.00 0.00 H new ATOM 0 HG2 MET A 101 -9.899 6.013 -9.402 1.00 0.00 H new ATOM 0 HG3 MET A 101 -10.343 7.708 -9.407 1.00 0.00 H new ATOM 0 HE1 MET A 101 -11.435 8.661 -6.099 1.00 0.00 H new ATOM 0 HE2 MET A 101 -11.811 8.789 -7.834 1.00 0.00 H new ATOM 0 HE3 MET A 101 -12.854 7.820 -6.767 1.00 0.00 H new ATOM 1665 N LEU A 102 -10.978 3.565 -10.819 1.00 0.00 N ATOM 1666 CA LEU A 102 -9.797 2.701 -10.966 1.00 0.00 C ATOM 1667 C LEU A 102 -8.539 3.522 -10.658 1.00 0.00 C ATOM 1668 O LEU A 102 -8.483 4.720 -10.974 1.00 0.00 O ATOM 1669 CB LEU A 102 -9.712 2.053 -12.385 1.00 0.00 C ATOM 1670 CG LEU A 102 -10.834 1.023 -12.768 1.00 0.00 C ATOM 1671 CD1 LEU A 102 -11.155 0.070 -11.604 1.00 0.00 C ATOM 1672 CD2 LEU A 102 -12.094 1.708 -13.306 1.00 0.00 C ATOM 0 H LEU A 102 -11.367 3.900 -11.701 1.00 0.00 H new ATOM 0 HA LEU A 102 -9.881 1.876 -10.258 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -9.721 2.854 -13.124 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -8.748 1.551 -12.471 1.00 0.00 H new ATOM 0 HG LEU A 102 -10.437 0.417 -13.582 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -11.936 -0.627 -11.909 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -10.258 -0.486 -11.331 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -11.499 0.647 -10.746 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -12.840 0.953 -13.556 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -12.497 2.378 -12.546 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -11.844 2.281 -14.199 1.00 0.00 H new ATOM 1684 N ASP A 103 -7.564 2.880 -9.997 1.00 0.00 N ATOM 1685 CA ASP A 103 -6.301 3.522 -9.603 1.00 0.00 C ATOM 1686 C ASP A 103 -5.456 3.760 -10.856 1.00 0.00 C ATOM 1687 O ASP A 103 -5.335 2.855 -11.675 1.00 0.00 O ATOM 1688 CB ASP A 103 -5.531 2.633 -8.598 1.00 0.00 C ATOM 1689 CG ASP A 103 -4.458 3.420 -7.835 1.00 0.00 C ATOM 1690 OD1 ASP A 103 -3.391 3.713 -8.407 1.00 0.00 O ATOM 1691 OD2 ASP A 103 -4.694 3.769 -6.665 1.00 0.00 O ATOM 0 H ASP A 103 -7.629 1.900 -9.720 1.00 0.00 H new ATOM 0 HA ASP A 103 -6.514 4.474 -9.117 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -6.234 2.197 -7.888 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -5.063 1.806 -9.131 1.00 0.00 H new ATOM 1696 N ASN A 104 -4.860 4.956 -10.982 1.00 0.00 N ATOM 1697 CA ASN A 104 -4.132 5.363 -12.204 1.00 0.00 C ATOM 1698 C ASN A 104 -2.843 4.522 -12.409 1.00 0.00 C ATOM 1699 O ASN A 104 -2.345 4.389 -13.534 1.00 0.00 O ATOM 1700 CB ASN A 104 -3.817 6.887 -12.172 1.00 0.00 C ATOM 1701 CG ASN A 104 -3.496 7.493 -13.543 1.00 0.00 C ATOM 1702 OD1 ASN A 104 -4.224 7.071 -14.573 1.00 0.00 O flip ATOM 1703 ND2 ASN A 104 -2.635 8.370 -13.671 1.00 0.00 N flip ATOM 0 H ASN A 104 -4.866 5.666 -10.249 1.00 0.00 H new ATOM 0 HA ASN A 104 -4.779 5.169 -13.059 1.00 0.00 H new ATOM 0 HB2 ASN A 104 -4.671 7.414 -11.746 1.00 0.00 H new ATOM 0 HB3 ASN A 104 -2.972 7.058 -11.505 1.00 0.00 H new ATOM 0 HD21 ASN A 104 -2.092 8.673 -12.863 1.00 0.00 H new ATOM 0 HD22 ASN A 104 -2.467 8.790 -14.585 1.00 0.00 H new ATOM 1710 N GLU A 105 -2.308 3.968 -11.301 1.00 0.00 N ATOM 1711 CA GLU A 105 -1.226 2.958 -11.341 1.00 0.00 C ATOM 1712 C GLU A 105 -1.737 1.658 -11.986 1.00 0.00 C ATOM 1713 O GLU A 105 -1.058 1.070 -12.837 1.00 0.00 O ATOM 1714 CB GLU A 105 -0.691 2.688 -9.902 1.00 0.00 C ATOM 1715 CG GLU A 105 0.321 1.527 -9.749 1.00 0.00 C ATOM 1716 CD GLU A 105 1.595 1.686 -10.599 1.00 0.00 C ATOM 1717 OE1 GLU A 105 2.391 2.606 -10.324 1.00 0.00 O ATOM 1718 OE2 GLU A 105 1.808 0.895 -11.542 1.00 0.00 O ATOM 0 H GLU A 105 -2.611 4.206 -10.357 1.00 0.00 H new ATOM 0 HA GLU A 105 -0.405 3.341 -11.947 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -0.221 3.601 -9.536 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -1.543 2.486 -9.253 1.00 0.00 H new ATOM 0 HG2 GLU A 105 0.605 1.443 -8.700 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -0.170 0.593 -10.022 1.00 0.00 H new ATOM 1725 N ALA A 106 -2.951 1.245 -11.591 1.00 0.00 N ATOM 1726 CA ALA A 106 -3.574 0.011 -12.084 1.00 0.00 C ATOM 1727 C ALA A 106 -3.911 0.126 -13.588 1.00 0.00 C ATOM 1728 O ALA A 106 -3.434 -0.675 -14.399 1.00 0.00 O ATOM 1729 CB ALA A 106 -4.824 -0.325 -11.252 1.00 0.00 C ATOM 0 H ALA A 106 -3.526 1.757 -10.922 1.00 0.00 H new ATOM 0 HA ALA A 106 -2.863 -0.807 -11.971 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -5.276 -1.243 -11.629 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -4.540 -0.462 -10.208 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -5.542 0.491 -11.329 1.00 0.00 H new ATOM 1735 N ASP A 107 -4.661 1.184 -13.963 1.00 0.00 N ATOM 1736 CA ASP A 107 -5.234 1.344 -15.321 1.00 0.00 C ATOM 1737 C ASP A 107 -4.211 1.871 -16.360 1.00 0.00 C ATOM 1738 O ASP A 107 -4.592 2.425 -17.392 1.00 0.00 O ATOM 1739 CB ASP A 107 -6.528 2.227 -15.261 1.00 0.00 C ATOM 1740 CG ASP A 107 -6.351 3.670 -14.722 1.00 0.00 C ATOM 1741 OD1 ASP A 107 -5.510 4.433 -15.251 1.00 0.00 O ATOM 1742 OD2 ASP A 107 -7.068 4.049 -13.770 1.00 0.00 O ATOM 0 H ASP A 107 -4.888 1.954 -13.333 1.00 0.00 H new ATOM 0 HA ASP A 107 -5.510 0.351 -15.676 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -6.949 2.286 -16.265 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -7.262 1.717 -14.637 1.00 0.00 H new ATOM 1747 N GLY A 108 -2.912 1.663 -16.110 1.00 0.00 N ATOM 1748 CA GLY A 108 -1.878 1.951 -17.108 1.00 0.00 C ATOM 1749 C GLY A 108 -0.720 0.978 -17.041 1.00 0.00 C ATOM 1750 O GLY A 108 0.316 1.200 -17.671 1.00 0.00 O ATOM 0 H GLY A 108 -2.554 1.297 -15.227 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -2.320 1.917 -18.104 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -1.506 2.965 -16.959 1.00 0.00 H new ATOM 1754 N ASN A 109 -0.903 -0.123 -16.291 1.00 0.00 N ATOM 1755 CA ASN A 109 0.169 -1.118 -16.040 1.00 0.00 C ATOM 1756 C ASN A 109 -0.256 -2.484 -16.597 1.00 0.00 C ATOM 1757 O ASN A 109 0.568 -3.247 -17.107 1.00 0.00 O ATOM 1758 CB ASN A 109 0.444 -1.234 -14.507 1.00 0.00 C ATOM 1759 CG ASN A 109 1.748 -1.955 -14.135 1.00 0.00 C ATOM 1760 OD1 ASN A 109 2.299 -2.757 -14.892 1.00 0.00 O ATOM 1761 ND2 ASN A 109 2.238 -1.690 -12.939 1.00 0.00 N ATOM 0 H ASN A 109 -1.790 -0.352 -15.842 1.00 0.00 H new ATOM 0 HA ASN A 109 1.082 -0.792 -16.539 1.00 0.00 H new ATOM 0 HB2 ASN A 109 0.466 -0.231 -14.080 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -0.390 -1.760 -14.042 1.00 0.00 H new ATOM 0 HD21 ASN A 109 3.090 -2.153 -12.623 1.00 0.00 H new ATOM 0 HD22 ASN A 109 1.764 -1.023 -12.330 1.00 0.00 H new ATOM 1768 N LYS A 110 -1.569 -2.762 -16.535 1.00 0.00 N ATOM 1769 CA LYS A 110 -2.129 -4.078 -16.881 1.00 0.00 C ATOM 1770 C LYS A 110 -3.260 -3.949 -17.920 1.00 0.00 C ATOM 1771 O LYS A 110 -3.567 -2.839 -18.373 1.00 0.00 O ATOM 1772 CB LYS A 110 -2.567 -4.811 -15.576 1.00 0.00 C ATOM 1773 CG LYS A 110 -3.409 -4.002 -14.551 1.00 0.00 C ATOM 1774 CD LYS A 110 -4.789 -3.519 -15.059 1.00 0.00 C ATOM 1775 CE LYS A 110 -5.711 -3.084 -13.915 1.00 0.00 C ATOM 1776 NZ LYS A 110 -5.989 -4.191 -12.960 1.00 0.00 N ATOM 0 H LYS A 110 -2.271 -2.081 -16.244 1.00 0.00 H new ATOM 0 HA LYS A 110 -1.365 -4.690 -17.360 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -3.140 -5.693 -15.861 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -1.668 -5.164 -15.070 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -3.562 -4.619 -13.665 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -2.831 -3.132 -14.238 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -4.649 -2.685 -15.747 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -5.267 -4.320 -15.623 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -5.254 -2.252 -13.380 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -6.651 -2.719 -14.328 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -7.015 -4.274 -12.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -5.620 -5.083 -13.346 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -5.526 -3.990 -12.051 1.00 0.00 H new ATOM 1790 N THR A 111 -3.884 -5.092 -18.264 1.00 0.00 N ATOM 1791 CA THR A 111 -4.880 -5.181 -19.348 1.00 0.00 C ATOM 1792 C THR A 111 -6.272 -4.692 -18.902 1.00 0.00 C ATOM 1793 O THR A 111 -6.547 -4.559 -17.705 1.00 0.00 O ATOM 1794 CB THR A 111 -4.970 -6.641 -19.915 1.00 0.00 C ATOM 1795 OG1 THR A 111 -5.455 -7.536 -18.916 1.00 0.00 O ATOM 1796 CG2 THR A 111 -3.610 -7.146 -20.413 1.00 0.00 C ATOM 0 H THR A 111 -3.711 -5.982 -17.796 1.00 0.00 H new ATOM 0 HA THR A 111 -4.538 -4.518 -20.143 1.00 0.00 H new ATOM 0 HB THR A 111 -5.661 -6.611 -20.758 1.00 0.00 H new ATOM 0 HG1 THR A 111 -5.058 -7.306 -18.050 1.00 0.00 H new ATOM 0 HG21 THR A 111 -3.717 -8.160 -20.797 1.00 0.00 H new ATOM 0 HG22 THR A 111 -3.248 -6.493 -21.207 1.00 0.00 H new ATOM 0 HG23 THR A 111 -2.897 -7.144 -19.589 1.00 0.00 H new ATOM 1804 N MET A 112 -7.137 -4.391 -19.887 1.00 0.00 N ATOM 1805 CA MET A 112 -8.498 -3.871 -19.635 1.00 0.00 C ATOM 1806 C MET A 112 -9.529 -4.991 -19.407 1.00 0.00 C ATOM 1807 O MET A 112 -10.657 -4.723 -18.970 1.00 0.00 O ATOM 1808 CB MET A 112 -8.943 -2.947 -20.794 1.00 0.00 C ATOM 1809 CG MET A 112 -9.221 -3.604 -22.142 1.00 0.00 C ATOM 1810 SD MET A 112 -9.576 -2.391 -23.429 1.00 0.00 S ATOM 1811 CE MET A 112 -10.900 -1.417 -22.694 1.00 0.00 C ATOM 0 H MET A 112 -6.916 -4.500 -20.877 1.00 0.00 H new ATOM 0 HA MET A 112 -8.454 -3.294 -18.712 1.00 0.00 H new ATOM 0 HB2 MET A 112 -9.846 -2.423 -20.481 1.00 0.00 H new ATOM 0 HB3 MET A 112 -8.171 -2.192 -20.939 1.00 0.00 H new ATOM 0 HG2 MET A 112 -8.360 -4.203 -22.437 1.00 0.00 H new ATOM 0 HG3 MET A 112 -10.066 -4.286 -22.045 1.00 0.00 H new ATOM 0 HE1 MET A 112 -11.408 -0.848 -23.472 1.00 0.00 H new ATOM 0 HE2 MET A 112 -11.613 -2.082 -22.206 1.00 0.00 H new ATOM 0 HE3 MET A 112 -10.481 -0.731 -21.958 1.00 0.00 H new ATOM 1821 N ILE A 113 -9.131 -6.244 -19.698 1.00 0.00 N ATOM 1822 CA ILE A 113 -10.005 -7.432 -19.568 1.00 0.00 C ATOM 1823 C ILE A 113 -10.345 -7.715 -18.090 1.00 0.00 C ATOM 1824 O ILE A 113 -11.403 -8.268 -17.771 1.00 0.00 O ATOM 1825 CB ILE A 113 -9.338 -8.700 -20.227 1.00 0.00 C ATOM 1826 CG1 ILE A 113 -10.362 -9.861 -20.381 1.00 0.00 C ATOM 1827 CG2 ILE A 113 -8.085 -9.163 -19.445 1.00 0.00 C ATOM 1828 CD1 ILE A 113 -11.594 -9.524 -21.199 1.00 0.00 C ATOM 0 H ILE A 113 -8.192 -6.465 -20.031 1.00 0.00 H new ATOM 0 HA ILE A 113 -10.933 -7.215 -20.097 1.00 0.00 H new ATOM 0 HB ILE A 113 -9.009 -8.408 -21.224 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -9.859 -10.710 -20.843 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -10.679 -10.180 -19.388 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -7.655 -10.039 -19.932 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -7.349 -8.359 -19.429 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -8.367 -9.417 -18.423 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -12.247 -10.395 -21.249 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -12.128 -8.697 -20.730 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -11.294 -9.237 -22.207 1.00 0.00 H new ATOM 1840 N GLU A 114 -9.438 -7.276 -17.218 1.00 0.00 N ATOM 1841 CA GLU A 114 -9.509 -7.480 -15.756 1.00 0.00 C ATOM 1842 C GLU A 114 -10.556 -6.536 -15.166 1.00 0.00 C ATOM 1843 O GLU A 114 -11.382 -6.916 -14.326 1.00 0.00 O ATOM 1844 CB GLU A 114 -8.118 -7.186 -15.106 1.00 0.00 C ATOM 1845 CG GLU A 114 -6.931 -7.324 -16.073 1.00 0.00 C ATOM 1846 CD GLU A 114 -5.555 -7.081 -15.473 1.00 0.00 C ATOM 1847 OE1 GLU A 114 -5.466 -6.573 -14.346 1.00 0.00 O ATOM 1848 OE2 GLU A 114 -4.554 -7.385 -16.147 1.00 0.00 O ATOM 0 H GLU A 114 -8.610 -6.755 -17.507 1.00 0.00 H new ATOM 0 HA GLU A 114 -9.786 -8.514 -15.551 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -8.126 -6.175 -14.699 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -7.970 -7.866 -14.267 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -6.949 -8.327 -16.499 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -7.075 -6.625 -16.897 1.00 0.00 H new ATOM 1855 N LEU A 115 -10.481 -5.295 -15.650 1.00 0.00 N ATOM 1856 CA LEU A 115 -11.329 -4.190 -15.222 1.00 0.00 C ATOM 1857 C LEU A 115 -12.774 -4.396 -15.705 1.00 0.00 C ATOM 1858 O LEU A 115 -13.719 -4.073 -14.989 1.00 0.00 O ATOM 1859 CB LEU A 115 -10.732 -2.876 -15.767 1.00 0.00 C ATOM 1860 CG LEU A 115 -9.296 -2.529 -15.271 1.00 0.00 C ATOM 1861 CD1 LEU A 115 -8.738 -1.293 -15.995 1.00 0.00 C ATOM 1862 CD2 LEU A 115 -9.271 -2.333 -13.744 1.00 0.00 C ATOM 0 H LEU A 115 -9.809 -5.028 -16.370 1.00 0.00 H new ATOM 0 HA LEU A 115 -11.362 -4.144 -14.133 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -10.717 -2.929 -16.856 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -11.398 -2.056 -15.497 1.00 0.00 H new ATOM 0 HG LEU A 115 -8.650 -3.373 -15.512 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -7.735 -1.077 -15.626 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -8.697 -1.487 -17.067 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -9.386 -0.437 -15.806 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -8.257 -2.092 -13.425 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -9.941 -1.518 -13.471 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -9.597 -3.250 -13.254 1.00 0.00 H new ATOM 1874 N SER A 116 -12.923 -4.930 -16.931 1.00 0.00 N ATOM 1875 CA SER A 116 -14.238 -5.309 -17.487 1.00 0.00 C ATOM 1876 C SER A 116 -14.750 -6.603 -16.826 1.00 0.00 C ATOM 1877 O SER A 116 -15.957 -6.804 -16.692 1.00 0.00 O ATOM 1878 CB SER A 116 -14.145 -5.477 -19.026 1.00 0.00 C ATOM 1879 OG SER A 116 -13.163 -6.431 -19.391 1.00 0.00 O ATOM 0 H SER A 116 -12.142 -5.111 -17.562 1.00 0.00 H new ATOM 0 HA SER A 116 -14.950 -4.512 -17.272 1.00 0.00 H new ATOM 0 HB2 SER A 116 -15.115 -5.785 -19.418 1.00 0.00 H new ATOM 0 HB3 SER A 116 -13.907 -4.517 -19.483 1.00 0.00 H new ATOM 0 HG SER A 116 -12.780 -6.832 -18.583 1.00 0.00 H new ATOM 1885 N ASP A 117 -13.793 -7.456 -16.400 1.00 0.00 N ATOM 1886 CA ASP A 117 -14.055 -8.796 -15.836 1.00 0.00 C ATOM 1887 C ASP A 117 -14.685 -9.703 -16.926 1.00 0.00 C ATOM 1888 O ASP A 117 -15.562 -10.527 -16.654 1.00 0.00 O ATOM 1889 CB ASP A 117 -14.919 -8.702 -14.530 1.00 0.00 C ATOM 1890 CG ASP A 117 -14.915 -9.993 -13.686 1.00 0.00 C ATOM 1891 OD1 ASP A 117 -13.964 -10.194 -12.905 1.00 0.00 O ATOM 1892 OD2 ASP A 117 -15.858 -10.809 -13.802 1.00 0.00 O ATOM 0 H ASP A 117 -12.800 -7.227 -16.440 1.00 0.00 H new ATOM 0 HA ASP A 117 -13.115 -9.257 -15.532 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -14.549 -7.879 -13.919 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -15.946 -8.460 -14.802 1.00 0.00 H new ATOM 1897 N ASN A 118 -14.186 -9.523 -18.171 1.00 0.00 N ATOM 1898 CA ASN A 118 -14.553 -10.330 -19.362 1.00 0.00 C ATOM 1899 C ASN A 118 -15.980 -10.040 -19.874 1.00 0.00 C ATOM 1900 O ASN A 118 -16.623 -10.918 -20.463 1.00 0.00 O ATOM 1901 CB ASN A 118 -14.326 -11.860 -19.120 1.00 0.00 C ATOM 1902 CG ASN A 118 -12.856 -12.227 -18.889 1.00 0.00 C ATOM 1903 OD1 ASN A 118 -12.131 -12.566 -19.823 1.00 0.00 O ATOM 1904 ND2 ASN A 118 -12.405 -12.162 -17.647 1.00 0.00 N ATOM 0 H ASN A 118 -13.502 -8.797 -18.382 1.00 0.00 H new ATOM 0 HA ASN A 118 -13.876 -10.017 -20.157 1.00 0.00 H new ATOM 0 HB2 ASN A 118 -14.912 -12.175 -18.256 1.00 0.00 H new ATOM 0 HB3 ASN A 118 -14.701 -12.416 -19.979 1.00 0.00 H new ATOM 0 HD21 ASN A 118 -11.433 -12.396 -17.444 1.00 0.00 H new ATOM 0 HD22 ASN A 118 -13.029 -11.878 -16.892 1.00 0.00 H new ATOM 1911 N GLU A 119 -16.459 -8.790 -19.710 1.00 0.00 N ATOM 1912 CA GLU A 119 -17.749 -8.355 -20.307 1.00 0.00 C ATOM 1913 C GLU A 119 -17.508 -7.347 -21.451 1.00 0.00 C ATOM 1914 O GLU A 119 -16.481 -6.648 -21.474 1.00 0.00 O ATOM 1915 CB GLU A 119 -18.689 -7.734 -19.233 1.00 0.00 C ATOM 1916 CG GLU A 119 -18.268 -6.341 -18.716 1.00 0.00 C ATOM 1917 CD GLU A 119 -19.278 -5.726 -17.738 1.00 0.00 C ATOM 1918 OE1 GLU A 119 -20.239 -5.073 -18.203 1.00 0.00 O ATOM 1919 OE2 GLU A 119 -19.130 -5.895 -16.504 1.00 0.00 O ATOM 0 H GLU A 119 -15.980 -8.066 -19.175 1.00 0.00 H new ATOM 0 HA GLU A 119 -18.238 -9.239 -20.715 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -19.693 -7.660 -19.651 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -18.746 -8.416 -18.385 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -17.299 -6.421 -18.224 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -18.140 -5.670 -19.565 1.00 0.00 H new ATOM 1926 N ASN A 120 -18.464 -7.307 -22.406 1.00 0.00 N ATOM 1927 CA ASN A 120 -18.527 -6.281 -23.468 1.00 0.00 C ATOM 1928 C ASN A 120 -19.967 -6.194 -24.041 1.00 0.00 C ATOM 1929 O ASN A 120 -20.612 -7.231 -24.210 1.00 0.00 O ATOM 1930 CB ASN A 120 -17.452 -6.496 -24.596 1.00 0.00 C ATOM 1931 CG ASN A 120 -17.269 -7.932 -25.132 1.00 0.00 C ATOM 1932 OD1 ASN A 120 -16.150 -8.327 -25.476 1.00 0.00 O ATOM 1933 ND2 ASN A 120 -18.334 -8.715 -25.244 1.00 0.00 N ATOM 0 H ASN A 120 -19.218 -7.991 -22.461 1.00 0.00 H new ATOM 0 HA ASN A 120 -18.278 -5.322 -23.013 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -17.711 -5.852 -25.437 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -16.490 -6.152 -24.216 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -18.236 -9.659 -25.619 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -19.251 -8.373 -24.955 1.00 0.00 H new ATOM 1940 N PRO A 121 -20.533 -4.963 -24.311 1.00 0.00 N ATOM 1941 CA PRO A 121 -19.904 -3.652 -23.999 1.00 0.00 C ATOM 1942 C PRO A 121 -19.884 -3.347 -22.478 1.00 0.00 C ATOM 1943 O PRO A 121 -20.813 -3.706 -21.746 1.00 0.00 O ATOM 1944 CB PRO A 121 -20.776 -2.638 -24.779 1.00 0.00 C ATOM 1945 CG PRO A 121 -22.121 -3.297 -24.870 1.00 0.00 C ATOM 1946 CD PRO A 121 -21.846 -4.781 -24.989 1.00 0.00 C ATOM 0 HA PRO A 121 -18.853 -3.620 -24.287 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -20.836 -1.682 -24.259 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -20.364 -2.437 -25.768 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -22.723 -3.080 -23.988 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -22.678 -2.932 -25.733 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -22.627 -5.371 -24.510 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -21.803 -5.096 -26.032 1.00 0.00 H new ATOM 1954 N TRP A 122 -18.792 -2.718 -22.024 1.00 0.00 N ATOM 1955 CA TRP A 122 -18.561 -2.389 -20.605 1.00 0.00 C ATOM 1956 C TRP A 122 -18.854 -0.895 -20.367 1.00 0.00 C ATOM 1957 O TRP A 122 -18.148 -0.036 -20.878 1.00 0.00 O ATOM 1958 CB TRP A 122 -17.094 -2.753 -20.251 1.00 0.00 C ATOM 1959 CG TRP A 122 -16.648 -2.430 -18.846 1.00 0.00 C ATOM 1960 CD1 TRP A 122 -17.341 -2.641 -17.696 1.00 0.00 C ATOM 1961 CD2 TRP A 122 -15.377 -1.903 -18.450 1.00 0.00 C ATOM 1962 NE1 TRP A 122 -16.614 -2.226 -16.620 1.00 0.00 N ATOM 1963 CE2 TRP A 122 -15.401 -1.779 -17.052 1.00 0.00 C ATOM 1964 CE3 TRP A 122 -14.227 -1.503 -19.146 1.00 0.00 C ATOM 1965 CZ2 TRP A 122 -14.325 -1.291 -16.334 1.00 0.00 C ATOM 1966 CZ3 TRP A 122 -13.148 -1.026 -18.431 1.00 0.00 C ATOM 1967 CH2 TRP A 122 -13.207 -0.916 -17.037 1.00 0.00 C ATOM 0 H TRP A 122 -18.033 -2.418 -22.636 1.00 0.00 H new ATOM 0 HA TRP A 122 -19.228 -2.960 -19.959 1.00 0.00 H new ATOM 0 HB2 TRP A 122 -16.957 -3.821 -20.417 1.00 0.00 H new ATOM 0 HB3 TRP A 122 -16.435 -2.235 -20.947 1.00 0.00 H new ATOM 0 HD1 TRP A 122 -18.328 -3.076 -17.642 1.00 0.00 H new ATOM 0 HE1 TRP A 122 -16.927 -2.247 -15.649 1.00 0.00 H new ATOM 0 HE3 TRP A 122 -14.187 -1.567 -20.223 1.00 0.00 H new ATOM 0 HZ2 TRP A 122 -14.363 -1.208 -15.258 1.00 0.00 H new ATOM 0 HZ3 TRP A 122 -12.248 -0.734 -18.952 1.00 0.00 H new ATOM 0 HH2 TRP A 122 -12.353 -0.527 -16.502 1.00 0.00 H new ATOM 1978 N THR A 123 -19.913 -0.602 -19.604 1.00 0.00 N ATOM 1979 CA THR A 123 -20.330 0.778 -19.300 1.00 0.00 C ATOM 1980 C THR A 123 -19.439 1.412 -18.199 1.00 0.00 C ATOM 1981 O THR A 123 -19.160 0.788 -17.165 1.00 0.00 O ATOM 1982 CB THR A 123 -21.832 0.800 -18.877 1.00 0.00 C ATOM 1983 OG1 THR A 123 -22.622 0.197 -19.910 1.00 0.00 O ATOM 1984 CG2 THR A 123 -22.356 2.218 -18.619 1.00 0.00 C ATOM 0 H THR A 123 -20.508 -1.313 -19.178 1.00 0.00 H new ATOM 0 HA THR A 123 -20.207 1.377 -20.202 1.00 0.00 H new ATOM 0 HB THR A 123 -21.911 0.244 -17.943 1.00 0.00 H new ATOM 0 HG1 THR A 123 -22.861 0.874 -20.577 1.00 0.00 H new ATOM 0 HG21 THR A 123 -23.405 2.171 -18.328 1.00 0.00 H new ATOM 0 HG22 THR A 123 -21.778 2.679 -17.818 1.00 0.00 H new ATOM 0 HG23 THR A 123 -22.257 2.813 -19.527 1.00 0.00 H new ATOM 1992 N ILE A 124 -19.008 2.660 -18.441 1.00 0.00 N ATOM 1993 CA ILE A 124 -18.106 3.408 -17.551 1.00 0.00 C ATOM 1994 C ILE A 124 -18.446 4.909 -17.596 1.00 0.00 C ATOM 1995 O ILE A 124 -18.929 5.427 -18.616 1.00 0.00 O ATOM 1996 CB ILE A 124 -16.569 3.150 -17.922 1.00 0.00 C ATOM 1997 CG1 ILE A 124 -15.849 2.338 -16.805 1.00 0.00 C ATOM 1998 CG2 ILE A 124 -15.768 4.446 -18.244 1.00 0.00 C ATOM 1999 CD1 ILE A 124 -14.358 2.193 -16.991 1.00 0.00 C ATOM 0 H ILE A 124 -19.280 3.185 -19.272 1.00 0.00 H new ATOM 0 HA ILE A 124 -18.254 3.049 -16.533 1.00 0.00 H new ATOM 0 HB ILE A 124 -16.590 2.565 -18.842 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -16.036 2.821 -15.846 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -16.293 1.344 -16.754 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -14.737 4.186 -18.485 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -16.223 4.953 -19.095 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -15.782 5.107 -17.378 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -13.943 1.614 -16.166 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -14.157 1.680 -17.932 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -13.896 3.180 -17.010 1.00 0.00 H new ATOM 2011 N PHE A 125 -18.199 5.588 -16.465 1.00 0.00 N ATOM 2012 CA PHE A 125 -18.274 7.054 -16.354 1.00 0.00 C ATOM 2013 C PHE A 125 -16.856 7.619 -16.543 1.00 0.00 C ATOM 2014 O PHE A 125 -15.930 7.184 -15.842 1.00 0.00 O ATOM 2015 CB PHE A 125 -18.815 7.492 -14.956 1.00 0.00 C ATOM 2016 CG PHE A 125 -20.082 6.776 -14.478 1.00 0.00 C ATOM 2017 CD1 PHE A 125 -20.009 5.504 -13.906 1.00 0.00 C ATOM 2018 CD2 PHE A 125 -21.339 7.366 -14.594 1.00 0.00 C ATOM 2019 CE1 PHE A 125 -21.140 4.858 -13.455 1.00 0.00 C ATOM 2020 CE2 PHE A 125 -22.473 6.716 -14.141 1.00 0.00 C ATOM 2021 CZ PHE A 125 -22.373 5.458 -13.581 1.00 0.00 C ATOM 0 H PHE A 125 -17.939 5.130 -15.592 1.00 0.00 H new ATOM 0 HA PHE A 125 -18.957 7.434 -17.114 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -18.030 7.333 -14.217 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -19.014 8.563 -14.984 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -19.049 5.018 -13.815 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -21.429 8.344 -15.044 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -21.059 3.881 -13.003 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -23.438 7.193 -14.226 1.00 0.00 H new ATOM 0 HZ PHE A 125 -23.261 4.945 -13.242 1.00 0.00 H new ATOM 2031 N LEU A 126 -16.675 8.554 -17.491 1.00 0.00 N ATOM 2032 CA LEU A 126 -15.395 9.262 -17.662 1.00 0.00 C ATOM 2033 C LEU A 126 -15.335 10.396 -16.616 1.00 0.00 C ATOM 2034 O LEU A 126 -16.310 11.142 -16.439 1.00 0.00 O ATOM 2035 CB LEU A 126 -15.242 9.836 -19.107 1.00 0.00 C ATOM 2036 CG LEU A 126 -13.795 9.864 -19.737 1.00 0.00 C ATOM 2037 CD1 LEU A 126 -13.765 10.753 -20.991 1.00 0.00 C ATOM 2038 CD2 LEU A 126 -12.687 10.287 -18.751 1.00 0.00 C ATOM 0 H LEU A 126 -17.399 8.837 -18.151 1.00 0.00 H new ATOM 0 HA LEU A 126 -14.571 8.563 -17.514 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -15.884 9.255 -19.768 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -15.626 10.856 -19.105 1.00 0.00 H new ATOM 0 HG LEU A 126 -13.574 8.833 -20.012 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -12.758 10.758 -21.409 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -14.463 10.362 -21.731 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -14.052 11.770 -20.723 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -11.724 10.281 -19.261 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -12.894 11.291 -18.380 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -12.659 9.589 -17.914 1.00 0.00 H new ATOM 2050 N GLU A 127 -14.193 10.499 -15.938 1.00 0.00 N ATOM 2051 CA GLU A 127 -13.917 11.534 -14.940 1.00 0.00 C ATOM 2052 C GLU A 127 -12.580 12.223 -15.277 1.00 0.00 C ATOM 2053 O GLU A 127 -11.670 11.586 -15.825 1.00 0.00 O ATOM 2054 CB GLU A 127 -13.864 10.888 -13.529 1.00 0.00 C ATOM 2055 CG GLU A 127 -13.652 11.879 -12.372 1.00 0.00 C ATOM 2056 CD GLU A 127 -14.838 12.839 -12.195 1.00 0.00 C ATOM 2057 OE1 GLU A 127 -15.784 12.487 -11.457 1.00 0.00 O ATOM 2058 OE2 GLU A 127 -14.843 13.938 -12.800 1.00 0.00 O ATOM 0 H GLU A 127 -13.416 9.851 -16.069 1.00 0.00 H new ATOM 0 HA GLU A 127 -14.708 12.284 -14.949 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -14.794 10.346 -13.358 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -13.059 10.153 -13.511 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -13.497 11.324 -11.447 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -12.745 12.456 -12.554 1.00 0.00 H new ATOM 2065 N THR A 128 -12.469 13.526 -14.962 1.00 0.00 N ATOM 2066 CA THR A 128 -11.228 14.293 -15.175 1.00 0.00 C ATOM 2067 C THR A 128 -10.557 14.547 -13.793 1.00 0.00 C ATOM 2068 O THR A 128 -10.538 15.704 -13.305 1.00 0.00 O ATOM 2069 CB THR A 128 -11.531 15.642 -15.947 1.00 0.00 C ATOM 2070 OG1 THR A 128 -12.689 15.500 -16.769 1.00 0.00 O ATOM 2071 CG2 THR A 128 -10.355 16.083 -16.841 1.00 0.00 C ATOM 2072 OXT THR A 128 -10.117 13.562 -13.172 1.00 0.00 O ATOM 0 H THR A 128 -13.229 14.073 -14.557 1.00 0.00 H new ATOM 0 HA THR A 128 -10.538 13.726 -15.799 1.00 0.00 H new ATOM 0 HB THR A 128 -11.694 16.402 -15.183 1.00 0.00 H new ATOM 0 HG1 THR A 128 -12.481 14.919 -17.530 1.00 0.00 H new ATOM 0 HG21 THR A 128 -10.612 17.013 -17.349 1.00 0.00 H new ATOM 0 HG22 THR A 128 -9.469 16.239 -16.226 1.00 0.00 H new ATOM 0 HG23 THR A 128 -10.151 15.310 -17.582 1.00 0.00 H new TER 2080 THR A 128