USER MOD reduce.3.24.130724 H: found=0, std=0, add=1978, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 1974 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 20 ASN : amide:sc= -0.06 K(o=-2,f=-3.6!) USER MOD Set 1.2: A 125 ASN : amide:sc= -0.87 X(o=-2,f=-2.3) USER MOD Set 1.3: B 20 ASN : amide:sc= -0.0637 K(o=-2,f=-3.7!) USER MOD Set 1.4: B 125 ASN : amide:sc= -0.979 X(o=-2,f=-2.3) USER MOD Set 2.1: B 90 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: B 119 ASN : amide:sc= -0.0198 X(o=-0.02,f=-0.02) USER MOD Set 3.1: B 27 HIS : no HD1:sc= -0.108 K(o=-0.38,f=-1.1) USER MOD Set 3.2: B 29 TYR OH : rot 25:sc= -0.271 USER MOD Set 4.1: A 90 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: A 119 ASN : amide:sc= -0.0363 X(o=-0.036,f=-0.036) USER MOD Set 5.1: A 27 HIS : no HD1:sc= -0.119 K(o=-0.39,f=-1.1) USER MOD Set 5.2: A 29 TYR OH : rot 15:sc= -0.268 USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 GLN : amide:sc= 0 K(o=0,f=-0.88) USER MOD Single : A 3 SER OG : rot 180:sc= -0.303 USER MOD Single : A 10 ASN : amide:sc= -0.0571 K(o=-0.057,f=-1.6!) USER MOD Single : A 11 THR OG1 : rot 114:sc= 0.119 USER MOD Single : A 12 GLN : amide:sc= -0.481 K(o=-0.48,f=-3.9!) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 GLN : amide:sc= -0.124 K(o=-0.12,f=-2.3!) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 TYR OH : rot 50:sc= -0.296 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 HIS : no HD1:sc= -0.79 K(o=-0.79,f=-0.061) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 180:sc= -0.359 USER MOD Single : A 35 ASN : amide:sc= -3.94! C(o=-3.9!,f=-11!) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 THR OG1 : rot 107:sc= 0.781 USER MOD Single : A 48 THR OG1 : rot 140:sc= 0.0284 USER MOD Single : A 49 ASN : amide:sc= -0.233 K(o=-0.23,f=-2.5!) USER MOD Single : A 50 MET CE :methyl 177:sc=-0.00572 (180deg=-0.0269) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 59 CYS SG : rot 145:sc= 1.36 USER MOD Single : A 65 LYS NZ :NH3+ -169:sc=-0.00781 (180deg=-0.124) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 MET CE :methyl 166:sc= -3.91! (180deg=-4.67!) USER MOD Single : A 73 SER OG : rot 180:sc= -0.135 USER MOD Single : A 74 CYS SG : rot 161:sc= 1.37 USER MOD Single : A 76 THR OG1 : rot 67:sc= 0.603 USER MOD Single : A 78 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 81 THR OG1 : rot 64:sc= 0.133 USER MOD Single : A 85 ASN : amide:sc= -0.314 K(o=-0.31,f=-1.3) USER MOD Single : A 86 ASN : amide:sc= -0.44 X(o=-0.44,f=0) USER MOD Single : A 94 THR OG1 : rot 80:sc= -1.36! USER MOD Single : A 95 ASN : amide:sc= -0.0345 K(o=-0.034,f=-4.3!) USER MOD Single : A 96 THR OG1 : rot 120:sc= -0.17 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 GLN : amide:sc= -0.0844 X(o=-0.084,f=-0.18) USER MOD Single : A 110 GLN : amide:sc= -0.115 X(o=-0.11,f=0) USER MOD Single : A 114 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 TYR OH : rot 35:sc= -0.254 USER MOD Single : B 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 2 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : B 3 SER OG : rot 180:sc= -0.301 USER MOD Single : B 10 ASN : amide:sc= -0.0358 K(o=-0.036,f=-1.6!) USER MOD Single : B 11 THR OG1 : rot 112:sc= 0.123 USER MOD Single : B 12 GLN : amide:sc= -0.483 K(o=-0.48,f=-3.7!) USER MOD Single : B 14 SER OG : rot 180:sc= 0 USER MOD Single : B 15 GLN : amide:sc= -0.208 K(o=-0.21,f=-2.3!) USER MOD Single : B 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 23 TYR OH : rot 50:sc= -0.287 USER MOD Single : B 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 28 THR OG1 : rot 180:sc= 0 USER MOD Single : B 30 HIS : no HD1:sc= -0.717 K(o=-0.72,f=-0.065) USER MOD Single : B 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 34 THR OG1 : rot 180:sc= -0.371 USER MOD Single : B 35 ASN : amide:sc= -3.96! C(o=-4!,f=-11!) USER MOD Single : B 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 47 THR OG1 : rot 106:sc= 0.78 USER MOD Single : B 48 THR OG1 : rot 140:sc= 0.0274 USER MOD Single : B 49 ASN : amide:sc= -0.261 K(o=-0.26,f=-2.5!) USER MOD Single : B 50 MET CE :methyl 177:sc=-0.00409 (180deg=-0.0227) USER MOD Single : B 54 SER OG : rot 180:sc= 0 USER MOD Single : B 59 CYS SG : rot 146:sc= 1.37 USER MOD Single : B 65 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.115) USER MOD Single : B 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 70 MET CE :methyl 167:sc= -3.98! (180deg=-4.74!) USER MOD Single : B 73 SER OG : rot 180:sc= -0.143 USER MOD Single : B 74 CYS SG : rot 166:sc= 1.38 USER MOD Single : B 76 THR OG1 : rot 62:sc= 0.45 USER MOD Single : B 78 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 81 THR OG1 : rot 180:sc= 0 USER MOD Single : B 85 ASN : amide:sc= -0.314 K(o=-0.31,f=-1.2) USER MOD Single : B 86 ASN : amide:sc= -0.454 X(o=-0.45,f=0) USER MOD Single : B 94 THR OG1 : rot 77:sc= -1.07! USER MOD Single : B 95 ASN : amide:sc= -0.0516 K(o=-0.052,f=-4.5!) USER MOD Single : B 96 THR OG1 : rot 120:sc= -0.172 USER MOD Single : B 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 103 GLN : amide:sc= -0.101 X(o=-0.1,f=-0.2) USER MOD Single : B 110 GLN : amide:sc= -0.0623 X(o=-0.062,f=0) USER MOD Single : B 114 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 124 TYR OH : rot 40:sc= -0.216 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -44.305 0.733 -2.160 1.00 0.00 N ATOM 2 CA ALA A 1 -42.980 1.089 -1.591 1.00 0.00 C ATOM 3 C ALA A 1 -42.334 2.223 -2.378 1.00 0.00 C ATOM 4 O ALA A 1 -41.448 1.994 -3.203 1.00 0.00 O ATOM 5 CB ALA A 1 -42.068 -0.129 -1.577 1.00 0.00 C ATOM 0 H1 ALA A 1 -44.724 -0.041 -1.606 1.00 0.00 H new ATOM 0 H2 ALA A 1 -44.932 1.562 -2.125 1.00 0.00 H new ATOM 0 H3 ALA A 1 -44.188 0.429 -3.148 1.00 0.00 H new ATOM 0 HA ALA A 1 -43.131 1.430 -0.567 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -41.100 0.146 -1.158 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -42.518 -0.913 -0.968 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -41.932 -0.493 -2.595 1.00 0.00 H new ATOM 13 N GLN A 2 -42.785 3.447 -2.121 1.00 0.00 N ATOM 14 CA GLN A 2 -42.251 4.617 -2.807 1.00 0.00 C ATOM 15 C GLN A 2 -41.629 5.593 -1.816 1.00 0.00 C ATOM 16 O GLN A 2 -42.244 5.952 -0.812 1.00 0.00 O ATOM 17 CB GLN A 2 -43.355 5.316 -3.603 1.00 0.00 C ATOM 18 CG GLN A 2 -44.638 5.520 -2.815 1.00 0.00 C ATOM 19 CD GLN A 2 -45.720 6.201 -3.629 1.00 0.00 C ATOM 20 OE1 GLN A 2 -45.576 6.390 -4.837 1.00 0.00 O ATOM 21 NE2 GLN A 2 -46.810 6.574 -2.971 1.00 0.00 N ATOM 0 H GLN A 2 -43.519 3.654 -1.443 1.00 0.00 H new ATOM 0 HA GLN A 2 -41.474 4.280 -3.494 1.00 0.00 H new ATOM 0 HB2 GLN A 2 -42.989 6.285 -3.942 1.00 0.00 H new ATOM 0 HB3 GLN A 2 -43.576 4.729 -4.495 1.00 0.00 H new ATOM 0 HG2 GLN A 2 -45.004 4.554 -2.467 1.00 0.00 H new ATOM 0 HG3 GLN A 2 -44.425 6.118 -1.929 1.00 0.00 H new ATOM 0 HE21 GLN A 2 -46.887 6.397 -1.969 1.00 0.00 H new ATOM 0 HE22 GLN A 2 -47.571 7.038 -3.467 1.00 0.00 H new ATOM 30 N SER A 3 -40.403 6.020 -2.105 1.00 0.00 N ATOM 31 CA SER A 3 -39.694 6.958 -1.242 1.00 0.00 C ATOM 32 C SER A 3 -38.518 7.588 -1.980 1.00 0.00 C ATOM 33 O SER A 3 -38.596 8.730 -2.433 1.00 0.00 O ATOM 34 CB SER A 3 -39.199 6.249 0.019 1.00 0.00 C ATOM 35 OG SER A 3 -38.267 7.051 0.724 1.00 0.00 O ATOM 0 H SER A 3 -39.880 5.731 -2.931 1.00 0.00 H new ATOM 0 HA SER A 3 -40.388 7.748 -0.956 1.00 0.00 H new ATOM 0 HB2 SER A 3 -40.046 6.017 0.665 1.00 0.00 H new ATOM 0 HB3 SER A 3 -38.735 5.300 -0.252 1.00 0.00 H new ATOM 0 HG SER A 3 -37.967 6.575 1.527 1.00 0.00 H new ATOM 41 N VAL A 4 -37.429 6.835 -2.101 1.00 0.00 N ATOM 42 CA VAL A 4 -36.239 7.318 -2.787 1.00 0.00 C ATOM 43 C VAL A 4 -35.146 6.252 -2.810 1.00 0.00 C ATOM 44 O VAL A 4 -34.917 5.567 -1.812 1.00 0.00 O ATOM 45 CB VAL A 4 -35.682 8.591 -2.122 1.00 0.00 C ATOM 46 CG1 VAL A 4 -35.360 8.333 -0.659 1.00 0.00 C ATOM 47 CG2 VAL A 4 -34.454 9.091 -2.868 1.00 0.00 C ATOM 0 H VAL A 4 -37.348 5.888 -1.732 1.00 0.00 H new ATOM 0 HA VAL A 4 -36.538 7.552 -3.809 1.00 0.00 H new ATOM 0 HB VAL A 4 -36.446 9.367 -2.169 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -34.968 9.244 -0.207 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -36.266 8.029 -0.135 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -34.615 7.541 -0.585 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -34.075 9.991 -2.383 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -33.683 8.321 -2.857 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -34.723 9.320 -3.899 1.00 0.00 H new ATOM 57 N PRO A 5 -34.453 6.095 -3.952 1.00 0.00 N ATOM 58 CA PRO A 5 -33.383 5.107 -4.095 1.00 0.00 C ATOM 59 C PRO A 5 -32.093 5.542 -3.403 1.00 0.00 C ATOM 60 O PRO A 5 -31.901 6.724 -3.119 1.00 0.00 O ATOM 61 CB PRO A 5 -33.180 5.033 -5.608 1.00 0.00 C ATOM 62 CG PRO A 5 -33.563 6.385 -6.102 1.00 0.00 C ATOM 63 CD PRO A 5 -34.661 6.870 -5.192 1.00 0.00 C ATOM 0 HA PRO A 5 -33.641 4.153 -3.635 1.00 0.00 H new ATOM 0 HB2 PRO A 5 -32.146 4.797 -5.859 1.00 0.00 H new ATOM 0 HB3 PRO A 5 -33.801 4.257 -6.054 1.00 0.00 H new ATOM 0 HG2 PRO A 5 -32.710 7.064 -6.079 1.00 0.00 H new ATOM 0 HG3 PRO A 5 -33.906 6.339 -7.136 1.00 0.00 H new ATOM 0 HD2 PRO A 5 -34.588 7.942 -5.011 1.00 0.00 H new ATOM 0 HD3 PRO A 5 -35.647 6.686 -5.619 1.00 0.00 H new ATOM 71 N PRO A 6 -31.189 4.589 -3.122 1.00 0.00 N ATOM 72 CA PRO A 6 -29.913 4.882 -2.461 1.00 0.00 C ATOM 73 C PRO A 6 -28.971 5.685 -3.351 1.00 0.00 C ATOM 74 O PRO A 6 -28.781 5.360 -4.523 1.00 0.00 O ATOM 75 CB PRO A 6 -29.328 3.495 -2.180 1.00 0.00 C ATOM 76 CG PRO A 6 -29.956 2.606 -3.195 1.00 0.00 C ATOM 77 CD PRO A 6 -31.337 3.153 -3.428 1.00 0.00 C ATOM 0 HA PRO A 6 -30.049 5.490 -1.567 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -28.242 3.497 -2.274 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -29.560 3.165 -1.167 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -29.378 2.600 -4.119 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -29.999 1.577 -2.839 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -31.665 2.992 -4.455 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -32.073 2.677 -2.780 1.00 0.00 H new ATOM 85 N GLY A 7 -28.386 6.737 -2.788 1.00 0.00 N ATOM 86 CA GLY A 7 -27.472 7.570 -3.546 1.00 0.00 C ATOM 87 C GLY A 7 -26.251 6.809 -4.023 1.00 0.00 C ATOM 88 O GLY A 7 -26.347 5.638 -4.395 1.00 0.00 O ATOM 0 H GLY A 7 -28.529 7.027 -1.821 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -27.995 7.987 -4.407 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -27.154 8.410 -2.928 1.00 0.00 H new ATOM 92 N ASP A 8 -25.100 7.473 -4.014 1.00 0.00 N ATOM 93 CA ASP A 8 -23.856 6.851 -4.450 1.00 0.00 C ATOM 94 C ASP A 8 -22.747 7.073 -3.427 1.00 0.00 C ATOM 95 O ASP A 8 -22.593 8.171 -2.891 1.00 0.00 O ATOM 96 CB ASP A 8 -23.430 7.411 -5.808 1.00 0.00 C ATOM 97 CG ASP A 8 -22.819 6.352 -6.705 1.00 0.00 C ATOM 98 OD1 ASP A 8 -22.736 5.184 -6.273 1.00 0.00 O ATOM 99 OD2 ASP A 8 -22.425 6.692 -7.840 1.00 0.00 O ATOM 0 H ASP A 8 -25.003 8.442 -3.710 1.00 0.00 H new ATOM 0 HA ASP A 8 -24.030 5.779 -4.544 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -24.296 7.849 -6.305 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -22.709 8.215 -5.657 1.00 0.00 H new ATOM 104 N ILE A 9 -21.978 6.023 -3.158 1.00 0.00 N ATOM 105 CA ILE A 9 -20.884 6.103 -2.198 1.00 0.00 C ATOM 106 C ILE A 9 -19.565 6.421 -2.892 1.00 0.00 C ATOM 107 O ILE A 9 -19.376 6.101 -4.066 1.00 0.00 O ATOM 108 CB ILE A 9 -20.729 4.789 -1.408 1.00 0.00 C ATOM 109 CG1 ILE A 9 -20.348 3.642 -2.347 1.00 0.00 C ATOM 110 CG2 ILE A 9 -22.014 4.465 -0.662 1.00 0.00 C ATOM 111 CD1 ILE A 9 -19.741 2.453 -1.634 1.00 0.00 C ATOM 0 H ILE A 9 -22.093 5.107 -3.592 1.00 0.00 H new ATOM 0 HA ILE A 9 -21.132 6.908 -1.506 1.00 0.00 H new ATOM 0 HB ILE A 9 -19.929 4.915 -0.678 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -21.236 3.316 -2.888 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -19.640 4.011 -3.089 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -21.889 3.534 -0.109 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -22.244 5.272 0.033 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -22.831 4.356 -1.375 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -19.496 1.679 -2.361 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -18.834 2.764 -1.115 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -20.455 2.059 -0.911 1.00 0.00 H new ATOM 123 N ASN A 10 -18.653 7.049 -2.159 1.00 0.00 N ATOM 124 CA ASN A 10 -17.348 7.404 -2.702 1.00 0.00 C ATOM 125 C ASN A 10 -16.272 6.462 -2.175 1.00 0.00 C ATOM 126 O ASN A 10 -16.209 6.186 -0.977 1.00 0.00 O ATOM 127 CB ASN A 10 -16.999 8.851 -2.345 1.00 0.00 C ATOM 128 CG ASN A 10 -17.763 9.855 -3.187 1.00 0.00 C ATOM 129 OD1 ASN A 10 -18.262 9.528 -4.264 1.00 0.00 O ATOM 130 ND2 ASN A 10 -17.857 11.086 -2.698 1.00 0.00 N ATOM 0 H ASN A 10 -18.794 7.323 -1.187 1.00 0.00 H new ATOM 0 HA ASN A 10 -17.392 7.309 -3.787 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -17.216 9.025 -1.291 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -15.929 9.008 -2.480 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -18.358 11.805 -3.220 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -17.428 11.313 -1.801 1.00 0.00 H new ATOM 137 N THR A 11 -15.431 5.967 -3.076 1.00 0.00 N ATOM 138 CA THR A 11 -14.362 5.050 -2.698 1.00 0.00 C ATOM 139 C THR A 11 -13.010 5.549 -3.194 1.00 0.00 C ATOM 140 O THR A 11 -12.930 6.299 -4.167 1.00 0.00 O ATOM 141 CB THR A 11 -14.640 3.654 -3.255 1.00 0.00 C ATOM 142 OG1 THR A 11 -14.883 3.709 -4.650 1.00 0.00 O ATOM 143 CG2 THR A 11 -15.829 2.977 -2.608 1.00 0.00 C ATOM 0 H THR A 11 -15.468 6.185 -4.072 1.00 0.00 H new ATOM 0 HA THR A 11 -14.330 5.001 -1.610 1.00 0.00 H new ATOM 0 HB THR A 11 -13.746 3.072 -3.033 1.00 0.00 H new ATOM 0 HG1 THR A 11 -14.159 3.252 -5.126 1.00 0.00 H new ATOM 0 HG21 THR A 11 -15.971 1.990 -3.049 1.00 0.00 H new ATOM 0 HG22 THR A 11 -15.651 2.873 -1.538 1.00 0.00 H new ATOM 0 HG23 THR A 11 -16.723 3.579 -2.770 1.00 0.00 H new ATOM 151 N GLN A 12 -11.949 5.124 -2.517 1.00 0.00 N ATOM 152 CA GLN A 12 -10.595 5.521 -2.881 1.00 0.00 C ATOM 153 C GLN A 12 -9.632 4.336 -2.745 1.00 0.00 C ATOM 154 O GLN A 12 -9.407 3.848 -1.637 1.00 0.00 O ATOM 155 CB GLN A 12 -10.127 6.672 -1.991 1.00 0.00 C ATOM 156 CG GLN A 12 -11.052 7.878 -2.018 1.00 0.00 C ATOM 157 CD GLN A 12 -10.979 8.643 -3.325 1.00 0.00 C ATOM 158 OE1 GLN A 12 -10.436 8.152 -4.315 1.00 0.00 O ATOM 159 NE2 GLN A 12 -11.527 9.852 -3.334 1.00 0.00 N ATOM 0 H GLN A 12 -12.002 4.502 -1.710 1.00 0.00 H new ATOM 0 HA GLN A 12 -10.601 5.851 -3.920 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -10.040 6.314 -0.965 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -9.131 6.982 -2.306 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -12.077 7.548 -1.852 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -10.795 8.546 -1.196 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -11.966 10.219 -2.490 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -11.509 10.414 -4.185 1.00 0.00 H new ATOM 168 N PRO A 13 -9.048 3.847 -3.861 1.00 0.00 N ATOM 169 CA PRO A 13 -9.276 4.387 -5.212 1.00 0.00 C ATOM 170 C PRO A 13 -10.716 4.204 -5.678 1.00 0.00 C ATOM 171 O PRO A 13 -11.460 3.388 -5.134 1.00 0.00 O ATOM 172 CB PRO A 13 -8.324 3.575 -6.095 1.00 0.00 C ATOM 173 CG PRO A 13 -8.065 2.325 -5.328 1.00 0.00 C ATOM 174 CD PRO A 13 -8.105 2.716 -3.880 1.00 0.00 C ATOM 0 HA PRO A 13 -9.098 5.462 -5.249 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -8.772 3.358 -7.065 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -7.400 4.120 -6.286 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -8.817 1.568 -5.549 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -7.097 1.899 -5.591 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -8.449 1.895 -3.251 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -7.120 3.007 -3.514 1.00 0.00 H new ATOM 182 N SER A 14 -11.100 4.975 -6.689 1.00 0.00 N ATOM 183 CA SER A 14 -12.451 4.910 -7.237 1.00 0.00 C ATOM 184 C SER A 14 -12.804 3.489 -7.666 1.00 0.00 C ATOM 185 O SER A 14 -13.857 2.966 -7.303 1.00 0.00 O ATOM 186 CB SER A 14 -12.586 5.863 -8.427 1.00 0.00 C ATOM 187 OG SER A 14 -13.811 6.575 -8.375 1.00 0.00 O ATOM 0 H SER A 14 -10.493 5.655 -7.147 1.00 0.00 H new ATOM 0 HA SER A 14 -13.146 5.213 -6.454 1.00 0.00 H new ATOM 0 HB2 SER A 14 -11.753 6.566 -8.430 1.00 0.00 H new ATOM 0 HB3 SER A 14 -12.529 5.298 -9.357 1.00 0.00 H new ATOM 0 HG SER A 14 -13.872 7.178 -9.145 1.00 0.00 H new ATOM 193 N GLN A 15 -11.921 2.869 -8.443 1.00 0.00 N ATOM 194 CA GLN A 15 -12.151 1.509 -8.920 1.00 0.00 C ATOM 195 C GLN A 15 -10.882 0.919 -9.530 1.00 0.00 C ATOM 196 O GLN A 15 -10.920 0.327 -10.610 1.00 0.00 O ATOM 197 CB GLN A 15 -13.278 1.495 -9.954 1.00 0.00 C ATOM 198 CG GLN A 15 -12.975 2.317 -11.196 1.00 0.00 C ATOM 199 CD GLN A 15 -14.228 2.856 -11.860 1.00 0.00 C ATOM 200 OE1 GLN A 15 -15.327 2.746 -11.318 1.00 0.00 O ATOM 201 NE2 GLN A 15 -14.065 3.440 -13.042 1.00 0.00 N ATOM 0 H GLN A 15 -11.043 3.284 -8.755 1.00 0.00 H new ATOM 0 HA GLN A 15 -12.439 0.897 -8.065 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -13.476 0.465 -10.250 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -14.189 1.874 -9.491 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -12.325 3.149 -10.926 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -12.426 1.702 -11.909 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -13.134 3.508 -13.453 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -14.871 3.820 -13.539 1.00 0.00 H new ATOM 210 N LYS A 16 -9.764 1.081 -8.834 1.00 0.00 N ATOM 211 CA LYS A 16 -8.486 0.561 -9.310 1.00 0.00 C ATOM 212 C LYS A 16 -7.467 0.499 -8.177 1.00 0.00 C ATOM 213 O LYS A 16 -6.954 1.527 -7.735 1.00 0.00 O ATOM 214 CB LYS A 16 -7.949 1.428 -10.449 1.00 0.00 C ATOM 215 CG LYS A 16 -7.358 0.625 -11.598 1.00 0.00 C ATOM 216 CD LYS A 16 -6.961 1.524 -12.758 1.00 0.00 C ATOM 217 CE LYS A 16 -5.897 0.873 -13.627 1.00 0.00 C ATOM 218 NZ LYS A 16 -5.419 1.790 -14.699 1.00 0.00 N ATOM 0 H LYS A 16 -9.715 1.568 -7.939 1.00 0.00 H new ATOM 0 HA LYS A 16 -8.651 -0.450 -9.681 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -8.756 2.053 -10.831 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -7.186 2.099 -10.055 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -6.485 0.074 -11.248 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -8.084 -0.113 -11.940 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -7.839 1.749 -13.363 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -6.588 2.473 -12.373 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -5.054 0.571 -13.005 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -6.301 -0.033 -14.078 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -4.695 1.309 -15.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -6.218 2.058 -15.308 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -5.010 2.644 -14.269 1.00 0.00 H new ATOM 232 N ILE A 17 -7.176 -0.712 -7.713 1.00 0.00 N ATOM 233 CA ILE A 17 -6.217 -0.906 -6.633 1.00 0.00 C ATOM 234 C ILE A 17 -5.203 -1.990 -6.986 1.00 0.00 C ATOM 235 O ILE A 17 -5.574 -3.116 -7.317 1.00 0.00 O ATOM 236 CB ILE A 17 -6.921 -1.291 -5.318 1.00 0.00 C ATOM 237 CG1 ILE A 17 -5.896 -1.457 -4.195 1.00 0.00 C ATOM 238 CG2 ILE A 17 -7.724 -2.569 -5.502 1.00 0.00 C ATOM 239 CD1 ILE A 17 -6.512 -1.821 -2.862 1.00 0.00 C ATOM 0 H ILE A 17 -7.591 -1.573 -8.068 1.00 0.00 H new ATOM 0 HA ILE A 17 -5.700 0.044 -6.497 1.00 0.00 H new ATOM 0 HB ILE A 17 -7.607 -0.490 -5.043 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -5.181 -2.229 -4.478 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -5.336 -0.528 -4.086 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -8.216 -2.828 -4.564 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -8.476 -2.418 -6.276 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -7.057 -3.379 -5.798 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -5.726 -1.922 -2.114 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -7.206 -1.038 -2.556 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -7.048 -2.765 -2.955 1.00 0.00 H new ATOM 251 N VAL A 18 -3.923 -1.643 -6.908 1.00 0.00 N ATOM 252 CA VAL A 18 -2.858 -2.589 -7.217 1.00 0.00 C ATOM 253 C VAL A 18 -1.918 -2.765 -6.033 1.00 0.00 C ATOM 254 O VAL A 18 -1.050 -1.925 -5.789 1.00 0.00 O ATOM 255 CB VAL A 18 -2.034 -2.136 -8.437 1.00 0.00 C ATOM 256 CG1 VAL A 18 -1.414 -0.771 -8.184 1.00 0.00 C ATOM 257 CG2 VAL A 18 -0.960 -3.163 -8.766 1.00 0.00 C ATOM 0 H VAL A 18 -3.599 -0.716 -6.634 1.00 0.00 H new ATOM 0 HA VAL A 18 -3.342 -3.539 -7.444 1.00 0.00 H new ATOM 0 HB VAL A 18 -2.702 -2.054 -9.294 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -0.835 -0.467 -9.056 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -2.203 -0.042 -7.999 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -0.759 -0.825 -7.315 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -0.388 -2.827 -9.630 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -0.293 -3.278 -7.912 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -1.429 -4.121 -8.992 1.00 0.00 H new ATOM 267 N PHE A 19 -2.084 -3.864 -5.302 1.00 0.00 N ATOM 268 CA PHE A 19 -1.237 -4.149 -4.146 1.00 0.00 C ATOM 269 C PHE A 19 0.234 -3.945 -4.496 1.00 0.00 C ATOM 270 O PHE A 19 0.597 -3.890 -5.670 1.00 0.00 O ATOM 271 CB PHE A 19 -1.466 -5.581 -3.658 1.00 0.00 C ATOM 272 CG PHE A 19 -2.870 -5.839 -3.192 1.00 0.00 C ATOM 273 CD1 PHE A 19 -3.596 -4.848 -2.554 1.00 0.00 C ATOM 274 CD2 PHE A 19 -3.463 -7.075 -3.393 1.00 0.00 C ATOM 275 CE1 PHE A 19 -4.888 -5.083 -2.123 1.00 0.00 C ATOM 276 CE2 PHE A 19 -4.755 -7.317 -2.964 1.00 0.00 C ATOM 277 CZ PHE A 19 -5.468 -6.319 -2.328 1.00 0.00 C ATOM 0 H PHE A 19 -2.795 -4.571 -5.488 1.00 0.00 H new ATOM 0 HA PHE A 19 -1.504 -3.458 -3.347 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -1.227 -6.274 -4.465 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -0.776 -5.792 -2.841 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -3.147 -3.879 -2.391 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -2.910 -7.858 -3.890 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -5.443 -4.301 -1.627 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -5.206 -8.285 -3.126 1.00 0.00 H new ATOM 0 HZ PHE A 19 -6.477 -6.505 -1.992 1.00 0.00 H new ATOM 287 N ASN A 20 1.076 -3.822 -3.477 1.00 0.00 N ATOM 288 CA ASN A 20 2.501 -3.612 -3.700 1.00 0.00 C ATOM 289 C ASN A 20 3.338 -4.693 -3.027 1.00 0.00 C ATOM 290 O ASN A 20 3.307 -4.850 -1.807 1.00 0.00 O ATOM 291 CB ASN A 20 2.919 -2.234 -3.184 1.00 0.00 C ATOM 292 CG ASN A 20 2.452 -1.113 -4.091 1.00 0.00 C ATOM 293 OD1 ASN A 20 3.020 -0.886 -5.159 1.00 0.00 O ATOM 294 ND2 ASN A 20 1.412 -0.403 -3.667 1.00 0.00 N ATOM 0 H ASN A 20 0.800 -3.864 -2.496 1.00 0.00 H new ATOM 0 HA ASN A 20 2.680 -3.667 -4.774 1.00 0.00 H new ATOM 0 HB2 ASN A 20 2.510 -2.084 -2.185 1.00 0.00 H new ATOM 0 HB3 ASN A 20 4.005 -2.197 -3.094 1.00 0.00 H new ATOM 0 HD21 ASN A 20 1.054 0.366 -4.234 1.00 0.00 H new ATOM 0 HD22 ASN A 20 0.972 -0.627 -2.774 1.00 0.00 H new ATOM 301 N ALA A 21 4.097 -5.428 -3.836 1.00 0.00 N ATOM 302 CA ALA A 21 4.959 -6.489 -3.326 1.00 0.00 C ATOM 303 C ALA A 21 5.801 -5.986 -2.151 1.00 0.00 C ATOM 304 O ALA A 21 5.819 -4.788 -1.871 1.00 0.00 O ATOM 305 CB ALA A 21 5.856 -7.008 -4.442 1.00 0.00 C ATOM 0 H ALA A 21 4.132 -5.308 -4.848 1.00 0.00 H new ATOM 0 HA ALA A 21 4.333 -7.306 -2.967 1.00 0.00 H new ATOM 0 HB1 ALA A 21 6.497 -7.800 -4.055 1.00 0.00 H new ATOM 0 HB2 ALA A 21 5.240 -7.402 -5.250 1.00 0.00 H new ATOM 0 HB3 ALA A 21 6.474 -6.194 -4.821 1.00 0.00 H new ATOM 311 N PRO A 22 6.511 -6.885 -1.439 1.00 0.00 N ATOM 312 CA PRO A 22 6.530 -8.327 -1.723 1.00 0.00 C ATOM 313 C PRO A 22 5.272 -9.038 -1.245 1.00 0.00 C ATOM 314 O PRO A 22 4.506 -8.501 -0.444 1.00 0.00 O ATOM 315 CB PRO A 22 7.744 -8.816 -0.936 1.00 0.00 C ATOM 316 CG PRO A 22 7.836 -7.884 0.222 1.00 0.00 C ATOM 317 CD PRO A 22 7.365 -6.545 -0.283 1.00 0.00 C ATOM 0 HA PRO A 22 6.577 -8.530 -2.793 1.00 0.00 H new ATOM 0 HB2 PRO A 22 7.615 -9.847 -0.607 1.00 0.00 H new ATOM 0 HB3 PRO A 22 8.649 -8.786 -1.543 1.00 0.00 H new ATOM 0 HG2 PRO A 22 7.216 -8.228 1.050 1.00 0.00 H new ATOM 0 HG3 PRO A 22 8.859 -7.823 0.593 1.00 0.00 H new ATOM 0 HD2 PRO A 22 6.807 -6.003 0.481 1.00 0.00 H new ATOM 0 HD3 PRO A 22 8.202 -5.911 -0.577 1.00 0.00 H new ATOM 325 N TYR A 23 5.069 -10.252 -1.743 1.00 0.00 N ATOM 326 CA TYR A 23 3.906 -11.049 -1.371 1.00 0.00 C ATOM 327 C TYR A 23 4.324 -12.274 -0.567 1.00 0.00 C ATOM 328 O TYR A 23 3.792 -13.367 -0.763 1.00 0.00 O ATOM 329 CB TYR A 23 3.137 -11.475 -2.620 1.00 0.00 C ATOM 330 CG TYR A 23 2.646 -10.307 -3.442 1.00 0.00 C ATOM 331 CD1 TYR A 23 2.141 -9.170 -2.827 1.00 0.00 C ATOM 332 CD2 TYR A 23 2.692 -10.340 -4.829 1.00 0.00 C ATOM 333 CE1 TYR A 23 1.694 -8.096 -3.571 1.00 0.00 C ATOM 334 CE2 TYR A 23 2.247 -9.269 -5.581 1.00 0.00 C ATOM 335 CZ TYR A 23 1.748 -8.150 -4.948 1.00 0.00 C ATOM 336 OH TYR A 23 1.305 -7.082 -5.691 1.00 0.00 O ATOM 0 H TYR A 23 5.696 -10.707 -2.407 1.00 0.00 H new ATOM 0 HA TYR A 23 3.256 -10.436 -0.747 1.00 0.00 H new ATOM 0 HB2 TYR A 23 3.779 -12.102 -3.238 1.00 0.00 H new ATOM 0 HB3 TYR A 23 2.285 -12.086 -2.323 1.00 0.00 H new ATOM 0 HD1 TYR A 23 2.097 -9.124 -1.749 1.00 0.00 H new ATOM 0 HD2 TYR A 23 3.081 -11.215 -5.328 1.00 0.00 H new ATOM 0 HE1 TYR A 23 1.304 -7.218 -3.077 1.00 0.00 H new ATOM 0 HE2 TYR A 23 2.290 -9.308 -6.659 1.00 0.00 H new ATOM 0 HH TYR A 23 1.712 -6.257 -5.353 1.00 0.00 H new ATOM 346 N ASP A 24 5.277 -12.083 0.337 1.00 0.00 N ATOM 347 CA ASP A 24 5.767 -13.169 1.176 1.00 0.00 C ATOM 348 C ASP A 24 5.297 -13.012 2.623 1.00 0.00 C ATOM 349 O ASP A 24 5.719 -13.765 3.502 1.00 0.00 O ATOM 350 CB ASP A 24 7.294 -13.221 1.130 1.00 0.00 C ATOM 351 CG ASP A 24 7.839 -14.593 1.478 1.00 0.00 C ATOM 352 OD1 ASP A 24 7.120 -15.366 2.147 1.00 0.00 O ATOM 353 OD2 ASP A 24 8.984 -14.895 1.082 1.00 0.00 O ATOM 0 H ASP A 24 5.727 -11.184 0.508 1.00 0.00 H new ATOM 0 HA ASP A 24 5.360 -14.102 0.786 1.00 0.00 H new ATOM 0 HB2 ASP A 24 7.634 -12.941 0.133 1.00 0.00 H new ATOM 0 HB3 ASP A 24 7.700 -12.485 1.824 1.00 0.00 H new ATOM 358 N ASP A 25 4.428 -12.033 2.872 1.00 0.00 N ATOM 359 CA ASP A 25 3.917 -11.795 4.218 1.00 0.00 C ATOM 360 C ASP A 25 2.476 -11.296 4.172 1.00 0.00 C ATOM 361 O ASP A 25 1.782 -11.467 3.171 1.00 0.00 O ATOM 362 CB ASP A 25 4.800 -10.782 4.947 1.00 0.00 C ATOM 363 CG ASP A 25 5.224 -11.267 6.319 1.00 0.00 C ATOM 364 OD1 ASP A 25 4.379 -11.263 7.238 1.00 0.00 O ATOM 365 OD2 ASP A 25 6.402 -11.653 6.475 1.00 0.00 O ATOM 0 H ASP A 25 4.066 -11.396 2.163 1.00 0.00 H new ATOM 0 HA ASP A 25 3.936 -12.740 4.762 1.00 0.00 H new ATOM 0 HB2 ASP A 25 5.687 -10.578 4.347 1.00 0.00 H new ATOM 0 HB3 ASP A 25 4.261 -9.840 5.048 1.00 0.00 H new ATOM 370 N LYS A 26 2.032 -10.681 5.264 1.00 0.00 N ATOM 371 CA LYS A 26 0.672 -10.161 5.348 1.00 0.00 C ATOM 372 C LYS A 26 0.642 -8.656 5.102 1.00 0.00 C ATOM 373 O LYS A 26 1.144 -7.874 5.910 1.00 0.00 O ATOM 374 CB LYS A 26 0.067 -10.476 6.717 1.00 0.00 C ATOM 375 CG LYS A 26 -0.077 -11.965 6.991 1.00 0.00 C ATOM 376 CD LYS A 26 0.483 -12.336 8.355 1.00 0.00 C ATOM 377 CE LYS A 26 -0.567 -13.013 9.221 1.00 0.00 C ATOM 378 NZ LYS A 26 -0.417 -12.654 10.658 1.00 0.00 N ATOM 0 H LYS A 26 2.594 -10.531 6.102 1.00 0.00 H new ATOM 0 HA LYS A 26 0.079 -10.647 4.573 1.00 0.00 H new ATOM 0 HB2 LYS A 26 0.691 -10.031 7.492 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -0.914 -10.005 6.789 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -1.129 -12.246 6.940 1.00 0.00 H new ATOM 0 HG3 LYS A 26 0.442 -12.531 6.217 1.00 0.00 H new ATOM 0 HD2 LYS A 26 1.338 -13.001 8.230 1.00 0.00 H new ATOM 0 HD3 LYS A 26 0.847 -11.439 8.856 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -1.561 -12.727 8.877 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -0.490 -14.094 9.107 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -1.152 -13.136 11.215 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 0.522 -12.950 10.994 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -0.516 -11.625 10.771 1.00 0.00 H new ATOM 392 N HIS A 27 0.045 -8.257 3.983 1.00 0.00 N ATOM 393 CA HIS A 27 -0.056 -6.845 3.631 1.00 0.00 C ATOM 394 C HIS A 27 -1.509 -6.383 3.685 1.00 0.00 C ATOM 395 O HIS A 27 -2.362 -6.906 2.968 1.00 0.00 O ATOM 396 CB HIS A 27 0.519 -6.601 2.236 1.00 0.00 C ATOM 397 CG HIS A 27 2.006 -6.426 2.223 1.00 0.00 C ATOM 398 ND1 HIS A 27 2.841 -6.880 3.221 1.00 0.00 N ATOM 399 CD2 HIS A 27 2.809 -5.830 1.306 1.00 0.00 C ATOM 400 CE1 HIS A 27 4.096 -6.553 2.886 1.00 0.00 C ATOM 401 NE2 HIS A 27 4.132 -5.915 1.731 1.00 0.00 N ATOM 0 H HIS A 27 -0.376 -8.892 3.305 1.00 0.00 H new ATOM 0 HA HIS A 27 0.521 -6.270 4.355 1.00 0.00 H new ATOM 0 HB2 HIS A 27 0.255 -7.439 1.591 1.00 0.00 H new ATOM 0 HB3 HIS A 27 0.053 -5.712 1.810 1.00 0.00 H new ATOM 0 HD2 HIS A 27 2.475 -5.363 0.391 1.00 0.00 H new ATOM 0 HE1 HIS A 27 4.966 -6.782 3.484 1.00 0.00 H new ATOM 0 HE2 HIS A 27 4.958 -5.558 1.250 1.00 0.00 H new ATOM 409 N THR A 28 -1.785 -5.409 4.545 1.00 0.00 N ATOM 410 CA THR A 28 -3.139 -4.888 4.697 1.00 0.00 C ATOM 411 C THR A 28 -3.294 -3.531 4.016 1.00 0.00 C ATOM 412 O THR A 28 -2.697 -2.541 4.437 1.00 0.00 O ATOM 413 CB THR A 28 -3.494 -4.768 6.180 1.00 0.00 C ATOM 414 OG1 THR A 28 -2.723 -5.667 6.955 1.00 0.00 O ATOM 415 CG2 THR A 28 -4.953 -5.047 6.471 1.00 0.00 C ATOM 0 H THR A 28 -1.091 -4.965 5.146 1.00 0.00 H new ATOM 0 HA THR A 28 -3.821 -5.589 4.216 1.00 0.00 H new ATOM 0 HB THR A 28 -3.278 -3.733 6.445 1.00 0.00 H new ATOM 0 HG1 THR A 28 -2.964 -5.574 7.900 1.00 0.00 H new ATOM 0 HG21 THR A 28 -5.137 -4.945 7.541 1.00 0.00 H new ATOM 0 HG22 THR A 28 -5.575 -4.337 5.926 1.00 0.00 H new ATOM 0 HG23 THR A 28 -5.199 -6.061 6.156 1.00 0.00 H new ATOM 423 N TYR A 29 -4.111 -3.493 2.966 1.00 0.00 N ATOM 424 CA TYR A 29 -4.359 -2.259 2.232 1.00 0.00 C ATOM 425 C TYR A 29 -5.744 -1.716 2.565 1.00 0.00 C ATOM 426 O TYR A 29 -6.759 -2.328 2.229 1.00 0.00 O ATOM 427 CB TYR A 29 -4.239 -2.499 0.726 1.00 0.00 C ATOM 428 CG TYR A 29 -3.043 -3.341 0.342 1.00 0.00 C ATOM 429 CD1 TYR A 29 -3.098 -4.728 0.406 1.00 0.00 C ATOM 430 CD2 TYR A 29 -1.861 -2.749 -0.083 1.00 0.00 C ATOM 431 CE1 TYR A 29 -2.007 -5.501 0.056 1.00 0.00 C ATOM 432 CE2 TYR A 29 -0.766 -3.516 -0.434 1.00 0.00 C ATOM 433 CZ TYR A 29 -0.844 -4.890 -0.362 1.00 0.00 C ATOM 434 OH TYR A 29 0.244 -5.657 -0.711 1.00 0.00 O ATOM 0 H TYR A 29 -4.612 -4.305 2.606 1.00 0.00 H new ATOM 0 HA TYR A 29 -3.611 -1.524 2.529 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -5.146 -2.988 0.371 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -4.175 -1.537 0.217 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -4.007 -5.209 0.734 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -1.796 -1.672 -0.140 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -2.065 -6.578 0.110 1.00 0.00 H new ATOM 0 HE2 TYR A 29 0.146 -3.041 -0.763 1.00 0.00 H new ATOM 0 HH TYR A 29 -0.038 -6.587 -0.837 1.00 0.00 H new ATOM 444 N HIS A 30 -5.781 -0.573 3.241 1.00 0.00 N ATOM 445 CA HIS A 30 -7.046 0.038 3.633 1.00 0.00 C ATOM 446 C HIS A 30 -7.636 0.882 2.507 1.00 0.00 C ATOM 447 O HIS A 30 -6.910 1.524 1.748 1.00 0.00 O ATOM 448 CB HIS A 30 -6.851 0.904 4.880 1.00 0.00 C ATOM 449 CG HIS A 30 -6.263 0.162 6.039 1.00 0.00 C ATOM 450 ND1 HIS A 30 -5.846 0.766 7.205 1.00 0.00 N ATOM 451 CD2 HIS A 30 -6.026 -1.165 6.199 1.00 0.00 C ATOM 452 CE1 HIS A 30 -5.378 -0.191 8.018 1.00 0.00 C ATOM 453 NE2 HIS A 30 -5.465 -1.381 7.455 1.00 0.00 N ATOM 0 H HIS A 30 -4.952 -0.052 3.528 1.00 0.00 H new ATOM 0 HA HIS A 30 -7.746 -0.768 3.854 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -6.203 1.744 4.631 1.00 0.00 H new ATOM 0 HB3 HIS A 30 -7.813 1.321 5.177 1.00 0.00 H new ATOM 0 HD2 HIS A 30 -6.239 -1.931 5.468 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -4.981 -0.011 9.006 1.00 0.00 H new ATOM 0 HE2 HIS A 30 -5.180 -2.274 7.857 1.00 0.00 H new ATOM 461 N ILE A 31 -8.963 0.880 2.418 1.00 0.00 N ATOM 462 CA ILE A 31 -9.669 1.649 1.401 1.00 0.00 C ATOM 463 C ILE A 31 -10.531 2.725 2.052 1.00 0.00 C ATOM 464 O ILE A 31 -11.071 2.523 3.140 1.00 0.00 O ATOM 465 CB ILE A 31 -10.562 0.747 0.525 1.00 0.00 C ATOM 466 CG1 ILE A 31 -9.859 -0.583 0.242 1.00 0.00 C ATOM 467 CG2 ILE A 31 -10.917 1.453 -0.775 1.00 0.00 C ATOM 468 CD1 ILE A 31 -10.589 -1.452 -0.761 1.00 0.00 C ATOM 0 H ILE A 31 -9.573 0.351 3.042 1.00 0.00 H new ATOM 0 HA ILE A 31 -8.915 2.114 0.765 1.00 0.00 H new ATOM 0 HB ILE A 31 -11.486 0.540 1.066 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -8.854 -0.382 -0.128 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -9.751 -1.133 1.177 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -11.547 0.803 -1.382 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -11.454 2.375 -0.553 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -10.004 1.687 -1.323 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -10.034 -2.378 -0.913 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -11.585 -1.684 -0.384 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -10.674 -0.921 -1.709 1.00 0.00 H new ATOM 480 N LYS A 32 -10.651 3.871 1.391 1.00 0.00 N ATOM 481 CA LYS A 32 -11.440 4.976 1.925 1.00 0.00 C ATOM 482 C LYS A 32 -12.867 4.958 1.384 1.00 0.00 C ATOM 483 O LYS A 32 -13.085 4.873 0.176 1.00 0.00 O ATOM 484 CB LYS A 32 -10.775 6.312 1.591 1.00 0.00 C ATOM 485 CG LYS A 32 -11.044 7.399 2.618 1.00 0.00 C ATOM 486 CD LYS A 32 -10.473 8.737 2.178 1.00 0.00 C ATOM 487 CE LYS A 32 -11.238 9.897 2.792 1.00 0.00 C ATOM 488 NZ LYS A 32 -11.523 10.966 1.794 1.00 0.00 N ATOM 0 H LYS A 32 -10.214 4.059 0.489 1.00 0.00 H new ATOM 0 HA LYS A 32 -11.487 4.856 3.007 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -9.699 6.162 1.507 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -11.127 6.650 0.616 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -12.118 7.495 2.774 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -10.607 7.113 3.575 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -9.424 8.799 2.466 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -10.510 8.810 1.091 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -12.176 9.532 3.211 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -10.662 10.315 3.617 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -12.046 11.739 2.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -10.628 11.333 1.413 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -12.095 10.574 1.019 1.00 0.00 H new ATOM 502 N ILE A 33 -13.835 5.048 2.292 1.00 0.00 N ATOM 503 CA ILE A 33 -15.245 5.054 1.917 1.00 0.00 C ATOM 504 C ILE A 33 -15.967 6.237 2.553 1.00 0.00 C ATOM 505 O ILE A 33 -15.573 6.714 3.618 1.00 0.00 O ATOM 506 CB ILE A 33 -15.949 3.750 2.339 1.00 0.00 C ATOM 507 CG1 ILE A 33 -15.198 2.537 1.789 1.00 0.00 C ATOM 508 CG2 ILE A 33 -17.393 3.750 1.857 1.00 0.00 C ATOM 509 CD1 ILE A 33 -15.686 1.219 2.349 1.00 0.00 C ATOM 0 H ILE A 33 -13.667 5.118 3.296 1.00 0.00 H new ATOM 0 HA ILE A 33 -15.286 5.139 0.831 1.00 0.00 H new ATOM 0 HB ILE A 33 -15.948 3.689 3.427 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -15.297 2.520 0.704 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -14.136 2.646 2.011 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -17.878 2.823 2.162 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -17.922 4.597 2.293 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -17.414 3.830 0.770 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -15.108 0.403 1.915 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -15.562 1.215 3.432 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -16.740 1.088 2.104 1.00 0.00 H new ATOM 521 N THR A 34 -17.022 6.711 1.898 1.00 0.00 N ATOM 522 CA THR A 34 -17.787 7.842 2.411 1.00 0.00 C ATOM 523 C THR A 34 -19.237 7.790 1.943 1.00 0.00 C ATOM 524 O THR A 34 -19.550 7.188 0.917 1.00 0.00 O ATOM 525 CB THR A 34 -17.144 9.158 1.965 1.00 0.00 C ATOM 526 OG1 THR A 34 -15.861 9.311 2.545 1.00 0.00 O ATOM 527 CG2 THR A 34 -17.961 10.381 2.327 1.00 0.00 C ATOM 0 H THR A 34 -17.365 6.332 1.016 1.00 0.00 H new ATOM 0 HA THR A 34 -17.779 7.785 3.499 1.00 0.00 H new ATOM 0 HB THR A 34 -17.082 9.093 0.879 1.00 0.00 H new ATOM 0 HG1 THR A 34 -15.466 10.157 2.247 1.00 0.00 H new ATOM 0 HG21 THR A 34 -17.447 11.278 1.981 1.00 0.00 H new ATOM 0 HG22 THR A 34 -18.940 10.318 1.852 1.00 0.00 H new ATOM 0 HG23 THR A 34 -18.085 10.428 3.409 1.00 0.00 H new ATOM 535 N ASN A 35 -20.115 8.433 2.706 1.00 0.00 N ATOM 536 CA ASN A 35 -21.534 8.476 2.378 1.00 0.00 C ATOM 537 C ASN A 35 -21.866 9.741 1.594 1.00 0.00 C ATOM 538 O ASN A 35 -22.000 10.822 2.168 1.00 0.00 O ATOM 539 CB ASN A 35 -22.375 8.416 3.655 1.00 0.00 C ATOM 540 CG ASN A 35 -23.038 7.066 3.849 1.00 0.00 C ATOM 541 OD1 ASN A 35 -22.492 6.033 3.464 1.00 0.00 O ATOM 542 ND2 ASN A 35 -24.223 7.072 4.448 1.00 0.00 N ATOM 0 H ASN A 35 -19.866 8.933 3.559 1.00 0.00 H new ATOM 0 HA ASN A 35 -21.769 7.611 1.758 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -21.741 8.633 4.515 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -23.140 9.192 3.619 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -24.719 6.195 4.606 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -24.637 7.954 4.750 1.00 0.00 H new ATOM 549 N ALA A 36 -21.993 9.599 0.278 1.00 0.00 N ATOM 550 CA ALA A 36 -22.304 10.732 -0.588 1.00 0.00 C ATOM 551 C ALA A 36 -23.810 10.902 -0.768 1.00 0.00 C ATOM 552 O ALA A 36 -24.259 11.570 -1.699 1.00 0.00 O ATOM 553 CB ALA A 36 -21.632 10.555 -1.939 1.00 0.00 C ATOM 0 H ALA A 36 -21.885 8.711 -0.212 1.00 0.00 H new ATOM 0 HA ALA A 36 -21.922 11.634 -0.110 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -21.870 11.405 -2.578 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -20.552 10.494 -1.803 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -21.991 9.638 -2.407 1.00 0.00 H new ATOM 559 N GLY A 37 -24.587 10.296 0.124 1.00 0.00 N ATOM 560 CA GLY A 37 -26.031 10.399 0.038 1.00 0.00 C ATOM 561 C GLY A 37 -26.608 11.336 1.080 1.00 0.00 C ATOM 562 O GLY A 37 -25.956 12.295 1.491 1.00 0.00 O ATOM 0 H GLY A 37 -24.242 9.736 0.904 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -26.309 10.750 -0.956 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -26.471 9.409 0.160 1.00 0.00 H new ATOM 566 N GLY A 38 -27.836 11.058 1.508 1.00 0.00 N ATOM 567 CA GLY A 38 -28.479 11.892 2.506 1.00 0.00 C ATOM 568 C GLY A 38 -28.776 11.139 3.787 1.00 0.00 C ATOM 569 O GLY A 38 -28.850 11.734 4.862 1.00 0.00 O ATOM 0 H GLY A 38 -28.396 10.271 1.181 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -27.838 12.745 2.730 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -29.408 12.290 2.098 1.00 0.00 H new ATOM 573 N ARG A 39 -28.948 9.826 3.673 1.00 0.00 N ATOM 574 CA ARG A 39 -29.240 8.987 4.831 1.00 0.00 C ATOM 575 C ARG A 39 -28.236 7.843 4.940 1.00 0.00 C ATOM 576 O ARG A 39 -27.547 7.519 3.973 1.00 0.00 O ATOM 577 CB ARG A 39 -30.660 8.425 4.735 1.00 0.00 C ATOM 578 CG ARG A 39 -31.724 9.489 4.526 1.00 0.00 C ATOM 579 CD ARG A 39 -33.055 8.873 4.122 1.00 0.00 C ATOM 580 NE ARG A 39 -33.593 9.480 2.909 1.00 0.00 N ATOM 581 CZ ARG A 39 -34.040 10.731 2.849 1.00 0.00 C ATOM 582 NH1 ARG A 39 -34.010 11.501 3.928 1.00 0.00 N ATOM 583 NH2 ARG A 39 -34.516 11.213 1.709 1.00 0.00 N ATOM 0 H ARG A 39 -28.890 9.319 2.790 1.00 0.00 H new ATOM 0 HA ARG A 39 -29.160 9.605 5.725 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -30.704 7.712 3.911 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -30.885 7.872 5.647 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -31.851 10.063 5.444 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -31.396 10.187 3.756 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -32.926 7.802 3.965 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -33.771 8.992 4.935 1.00 0.00 H new ATOM 0 HE ARG A 39 -33.628 8.914 2.061 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -33.644 11.134 4.806 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -34.353 12.460 3.880 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -34.540 10.624 0.877 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -34.859 12.173 1.665 1.00 0.00 H new ATOM 597 N ARG A 40 -28.162 7.234 6.118 1.00 0.00 N ATOM 598 CA ARG A 40 -27.243 6.125 6.344 1.00 0.00 C ATOM 599 C ARG A 40 -27.422 5.056 5.272 1.00 0.00 C ATOM 600 O ARG A 40 -28.385 5.089 4.508 1.00 0.00 O ATOM 601 CB ARG A 40 -27.466 5.518 7.731 1.00 0.00 C ATOM 602 CG ARG A 40 -28.830 4.868 7.899 1.00 0.00 C ATOM 603 CD ARG A 40 -29.142 4.601 9.363 1.00 0.00 C ATOM 604 NE ARG A 40 -29.318 5.838 10.119 1.00 0.00 N ATOM 605 CZ ARG A 40 -29.836 5.885 11.343 1.00 0.00 C ATOM 606 NH1 ARG A 40 -30.223 4.769 11.945 1.00 0.00 N ATOM 607 NH2 ARG A 40 -29.967 7.049 11.966 1.00 0.00 N ATOM 0 H ARG A 40 -28.726 7.489 6.929 1.00 0.00 H new ATOM 0 HA ARG A 40 -26.224 6.509 6.289 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -26.692 4.774 7.921 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -27.350 6.298 8.483 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -29.598 5.515 7.474 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -28.859 3.931 7.343 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -30.048 3.999 9.437 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -28.335 4.018 9.805 1.00 0.00 H new ATOM 0 HE ARG A 40 -29.028 6.714 9.684 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -30.124 3.872 11.469 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -30.620 4.807 12.884 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -29.670 7.910 11.506 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -30.365 7.083 12.905 1.00 0.00 H new ATOM 621 N ILE A 41 -26.490 4.109 5.217 1.00 0.00 N ATOM 622 CA ILE A 41 -26.555 3.040 4.228 1.00 0.00 C ATOM 623 C ILE A 41 -25.826 1.789 4.704 1.00 0.00 C ATOM 624 O ILE A 41 -24.671 1.852 5.125 1.00 0.00 O ATOM 625 CB ILE A 41 -25.948 3.480 2.884 1.00 0.00 C ATOM 626 CG1 ILE A 41 -24.452 3.757 3.041 1.00 0.00 C ATOM 627 CG2 ILE A 41 -26.666 4.710 2.352 1.00 0.00 C ATOM 628 CD1 ILE A 41 -23.813 4.343 1.800 1.00 0.00 C ATOM 0 H ILE A 41 -25.685 4.061 5.842 1.00 0.00 H new ATOM 0 HA ILE A 41 -27.612 2.811 4.093 1.00 0.00 H new ATOM 0 HB ILE A 41 -26.076 2.671 2.165 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -24.303 4.443 3.875 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -23.943 2.828 3.298 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -26.223 5.007 1.401 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -27.721 4.480 2.205 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -26.569 5.526 3.068 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -22.752 4.514 1.983 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -23.930 3.649 0.968 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -24.296 5.289 1.554 1.00 0.00 H new ATOM 640 N GLY A 42 -26.502 0.649 4.613 1.00 0.00 N ATOM 641 CA GLY A 42 -25.899 -0.606 5.016 1.00 0.00 C ATOM 642 C GLY A 42 -25.020 -1.176 3.923 1.00 0.00 C ATOM 643 O GLY A 42 -25.519 -1.663 2.908 1.00 0.00 O ATOM 0 H GLY A 42 -27.458 0.573 4.267 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -25.306 -0.453 5.918 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -26.681 -1.323 5.266 1.00 0.00 H new ATOM 647 N TRP A 43 -23.708 -1.096 4.116 1.00 0.00 N ATOM 648 CA TRP A 43 -22.765 -1.592 3.121 1.00 0.00 C ATOM 649 C TRP A 43 -22.146 -2.922 3.537 1.00 0.00 C ATOM 650 O TRP A 43 -22.084 -3.253 4.721 1.00 0.00 O ATOM 651 CB TRP A 43 -21.664 -0.559 2.879 1.00 0.00 C ATOM 652 CG TRP A 43 -20.875 -0.232 4.109 1.00 0.00 C ATOM 653 CD1 TRP A 43 -21.192 0.690 5.064 1.00 0.00 C ATOM 654 CD2 TRP A 43 -19.637 -0.825 4.517 1.00 0.00 C ATOM 655 NE1 TRP A 43 -20.227 0.707 6.042 1.00 0.00 N ATOM 656 CE2 TRP A 43 -19.262 -0.215 5.729 1.00 0.00 C ATOM 657 CE3 TRP A 43 -18.810 -1.814 3.977 1.00 0.00 C ATOM 658 CZ2 TRP A 43 -18.096 -0.560 6.407 1.00 0.00 C ATOM 659 CZ3 TRP A 43 -17.654 -2.156 4.651 1.00 0.00 C ATOM 660 CH2 TRP A 43 -17.306 -1.531 5.855 1.00 0.00 C ATOM 0 H TRP A 43 -23.275 -0.695 4.948 1.00 0.00 H new ATOM 0 HA TRP A 43 -23.320 -1.758 2.198 1.00 0.00 H new ATOM 0 HB2 TRP A 43 -20.987 -0.933 2.111 1.00 0.00 H new ATOM 0 HB3 TRP A 43 -22.113 0.355 2.490 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -22.073 1.315 5.053 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -20.228 1.308 6.866 1.00 0.00 H new ATOM 0 HE3 TRP A 43 -19.070 -2.302 3.049 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -17.825 -0.079 7.335 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 -17.007 -2.918 4.243 1.00 0.00 H new ATOM 0 HH2 TRP A 43 -16.395 -1.821 6.358 1.00 0.00 H new ATOM 671 N ALA A 44 -21.682 -3.670 2.544 1.00 0.00 N ATOM 672 CA ALA A 44 -21.050 -4.963 2.769 1.00 0.00 C ATOM 673 C ALA A 44 -19.990 -5.219 1.703 1.00 0.00 C ATOM 674 O ALA A 44 -20.060 -4.667 0.605 1.00 0.00 O ATOM 675 CB ALA A 44 -22.092 -6.072 2.763 1.00 0.00 C ATOM 0 H ALA A 44 -21.733 -3.398 1.562 1.00 0.00 H new ATOM 0 HA ALA A 44 -20.567 -4.953 3.746 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -21.603 -7.031 2.932 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -22.820 -5.891 3.554 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -22.600 -6.089 1.799 1.00 0.00 H new ATOM 681 N ILE A 45 -19.006 -6.045 2.032 1.00 0.00 N ATOM 682 CA ILE A 45 -17.932 -6.352 1.095 1.00 0.00 C ATOM 683 C ILE A 45 -17.744 -7.856 0.925 1.00 0.00 C ATOM 684 O ILE A 45 -17.778 -8.612 1.895 1.00 0.00 O ATOM 685 CB ILE A 45 -16.599 -5.732 1.556 1.00 0.00 C ATOM 686 CG1 ILE A 45 -16.827 -4.313 2.078 1.00 0.00 C ATOM 687 CG2 ILE A 45 -15.593 -5.729 0.415 1.00 0.00 C ATOM 688 CD1 ILE A 45 -17.262 -3.337 1.008 1.00 0.00 C ATOM 0 H ILE A 45 -18.928 -6.513 2.935 1.00 0.00 H new ATOM 0 HA ILE A 45 -18.223 -5.921 0.137 1.00 0.00 H new ATOM 0 HB ILE A 45 -16.194 -6.337 2.368 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -17.584 -4.341 2.862 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -15.906 -3.951 2.536 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -14.657 -5.288 0.757 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -15.413 -6.752 0.086 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -15.987 -5.145 -0.416 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -17.405 -2.351 1.451 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -16.496 -3.280 0.235 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -18.199 -3.675 0.566 1.00 0.00 H new ATOM 700 N LYS A 46 -17.538 -8.277 -0.319 1.00 0.00 N ATOM 701 CA LYS A 46 -17.333 -9.688 -0.627 1.00 0.00 C ATOM 702 C LYS A 46 -16.291 -9.852 -1.728 1.00 0.00 C ATOM 703 O LYS A 46 -16.375 -9.212 -2.775 1.00 0.00 O ATOM 704 CB LYS A 46 -18.648 -10.342 -1.053 1.00 0.00 C ATOM 705 CG LYS A 46 -19.742 -10.251 -0.002 1.00 0.00 C ATOM 706 CD LYS A 46 -21.051 -10.835 -0.510 1.00 0.00 C ATOM 707 CE LYS A 46 -20.882 -12.280 -0.953 1.00 0.00 C ATOM 708 NZ LYS A 46 -22.141 -13.059 -0.800 1.00 0.00 N ATOM 0 H LYS A 46 -17.509 -7.660 -1.131 1.00 0.00 H new ATOM 0 HA LYS A 46 -16.971 -10.182 0.275 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -18.998 -9.870 -1.971 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -18.464 -11.391 -1.284 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -19.430 -10.782 0.897 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -19.892 -9.209 0.280 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -21.804 -10.780 0.276 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -21.417 -10.238 -1.345 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -20.564 -12.305 -1.995 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -20.092 -12.749 -0.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -21.983 -14.038 -1.113 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -22.431 -13.057 0.199 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -22.889 -12.627 -1.379 1.00 0.00 H new ATOM 722 N THR A 47 -15.307 -10.710 -1.485 1.00 0.00 N ATOM 723 CA THR A 47 -14.245 -10.952 -2.456 1.00 0.00 C ATOM 724 C THR A 47 -14.443 -12.287 -3.165 1.00 0.00 C ATOM 725 O THR A 47 -15.110 -13.185 -2.650 1.00 0.00 O ATOM 726 CB THR A 47 -12.881 -10.928 -1.766 1.00 0.00 C ATOM 727 OG1 THR A 47 -12.747 -12.024 -0.879 1.00 0.00 O ATOM 728 CG2 THR A 47 -12.633 -9.663 -0.973 1.00 0.00 C ATOM 0 H THR A 47 -15.222 -11.250 -0.624 1.00 0.00 H new ATOM 0 HA THR A 47 -14.285 -10.158 -3.202 1.00 0.00 H new ATOM 0 HB THR A 47 -12.150 -10.981 -2.572 1.00 0.00 H new ATOM 0 HG1 THR A 47 -12.136 -12.685 -1.266 1.00 0.00 H new ATOM 0 HG21 THR A 47 -11.648 -9.711 -0.509 1.00 0.00 H new ATOM 0 HG22 THR A 47 -12.679 -8.801 -1.639 1.00 0.00 H new ATOM 0 HG23 THR A 47 -13.394 -9.564 -0.199 1.00 0.00 H new ATOM 736 N THR A 48 -13.854 -12.411 -4.351 1.00 0.00 N ATOM 737 CA THR A 48 -13.956 -13.634 -5.138 1.00 0.00 C ATOM 738 C THR A 48 -13.656 -14.860 -4.280 1.00 0.00 C ATOM 739 O THR A 48 -14.148 -15.957 -4.548 1.00 0.00 O ATOM 740 CB THR A 48 -12.991 -13.580 -6.324 1.00 0.00 C ATOM 741 OG1 THR A 48 -11.852 -12.801 -6.007 1.00 0.00 O ATOM 742 CG2 THR A 48 -13.612 -12.997 -7.575 1.00 0.00 C ATOM 0 H THR A 48 -13.299 -11.676 -4.789 1.00 0.00 H new ATOM 0 HA THR A 48 -14.977 -13.715 -5.510 1.00 0.00 H new ATOM 0 HB THR A 48 -12.719 -14.617 -6.523 1.00 0.00 H new ATOM 0 HG1 THR A 48 -11.051 -13.228 -6.376 1.00 0.00 H new ATOM 0 HG21 THR A 48 -12.874 -12.988 -8.377 1.00 0.00 H new ATOM 0 HG22 THR A 48 -14.466 -13.605 -7.874 1.00 0.00 H new ATOM 0 HG23 THR A 48 -13.944 -11.978 -7.376 1.00 0.00 H new ATOM 750 N ASN A 49 -12.846 -14.662 -3.246 1.00 0.00 N ATOM 751 CA ASN A 49 -12.476 -15.745 -2.341 1.00 0.00 C ATOM 752 C ASN A 49 -12.378 -15.239 -0.907 1.00 0.00 C ATOM 753 O ASN A 49 -11.560 -14.373 -0.598 1.00 0.00 O ATOM 754 CB ASN A 49 -11.145 -16.363 -2.770 1.00 0.00 C ATOM 755 CG ASN A 49 -11.333 -17.634 -3.576 1.00 0.00 C ATOM 756 OD1 ASN A 49 -12.393 -18.259 -3.536 1.00 0.00 O ATOM 757 ND2 ASN A 49 -10.300 -18.024 -4.314 1.00 0.00 N ATOM 0 H ASN A 49 -12.432 -13.759 -3.013 1.00 0.00 H new ATOM 0 HA ASN A 49 -13.252 -16.509 -2.387 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -10.585 -15.639 -3.363 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -10.547 -16.582 -1.885 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -10.367 -18.872 -4.877 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -9.440 -17.476 -4.318 1.00 0.00 H new ATOM 764 N MET A 50 -13.216 -15.788 -0.034 1.00 0.00 N ATOM 765 CA MET A 50 -13.222 -15.394 1.370 1.00 0.00 C ATOM 766 C MET A 50 -12.266 -16.257 2.192 1.00 0.00 C ATOM 767 O MET A 50 -12.363 -16.306 3.418 1.00 0.00 O ATOM 768 CB MET A 50 -14.637 -15.495 1.941 1.00 0.00 C ATOM 769 CG MET A 50 -15.647 -14.610 1.226 1.00 0.00 C ATOM 770 SD MET A 50 -16.664 -13.655 2.368 1.00 0.00 S ATOM 771 CE MET A 50 -15.747 -12.116 2.431 1.00 0.00 C ATOM 0 H MET A 50 -13.899 -16.506 -0.274 1.00 0.00 H new ATOM 0 HA MET A 50 -12.883 -14.360 1.429 1.00 0.00 H new ATOM 0 HB2 MET A 50 -14.970 -16.531 1.884 1.00 0.00 H new ATOM 0 HB3 MET A 50 -14.614 -15.226 2.997 1.00 0.00 H new ATOM 0 HG2 MET A 50 -15.119 -13.929 0.559 1.00 0.00 H new ATOM 0 HG3 MET A 50 -16.291 -15.230 0.603 1.00 0.00 H new ATOM 0 HE1 MET A 50 -16.280 -11.400 3.057 1.00 0.00 H new ATOM 0 HE2 MET A 50 -14.758 -12.299 2.850 1.00 0.00 H new ATOM 0 HE3 MET A 50 -15.645 -11.712 1.424 1.00 0.00 H new ATOM 781 N ARG A 51 -11.342 -16.936 1.515 1.00 0.00 N ATOM 782 CA ARG A 51 -10.374 -17.790 2.194 1.00 0.00 C ATOM 783 C ARG A 51 -8.974 -17.190 2.124 1.00 0.00 C ATOM 784 O ARG A 51 -8.213 -17.249 3.089 1.00 0.00 O ATOM 785 CB ARG A 51 -10.374 -19.189 1.574 1.00 0.00 C ATOM 786 CG ARG A 51 -10.020 -19.201 0.096 1.00 0.00 C ATOM 787 CD ARG A 51 -10.408 -20.517 -0.559 1.00 0.00 C ATOM 788 NE ARG A 51 -11.856 -20.676 -0.650 1.00 0.00 N ATOM 789 CZ ARG A 51 -12.448 -21.763 -1.135 1.00 0.00 C ATOM 790 NH1 ARG A 51 -11.718 -22.781 -1.571 1.00 0.00 N ATOM 791 NH2 ARG A 51 -13.771 -21.834 -1.184 1.00 0.00 N ATOM 0 H ARG A 51 -11.245 -16.911 0.500 1.00 0.00 H new ATOM 0 HA ARG A 51 -10.665 -17.864 3.242 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -9.665 -19.816 2.114 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -11.359 -19.636 1.706 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -10.528 -18.379 -0.408 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -8.949 -19.035 -0.024 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -9.974 -20.567 -1.558 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -9.988 -21.344 0.013 1.00 0.00 H new ATOM 0 HE ARG A 51 -12.446 -19.911 -0.323 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -10.700 -22.731 -1.535 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -12.175 -23.614 -1.943 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -14.336 -21.054 -0.849 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -14.223 -22.669 -1.556 1.00 0.00 H new ATOM 805 N ARG A 52 -8.640 -16.610 0.975 1.00 0.00 N ATOM 806 CA ARG A 52 -7.330 -15.999 0.778 1.00 0.00 C ATOM 807 C ARG A 52 -7.383 -14.500 1.057 1.00 0.00 C ATOM 808 O ARG A 52 -6.379 -13.892 1.431 1.00 0.00 O ATOM 809 CB ARG A 52 -6.837 -16.249 -0.648 1.00 0.00 C ATOM 810 CG ARG A 52 -6.605 -17.718 -0.961 1.00 0.00 C ATOM 811 CD ARG A 52 -5.125 -18.066 -0.937 1.00 0.00 C ATOM 812 NE ARG A 52 -4.613 -18.176 0.426 1.00 0.00 N ATOM 813 CZ ARG A 52 -3.393 -18.611 0.721 1.00 0.00 C ATOM 814 NH1 ARG A 52 -2.560 -18.969 -0.247 1.00 0.00 N ATOM 815 NH2 ARG A 52 -3.002 -18.687 1.986 1.00 0.00 N ATOM 0 H ARG A 52 -9.259 -16.550 0.166 1.00 0.00 H new ATOM 0 HA ARG A 52 -6.633 -16.456 1.480 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -7.566 -15.847 -1.352 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -5.908 -15.701 -0.804 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -7.136 -18.334 -0.236 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -7.019 -17.952 -1.942 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -4.965 -19.008 -1.462 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -4.564 -17.302 -1.475 1.00 0.00 H new ATOM 0 HE ARG A 52 -5.226 -17.904 1.194 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -2.855 -18.911 -1.222 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -1.624 -19.303 -0.017 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -3.638 -18.411 2.734 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -2.065 -19.021 2.211 1.00 0.00 H new ATOM 829 N LEU A 53 -8.559 -13.910 0.871 1.00 0.00 N ATOM 830 CA LEU A 53 -8.744 -12.482 1.102 1.00 0.00 C ATOM 831 C LEU A 53 -9.737 -12.240 2.233 1.00 0.00 C ATOM 832 O LEU A 53 -10.648 -13.039 2.452 1.00 0.00 O ATOM 833 CB LEU A 53 -9.231 -11.796 -0.177 1.00 0.00 C ATOM 834 CG LEU A 53 -8.394 -12.085 -1.424 1.00 0.00 C ATOM 835 CD1 LEU A 53 -9.292 -12.280 -2.636 1.00 0.00 C ATOM 836 CD2 LEU A 53 -7.400 -10.960 -1.669 1.00 0.00 C ATOM 0 H LEU A 53 -9.399 -14.399 0.561 1.00 0.00 H new ATOM 0 HA LEU A 53 -7.782 -12.057 1.390 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -10.259 -12.104 -0.368 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -9.247 -10.719 -0.010 1.00 0.00 H new ATOM 0 HG LEU A 53 -7.836 -13.007 -1.260 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -8.679 -12.485 -3.514 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -9.964 -13.119 -2.459 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -9.877 -11.376 -2.805 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -6.812 -11.181 -2.560 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -7.939 -10.023 -1.813 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -6.736 -10.868 -0.810 1.00 0.00 H new ATOM 848 N SER A 54 -9.556 -11.137 2.952 1.00 0.00 N ATOM 849 CA SER A 54 -10.438 -10.797 4.062 1.00 0.00 C ATOM 850 C SER A 54 -10.759 -9.308 4.076 1.00 0.00 C ATOM 851 O SER A 54 -9.917 -8.476 3.745 1.00 0.00 O ATOM 852 CB SER A 54 -9.796 -11.203 5.390 1.00 0.00 C ATOM 853 OG SER A 54 -10.781 -11.468 6.373 1.00 0.00 O ATOM 0 H SER A 54 -8.807 -10.464 2.786 1.00 0.00 H new ATOM 0 HA SER A 54 -11.370 -11.346 3.929 1.00 0.00 H new ATOM 0 HB2 SER A 54 -9.177 -12.088 5.243 1.00 0.00 H new ATOM 0 HB3 SER A 54 -9.137 -10.407 5.737 1.00 0.00 H new ATOM 0 HG SER A 54 -10.345 -11.727 7.212 1.00 0.00 H new ATOM 859 N VAL A 55 -11.988 -8.981 4.462 1.00 0.00 N ATOM 860 CA VAL A 55 -12.431 -7.596 4.524 1.00 0.00 C ATOM 861 C VAL A 55 -13.144 -7.316 5.842 1.00 0.00 C ATOM 862 O VAL A 55 -14.148 -7.953 6.162 1.00 0.00 O ATOM 863 CB VAL A 55 -13.378 -7.232 3.360 1.00 0.00 C ATOM 864 CG1 VAL A 55 -12.622 -6.491 2.268 1.00 0.00 C ATOM 865 CG2 VAL A 55 -14.072 -8.466 2.792 1.00 0.00 C ATOM 0 H VAL A 55 -12.697 -9.661 4.737 1.00 0.00 H new ATOM 0 HA VAL A 55 -11.534 -6.981 4.445 1.00 0.00 H new ATOM 0 HB VAL A 55 -14.151 -6.574 3.757 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -13.306 -6.243 1.456 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -12.197 -5.575 2.677 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -11.821 -7.124 1.887 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -14.730 -8.170 1.975 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -13.323 -9.165 2.420 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -14.659 -8.946 3.575 1.00 0.00 H new ATOM 875 N ASP A 56 -12.620 -6.364 6.606 1.00 0.00 N ATOM 876 CA ASP A 56 -13.211 -6.007 7.889 1.00 0.00 C ATOM 877 C ASP A 56 -13.293 -4.486 8.054 1.00 0.00 C ATOM 878 O ASP A 56 -12.343 -3.773 7.731 1.00 0.00 O ATOM 879 CB ASP A 56 -12.394 -6.609 9.035 1.00 0.00 C ATOM 880 CG ASP A 56 -12.399 -8.125 9.016 1.00 0.00 C ATOM 881 OD1 ASP A 56 -11.650 -8.711 8.207 1.00 0.00 O ATOM 882 OD2 ASP A 56 -13.153 -8.727 9.810 1.00 0.00 O ATOM 0 H ASP A 56 -11.789 -5.827 6.359 1.00 0.00 H new ATOM 0 HA ASP A 56 -14.223 -6.412 7.917 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -11.366 -6.251 8.972 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -12.795 -6.259 9.986 1.00 0.00 H new ATOM 887 N PRO A 57 -14.431 -3.961 8.560 1.00 0.00 N ATOM 888 CA PRO A 57 -15.592 -4.768 8.960 1.00 0.00 C ATOM 889 C PRO A 57 -16.366 -5.296 7.752 1.00 0.00 C ATOM 890 O PRO A 57 -16.666 -4.544 6.826 1.00 0.00 O ATOM 891 CB PRO A 57 -16.448 -3.781 9.753 1.00 0.00 C ATOM 892 CG PRO A 57 -16.114 -2.450 9.175 1.00 0.00 C ATOM 893 CD PRO A 57 -14.664 -2.520 8.778 1.00 0.00 C ATOM 0 HA PRO A 57 -15.304 -5.654 9.527 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -17.510 -4.004 9.649 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -16.217 -3.821 10.817 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -16.744 -2.230 8.313 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -16.281 -1.656 9.903 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -14.467 -1.941 7.875 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -14.015 -2.123 9.559 1.00 0.00 H new ATOM 901 N PRO A 58 -16.705 -6.598 7.743 1.00 0.00 N ATOM 902 CA PRO A 58 -17.448 -7.207 6.636 1.00 0.00 C ATOM 903 C PRO A 58 -18.684 -6.397 6.260 1.00 0.00 C ATOM 904 O PRO A 58 -19.008 -6.248 5.083 1.00 0.00 O ATOM 905 CB PRO A 58 -17.848 -8.574 7.190 1.00 0.00 C ATOM 906 CG PRO A 58 -16.801 -8.892 8.199 1.00 0.00 C ATOM 907 CD PRO A 58 -16.394 -7.576 8.804 1.00 0.00 C ATOM 0 HA PRO A 58 -16.855 -7.262 5.723 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -18.839 -8.543 7.643 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -17.881 -9.327 6.402 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -17.187 -9.569 8.961 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -15.949 -9.388 7.734 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -16.949 -7.366 9.719 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -15.335 -7.564 9.063 1.00 0.00 H new ATOM 915 N CYS A 59 -19.367 -5.873 7.269 1.00 0.00 N ATOM 916 CA CYS A 59 -20.566 -5.073 7.050 1.00 0.00 C ATOM 917 C CYS A 59 -20.673 -3.976 8.104 1.00 0.00 C ATOM 918 O CYS A 59 -20.007 -4.033 9.138 1.00 0.00 O ATOM 919 CB CYS A 59 -21.812 -5.959 7.091 1.00 0.00 C ATOM 920 SG CYS A 59 -22.137 -6.703 8.708 1.00 0.00 S ATOM 0 H CYS A 59 -19.111 -5.988 8.250 1.00 0.00 H new ATOM 0 HA CYS A 59 -20.495 -4.610 6.066 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -22.677 -5.365 6.796 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -21.704 -6.753 6.353 1.00 0.00 H new ATOM 0 HG CYS A 59 -23.420 -6.783 8.899 1.00 0.00 H new ATOM 926 N GLY A 60 -21.510 -2.979 7.841 1.00 0.00 N ATOM 927 CA GLY A 60 -21.676 -1.891 8.787 1.00 0.00 C ATOM 928 C GLY A 60 -22.535 -0.767 8.243 1.00 0.00 C ATOM 929 O GLY A 60 -22.630 -0.578 7.029 1.00 0.00 O ATOM 0 H GLY A 60 -22.074 -2.904 6.994 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -22.126 -2.276 9.702 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -20.696 -1.496 9.056 1.00 0.00 H new ATOM 933 N VAL A 61 -23.161 -0.018 9.145 1.00 0.00 N ATOM 934 CA VAL A 61 -24.016 1.096 8.757 1.00 0.00 C ATOM 935 C VAL A 61 -23.248 2.413 8.800 1.00 0.00 C ATOM 936 O VAL A 61 -22.705 2.791 9.837 1.00 0.00 O ATOM 937 CB VAL A 61 -25.248 1.203 9.676 1.00 0.00 C ATOM 938 CG1 VAL A 61 -26.174 2.313 9.203 1.00 0.00 C ATOM 939 CG2 VAL A 61 -25.984 -0.126 9.739 1.00 0.00 C ATOM 0 H VAL A 61 -23.091 -0.164 10.152 1.00 0.00 H new ATOM 0 HA VAL A 61 -24.349 0.903 7.737 1.00 0.00 H new ATOM 0 HB VAL A 61 -24.908 1.451 10.681 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -27.038 2.373 9.865 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -25.640 3.263 9.217 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -26.509 2.100 8.188 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -26.851 -0.031 10.393 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -26.313 -0.408 8.739 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -25.316 -0.893 10.131 1.00 0.00 H new ATOM 949 N LEU A 62 -23.204 3.106 7.666 1.00 0.00 N ATOM 950 CA LEU A 62 -22.499 4.379 7.579 1.00 0.00 C ATOM 951 C LEU A 62 -23.467 5.549 7.714 1.00 0.00 C ATOM 952 O LEU A 62 -24.631 5.453 7.323 1.00 0.00 O ATOM 953 CB LEU A 62 -21.742 4.478 6.253 1.00 0.00 C ATOM 954 CG LEU A 62 -20.300 4.975 6.367 1.00 0.00 C ATOM 955 CD1 LEU A 62 -19.537 4.160 7.401 1.00 0.00 C ATOM 956 CD2 LEU A 62 -19.605 4.911 5.015 1.00 0.00 C ATOM 0 H LEU A 62 -23.647 2.808 6.797 1.00 0.00 H new ATOM 0 HA LEU A 62 -21.785 4.426 8.401 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -21.735 3.495 5.782 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -22.289 5.147 5.589 1.00 0.00 H new ATOM 0 HG LEU A 62 -20.318 6.015 6.694 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -18.513 4.527 7.470 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -20.023 4.257 8.372 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -19.528 3.111 7.103 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -18.580 5.268 5.115 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -19.597 3.881 4.659 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -20.139 5.538 4.301 1.00 0.00 H new ATOM 968 N ASP A 63 -22.978 6.653 8.270 1.00 0.00 N ATOM 969 CA ASP A 63 -23.799 7.843 8.456 1.00 0.00 C ATOM 970 C ASP A 63 -23.644 8.800 7.276 1.00 0.00 C ATOM 971 O ASP A 63 -22.751 8.636 6.445 1.00 0.00 O ATOM 972 CB ASP A 63 -23.419 8.551 9.758 1.00 0.00 C ATOM 973 CG ASP A 63 -24.293 8.129 10.922 1.00 0.00 C ATOM 974 OD1 ASP A 63 -24.642 6.933 10.999 1.00 0.00 O ATOM 975 OD2 ASP A 63 -24.629 8.996 11.756 1.00 0.00 O ATOM 0 H ASP A 63 -22.017 6.748 8.599 1.00 0.00 H new ATOM 0 HA ASP A 63 -24.842 7.531 8.512 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -22.377 8.337 9.994 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -23.500 9.629 9.619 1.00 0.00 H new ATOM 980 N PRO A 64 -24.520 9.817 7.186 1.00 0.00 N ATOM 981 CA PRO A 64 -24.480 10.802 6.099 1.00 0.00 C ATOM 982 C PRO A 64 -23.198 11.627 6.110 1.00 0.00 C ATOM 983 O PRO A 64 -22.894 12.305 7.092 1.00 0.00 O ATOM 984 CB PRO A 64 -25.693 11.702 6.374 1.00 0.00 C ATOM 985 CG PRO A 64 -26.553 10.927 7.312 1.00 0.00 C ATOM 986 CD PRO A 64 -25.618 10.084 8.127 1.00 0.00 C ATOM 0 HA PRO A 64 -24.505 10.321 5.121 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -25.387 12.651 6.814 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -26.227 11.935 5.453 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -27.134 11.593 7.950 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -27.264 10.306 6.767 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -25.270 10.609 9.016 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -26.094 9.164 8.466 1.00 0.00 H new ATOM 994 N LYS A 65 -22.454 11.573 5.010 1.00 0.00 N ATOM 995 CA LYS A 65 -21.207 12.323 4.893 1.00 0.00 C ATOM 996 C LYS A 65 -20.139 11.781 5.841 1.00 0.00 C ATOM 997 O LYS A 65 -19.157 12.465 6.134 1.00 0.00 O ATOM 998 CB LYS A 65 -21.456 13.805 5.182 1.00 0.00 C ATOM 999 CG LYS A 65 -20.318 14.710 4.738 1.00 0.00 C ATOM 1000 CD LYS A 65 -20.812 15.815 3.820 1.00 0.00 C ATOM 1001 CE LYS A 65 -21.360 15.253 2.518 1.00 0.00 C ATOM 1002 NZ LYS A 65 -20.289 14.643 1.682 1.00 0.00 N ATOM 0 H LYS A 65 -22.692 11.019 4.187 1.00 0.00 H new ATOM 0 HA LYS A 65 -20.842 12.208 3.872 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -22.373 14.115 4.681 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -21.617 13.936 6.252 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -19.838 15.149 5.613 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -19.561 14.119 4.223 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -21.589 16.389 4.325 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -19.995 16.504 3.605 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -22.120 14.503 2.738 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -21.850 16.049 1.957 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -20.662 14.441 0.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -19.489 15.304 1.606 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -19.966 13.758 2.123 1.00 0.00 H new ATOM 1016 N GLU A 66 -20.328 10.553 6.317 1.00 0.00 N ATOM 1017 CA GLU A 66 -19.372 9.935 7.228 1.00 0.00 C ATOM 1018 C GLU A 66 -18.294 9.184 6.452 1.00 0.00 C ATOM 1019 O GLU A 66 -18.526 8.724 5.334 1.00 0.00 O ATOM 1020 CB GLU A 66 -20.086 8.981 8.187 1.00 0.00 C ATOM 1021 CG GLU A 66 -20.088 9.458 9.630 1.00 0.00 C ATOM 1022 CD GLU A 66 -19.668 8.374 10.603 1.00 0.00 C ATOM 1023 OE1 GLU A 66 -18.945 7.446 10.183 1.00 0.00 O ATOM 1024 OE2 GLU A 66 -20.064 8.453 11.785 1.00 0.00 O ATOM 0 H GLU A 66 -21.132 9.969 6.087 1.00 0.00 H new ATOM 0 HA GLU A 66 -18.896 10.726 7.807 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -21.116 8.849 7.855 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -19.607 8.003 8.137 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -19.415 10.310 9.728 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -21.086 9.809 9.891 1.00 0.00 H new ATOM 1031 N LYS A 67 -17.115 9.065 7.053 1.00 0.00 N ATOM 1032 CA LYS A 67 -16.002 8.372 6.418 1.00 0.00 C ATOM 1033 C LYS A 67 -15.508 7.219 7.288 1.00 0.00 C ATOM 1034 O LYS A 67 -15.647 7.248 8.510 1.00 0.00 O ATOM 1035 CB LYS A 67 -14.855 9.347 6.146 1.00 0.00 C ATOM 1036 CG LYS A 67 -15.234 10.485 5.212 1.00 0.00 C ATOM 1037 CD LYS A 67 -15.010 11.839 5.866 1.00 0.00 C ATOM 1038 CE LYS A 67 -15.401 12.977 4.937 1.00 0.00 C ATOM 1039 NZ LYS A 67 -14.555 14.183 5.151 1.00 0.00 N ATOM 0 H LYS A 67 -16.906 9.440 7.979 1.00 0.00 H new ATOM 0 HA LYS A 67 -16.356 7.963 5.472 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -14.511 9.764 7.093 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -14.017 8.799 5.716 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -14.644 10.419 4.298 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -16.281 10.387 4.924 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -15.593 11.901 6.785 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -13.961 11.940 6.146 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -15.310 12.648 3.902 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -16.448 13.234 5.099 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -14.853 14.936 4.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -14.661 14.512 6.132 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -13.559 13.944 4.972 1.00 0.00 H new ATOM 1053 N VAL A 68 -14.929 6.210 6.647 1.00 0.00 N ATOM 1054 CA VAL A 68 -14.411 5.047 7.358 1.00 0.00 C ATOM 1055 C VAL A 68 -13.188 4.474 6.650 1.00 0.00 C ATOM 1056 O VAL A 68 -13.036 4.623 5.437 1.00 0.00 O ATOM 1057 CB VAL A 68 -15.479 3.946 7.492 1.00 0.00 C ATOM 1058 CG1 VAL A 68 -16.464 4.288 8.599 1.00 0.00 C ATOM 1059 CG2 VAL A 68 -16.202 3.740 6.170 1.00 0.00 C ATOM 0 H VAL A 68 -14.806 6.174 5.635 1.00 0.00 H new ATOM 0 HA VAL A 68 -14.127 5.385 8.355 1.00 0.00 H new ATOM 0 HB VAL A 68 -14.981 3.013 7.757 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -17.211 3.498 8.678 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -15.931 4.379 9.545 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -16.957 5.232 8.368 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -16.953 2.958 6.284 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -16.688 4.669 5.872 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -15.484 3.445 5.405 1.00 0.00 H new ATOM 1069 N LEU A 69 -12.318 3.823 7.416 1.00 0.00 N ATOM 1070 CA LEU A 69 -11.106 3.231 6.861 1.00 0.00 C ATOM 1071 C LEU A 69 -11.161 1.707 6.913 1.00 0.00 C ATOM 1072 O LEU A 69 -10.763 1.097 7.905 1.00 0.00 O ATOM 1073 CB LEU A 69 -9.876 3.734 7.618 1.00 0.00 C ATOM 1074 CG LEU A 69 -8.551 3.589 6.868 1.00 0.00 C ATOM 1075 CD1 LEU A 69 -8.672 4.152 5.461 1.00 0.00 C ATOM 1076 CD2 LEU A 69 -7.429 4.281 7.628 1.00 0.00 C ATOM 0 H LEU A 69 -12.430 3.692 8.421 1.00 0.00 H new ATOM 0 HA LEU A 69 -11.034 3.534 5.816 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -10.024 4.786 7.863 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -9.803 3.194 8.562 1.00 0.00 H new ATOM 0 HG LEU A 69 -8.311 2.528 6.794 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -7.720 4.041 4.941 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -9.447 3.611 4.918 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -8.935 5.208 5.513 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -6.494 4.167 7.079 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -7.661 5.341 7.734 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -7.327 3.831 8.616 1.00 0.00 H new ATOM 1088 N MET A 70 -11.649 1.101 5.837 1.00 0.00 N ATOM 1089 CA MET A 70 -11.748 -0.351 5.755 1.00 0.00 C ATOM 1090 C MET A 70 -10.370 -0.973 5.578 1.00 0.00 C ATOM 1091 O MET A 70 -9.429 -0.307 5.145 1.00 0.00 O ATOM 1092 CB MET A 70 -12.659 -0.754 4.592 1.00 0.00 C ATOM 1093 CG MET A 70 -12.666 -2.247 4.306 1.00 0.00 C ATOM 1094 SD MET A 70 -13.658 -2.674 2.864 1.00 0.00 S ATOM 1095 CE MET A 70 -12.946 -1.589 1.629 1.00 0.00 C ATOM 0 H MET A 70 -11.983 1.593 5.008 1.00 0.00 H new ATOM 0 HA MET A 70 -12.178 -0.720 6.686 1.00 0.00 H new ATOM 0 HB2 MET A 70 -13.677 -0.431 4.811 1.00 0.00 H new ATOM 0 HB3 MET A 70 -12.342 -0.223 3.694 1.00 0.00 H new ATOM 0 HG2 MET A 70 -11.642 -2.588 4.152 1.00 0.00 H new ATOM 0 HG3 MET A 70 -13.051 -2.778 5.177 1.00 0.00 H new ATOM 0 HE1 MET A 70 -13.273 -1.902 0.637 1.00 0.00 H new ATOM 0 HE2 MET A 70 -13.273 -0.565 1.812 1.00 0.00 H new ATOM 0 HE3 MET A 70 -11.859 -1.638 1.685 1.00 0.00 H new ATOM 1105 N ALA A 71 -10.255 -2.251 5.916 1.00 0.00 N ATOM 1106 CA ALA A 71 -8.988 -2.964 5.793 1.00 0.00 C ATOM 1107 C ALA A 71 -9.138 -4.216 4.935 1.00 0.00 C ATOM 1108 O ALA A 71 -10.034 -5.030 5.157 1.00 0.00 O ATOM 1109 CB ALA A 71 -8.452 -3.326 7.171 1.00 0.00 C ATOM 0 H ALA A 71 -11.023 -2.816 6.278 1.00 0.00 H new ATOM 0 HA ALA A 71 -8.276 -2.304 5.298 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -7.506 -3.858 7.065 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -8.294 -2.416 7.751 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -9.171 -3.964 7.685 1.00 0.00 H new ATOM 1115 N VAL A 72 -8.251 -4.364 3.955 1.00 0.00 N ATOM 1116 CA VAL A 72 -8.281 -5.519 3.064 1.00 0.00 C ATOM 1117 C VAL A 72 -7.083 -6.430 3.310 1.00 0.00 C ATOM 1118 O VAL A 72 -6.012 -6.232 2.737 1.00 0.00 O ATOM 1119 CB VAL A 72 -8.287 -5.088 1.586 1.00 0.00 C ATOM 1120 CG1 VAL A 72 -8.390 -6.301 0.674 1.00 0.00 C ATOM 1121 CG2 VAL A 72 -9.424 -4.113 1.318 1.00 0.00 C ATOM 0 H VAL A 72 -7.503 -3.699 3.758 1.00 0.00 H new ATOM 0 HA VAL A 72 -9.201 -6.063 3.280 1.00 0.00 H new ATOM 0 HB VAL A 72 -7.346 -4.581 1.372 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -8.393 -5.975 -0.366 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -7.538 -6.959 0.846 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -9.313 -6.840 0.888 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -9.412 -3.820 0.268 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -10.376 -4.591 1.550 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -9.300 -3.229 1.943 1.00 0.00 H new ATOM 1131 N SER A 73 -7.272 -7.429 4.167 1.00 0.00 N ATOM 1132 CA SER A 73 -6.206 -8.371 4.491 1.00 0.00 C ATOM 1133 C SER A 73 -5.846 -9.227 3.282 1.00 0.00 C ATOM 1134 O SER A 73 -6.714 -9.845 2.664 1.00 0.00 O ATOM 1135 CB SER A 73 -6.629 -9.266 5.657 1.00 0.00 C ATOM 1136 OG SER A 73 -7.634 -8.646 6.439 1.00 0.00 O ATOM 0 H SER A 73 -8.153 -7.607 4.649 1.00 0.00 H new ATOM 0 HA SER A 73 -5.325 -7.798 4.780 1.00 0.00 H new ATOM 0 HB2 SER A 73 -6.998 -10.217 5.274 1.00 0.00 H new ATOM 0 HB3 SER A 73 -5.764 -9.488 6.281 1.00 0.00 H new ATOM 0 HG SER A 73 -7.888 -9.240 7.176 1.00 0.00 H new ATOM 1142 N CYS A 74 -4.559 -9.263 2.951 1.00 0.00 N ATOM 1143 CA CYS A 74 -4.079 -10.046 1.819 1.00 0.00 C ATOM 1144 C CYS A 74 -2.893 -10.913 2.226 1.00 0.00 C ATOM 1145 O CYS A 74 -1.768 -10.428 2.342 1.00 0.00 O ATOM 1146 CB CYS A 74 -3.680 -9.125 0.664 1.00 0.00 C ATOM 1147 SG CYS A 74 -4.044 -9.796 -0.975 1.00 0.00 S ATOM 0 H CYS A 74 -3.829 -8.757 3.452 1.00 0.00 H new ATOM 0 HA CYS A 74 -4.889 -10.697 1.489 1.00 0.00 H new ATOM 0 HB2 CYS A 74 -4.197 -8.172 0.778 1.00 0.00 H new ATOM 0 HB3 CYS A 74 -2.612 -8.918 0.731 1.00 0.00 H new ATOM 0 HG CYS A 74 -4.062 -8.830 -1.845 1.00 0.00 H new ATOM 1153 N ASP A 75 -3.152 -12.198 2.445 1.00 0.00 N ATOM 1154 CA ASP A 75 -2.107 -13.131 2.843 1.00 0.00 C ATOM 1155 C ASP A 75 -1.195 -13.468 1.669 1.00 0.00 C ATOM 1156 O ASP A 75 -1.639 -13.547 0.523 1.00 0.00 O ATOM 1157 CB ASP A 75 -2.724 -14.411 3.408 1.00 0.00 C ATOM 1158 CG ASP A 75 -3.185 -14.246 4.843 1.00 0.00 C ATOM 1159 OD1 ASP A 75 -2.752 -13.274 5.498 1.00 0.00 O ATOM 1160 OD2 ASP A 75 -3.980 -15.087 5.312 1.00 0.00 O ATOM 0 H ASP A 75 -4.078 -12.616 2.353 1.00 0.00 H new ATOM 0 HA ASP A 75 -1.507 -12.652 3.617 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -3.571 -14.707 2.789 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -1.993 -15.218 3.355 1.00 0.00 H new ATOM 1165 N THR A 76 0.086 -13.664 1.965 1.00 0.00 N ATOM 1166 CA THR A 76 1.071 -13.993 0.939 1.00 0.00 C ATOM 1167 C THR A 76 0.584 -15.138 0.055 1.00 0.00 C ATOM 1168 O THR A 76 -0.331 -15.875 0.423 1.00 0.00 O ATOM 1169 CB THR A 76 2.408 -14.369 1.586 1.00 0.00 C ATOM 1170 OG1 THR A 76 3.175 -15.184 0.717 1.00 0.00 O ATOM 1171 CG2 THR A 76 2.258 -15.117 2.895 1.00 0.00 C ATOM 0 H THR A 76 0.467 -13.601 2.909 1.00 0.00 H new ATOM 0 HA THR A 76 1.210 -13.111 0.314 1.00 0.00 H new ATOM 0 HB THR A 76 2.904 -13.419 1.784 1.00 0.00 H new ATOM 0 HG1 THR A 76 3.439 -14.664 -0.071 1.00 0.00 H new ATOM 0 HG21 THR A 76 3.244 -15.351 3.296 1.00 0.00 H new ATOM 0 HG22 THR A 76 1.714 -14.497 3.608 1.00 0.00 H new ATOM 0 HG23 THR A 76 1.707 -16.042 2.724 1.00 0.00 H new ATOM 1179 N PHE A 77 1.205 -15.283 -1.113 1.00 0.00 N ATOM 1180 CA PHE A 77 0.840 -16.340 -2.049 1.00 0.00 C ATOM 1181 C PHE A 77 1.876 -16.460 -3.165 1.00 0.00 C ATOM 1182 O PHE A 77 2.994 -15.959 -3.045 1.00 0.00 O ATOM 1183 CB PHE A 77 -0.551 -16.076 -2.638 1.00 0.00 C ATOM 1184 CG PHE A 77 -0.578 -15.010 -3.700 1.00 0.00 C ATOM 1185 CD1 PHE A 77 -0.008 -13.767 -3.470 1.00 0.00 C ATOM 1186 CD2 PHE A 77 -1.172 -15.253 -4.927 1.00 0.00 C ATOM 1187 CE1 PHE A 77 -0.032 -12.787 -4.445 1.00 0.00 C ATOM 1188 CE2 PHE A 77 -1.199 -14.278 -5.905 1.00 0.00 C ATOM 1189 CZ PHE A 77 -0.629 -13.044 -5.664 1.00 0.00 C ATOM 0 H PHE A 77 1.964 -14.681 -1.433 1.00 0.00 H new ATOM 0 HA PHE A 77 0.815 -17.284 -1.504 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -0.937 -17.004 -3.060 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -1.226 -15.788 -1.832 1.00 0.00 H new ATOM 0 HD1 PHE A 77 0.460 -13.562 -2.518 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -1.620 -16.216 -5.122 1.00 0.00 H new ATOM 0 HE1 PHE A 77 0.415 -11.823 -4.254 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -1.666 -14.481 -6.858 1.00 0.00 H new ATOM 0 HZ PHE A 77 -0.650 -12.280 -6.428 1.00 0.00 H new ATOM 1199 N ASN A 78 1.498 -17.128 -4.250 1.00 0.00 N ATOM 1200 CA ASN A 78 2.394 -17.311 -5.386 1.00 0.00 C ATOM 1201 C ASN A 78 1.914 -16.509 -6.591 1.00 0.00 C ATOM 1202 O ASN A 78 0.812 -16.726 -7.095 1.00 0.00 O ATOM 1203 CB ASN A 78 2.491 -18.793 -5.753 1.00 0.00 C ATOM 1204 CG ASN A 78 3.294 -19.588 -4.742 1.00 0.00 C ATOM 1205 OD1 ASN A 78 2.742 -20.381 -3.979 1.00 0.00 O ATOM 1206 ND2 ASN A 78 4.605 -19.381 -4.732 1.00 0.00 N ATOM 0 H ASN A 78 0.577 -17.552 -4.366 1.00 0.00 H new ATOM 0 HA ASN A 78 3.381 -16.949 -5.100 1.00 0.00 H new ATOM 0 HB2 ASN A 78 1.488 -19.213 -5.827 1.00 0.00 H new ATOM 0 HB3 ASN A 78 2.951 -18.892 -6.736 1.00 0.00 H new ATOM 0 HD21 ASN A 78 5.196 -19.889 -4.074 1.00 0.00 H new ATOM 0 HD22 ASN A 78 5.021 -18.714 -5.382 1.00 0.00 H new ATOM 1213 N ALA A 79 2.748 -15.580 -7.048 1.00 0.00 N ATOM 1214 CA ALA A 79 2.408 -14.746 -8.195 1.00 0.00 C ATOM 1215 C ALA A 79 3.251 -15.104 -9.417 1.00 0.00 C ATOM 1216 O ALA A 79 3.357 -14.319 -10.359 1.00 0.00 O ATOM 1217 CB ALA A 79 2.589 -13.279 -7.846 1.00 0.00 C ATOM 0 H ALA A 79 3.663 -15.386 -6.642 1.00 0.00 H new ATOM 0 HA ALA A 79 1.363 -14.930 -8.445 1.00 0.00 H new ATOM 0 HB1 ALA A 79 2.332 -12.665 -8.709 1.00 0.00 H new ATOM 0 HB2 ALA A 79 1.938 -13.021 -7.011 1.00 0.00 H new ATOM 0 HB3 ALA A 79 3.627 -13.097 -7.567 1.00 0.00 H new ATOM 1223 N ALA A 80 3.848 -16.292 -9.397 1.00 0.00 N ATOM 1224 CA ALA A 80 4.679 -16.746 -10.506 1.00 0.00 C ATOM 1225 C ALA A 80 3.913 -17.703 -11.413 1.00 0.00 C ATOM 1226 O ALA A 80 4.256 -17.871 -12.583 1.00 0.00 O ATOM 1227 CB ALA A 80 5.937 -17.420 -9.983 1.00 0.00 C ATOM 0 H ALA A 80 3.772 -16.956 -8.627 1.00 0.00 H new ATOM 0 HA ALA A 80 4.960 -15.872 -11.093 1.00 0.00 H new ATOM 0 HB1 ALA A 80 6.547 -17.753 -10.823 1.00 0.00 H new ATOM 0 HB2 ALA A 80 6.505 -16.712 -9.380 1.00 0.00 H new ATOM 0 HB3 ALA A 80 5.662 -18.279 -9.371 1.00 0.00 H new ATOM 1233 N THR A 81 2.880 -18.334 -10.864 1.00 0.00 N ATOM 1234 CA THR A 81 2.077 -19.280 -11.627 1.00 0.00 C ATOM 1235 C THR A 81 0.598 -19.155 -11.273 1.00 0.00 C ATOM 1236 O THR A 81 -0.069 -20.150 -10.989 1.00 0.00 O ATOM 1237 CB THR A 81 2.562 -20.703 -11.364 1.00 0.00 C ATOM 1238 OG1 THR A 81 2.404 -21.045 -9.998 1.00 0.00 O ATOM 1239 CG2 THR A 81 4.017 -20.901 -11.725 1.00 0.00 C ATOM 0 H THR A 81 2.581 -18.207 -9.897 1.00 0.00 H new ATOM 0 HA THR A 81 2.191 -19.051 -12.686 1.00 0.00 H new ATOM 0 HB THR A 81 1.951 -21.345 -11.998 1.00 0.00 H new ATOM 0 HG1 THR A 81 1.451 -21.041 -9.768 1.00 0.00 H new ATOM 0 HG21 THR A 81 4.307 -21.931 -11.517 1.00 0.00 H new ATOM 0 HG22 THR A 81 4.161 -20.691 -12.785 1.00 0.00 H new ATOM 0 HG23 THR A 81 4.634 -20.224 -11.134 1.00 0.00 H new ATOM 1247 N GLU A 82 0.092 -17.926 -11.292 1.00 0.00 N ATOM 1248 CA GLU A 82 -1.309 -17.671 -10.974 1.00 0.00 C ATOM 1249 C GLU A 82 -1.777 -16.356 -11.587 1.00 0.00 C ATOM 1250 O GLU A 82 -1.001 -15.408 -11.718 1.00 0.00 O ATOM 1251 CB GLU A 82 -1.511 -17.637 -9.457 1.00 0.00 C ATOM 1252 CG GLU A 82 -1.338 -18.992 -8.791 1.00 0.00 C ATOM 1253 CD GLU A 82 -1.716 -18.973 -7.323 1.00 0.00 C ATOM 1254 OE1 GLU A 82 -0.979 -18.352 -6.528 1.00 0.00 O ATOM 1255 OE2 GLU A 82 -2.750 -19.577 -6.969 1.00 0.00 O ATOM 0 H GLU A 82 0.631 -17.091 -11.524 1.00 0.00 H new ATOM 0 HA GLU A 82 -1.903 -18.481 -11.397 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -0.803 -16.933 -9.020 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -2.510 -17.259 -9.240 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -1.951 -19.729 -9.311 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -0.301 -19.312 -8.891 1.00 0.00 H new ATOM 1262 N ASP A 83 -3.052 -16.302 -11.960 1.00 0.00 N ATOM 1263 CA ASP A 83 -3.623 -15.102 -12.558 1.00 0.00 C ATOM 1264 C ASP A 83 -3.528 -13.921 -11.596 1.00 0.00 C ATOM 1265 O ASP A 83 -3.751 -14.070 -10.394 1.00 0.00 O ATOM 1266 CB ASP A 83 -5.084 -15.344 -12.945 1.00 0.00 C ATOM 1267 CG ASP A 83 -5.223 -16.292 -14.119 1.00 0.00 C ATOM 1268 OD1 ASP A 83 -4.193 -16.842 -14.564 1.00 0.00 O ATOM 1269 OD2 ASP A 83 -6.361 -16.485 -14.596 1.00 0.00 O ATOM 0 H ASP A 83 -3.709 -17.076 -11.858 1.00 0.00 H new ATOM 0 HA ASP A 83 -3.053 -14.865 -13.456 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -5.621 -15.751 -12.088 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -5.553 -14.392 -13.193 1.00 0.00 H new ATOM 1274 N LEU A 84 -3.191 -12.751 -12.128 1.00 0.00 N ATOM 1275 CA LEU A 84 -3.063 -11.549 -11.311 1.00 0.00 C ATOM 1276 C LEU A 84 -4.093 -10.500 -11.714 1.00 0.00 C ATOM 1277 O LEU A 84 -3.872 -9.301 -11.537 1.00 0.00 O ATOM 1278 CB LEU A 84 -1.655 -10.970 -11.437 1.00 0.00 C ATOM 1279 CG LEU A 84 -0.523 -11.927 -11.066 1.00 0.00 C ATOM 1280 CD1 LEU A 84 0.829 -11.289 -11.344 1.00 0.00 C ATOM 1281 CD2 LEU A 84 -0.631 -12.337 -9.605 1.00 0.00 C ATOM 0 H LEU A 84 -3.002 -12.609 -13.120 1.00 0.00 H new ATOM 0 HA LEU A 84 -3.244 -11.828 -10.273 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -1.507 -10.638 -12.464 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -1.585 -10.086 -10.803 1.00 0.00 H new ATOM 0 HG LEU A 84 -0.612 -12.822 -11.682 1.00 0.00 H new ATOM 0 HD11 LEU A 84 1.623 -11.986 -11.073 1.00 0.00 H new ATOM 0 HD12 LEU A 84 0.905 -11.046 -12.404 1.00 0.00 H new ATOM 0 HD13 LEU A 84 0.929 -10.378 -10.754 1.00 0.00 H new ATOM 0 HD21 LEU A 84 0.183 -13.019 -9.357 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -0.568 -11.451 -8.973 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -1.586 -12.835 -9.437 1.00 0.00 H new ATOM 1293 N ASN A 85 -5.216 -10.956 -12.255 1.00 0.00 N ATOM 1294 CA ASN A 85 -6.280 -10.054 -12.680 1.00 0.00 C ATOM 1295 C ASN A 85 -7.644 -10.702 -12.480 1.00 0.00 C ATOM 1296 O ASN A 85 -8.602 -10.389 -13.186 1.00 0.00 O ATOM 1297 CB ASN A 85 -6.094 -9.670 -14.149 1.00 0.00 C ATOM 1298 CG ASN A 85 -6.957 -8.490 -14.551 1.00 0.00 C ATOM 1299 OD1 ASN A 85 -7.217 -7.594 -13.749 1.00 0.00 O ATOM 1300 ND2 ASN A 85 -7.408 -8.486 -15.800 1.00 0.00 N ATOM 0 H ASN A 85 -5.414 -11.945 -12.410 1.00 0.00 H new ATOM 0 HA ASN A 85 -6.230 -9.153 -12.069 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -5.046 -9.429 -14.329 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -6.337 -10.526 -14.779 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -7.995 -7.719 -16.128 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -7.167 -9.250 -16.432 1.00 0.00 H new ATOM 1307 N ASN A 86 -7.723 -11.608 -11.511 1.00 0.00 N ATOM 1308 CA ASN A 86 -8.970 -12.305 -11.216 1.00 0.00 C ATOM 1309 C ASN A 86 -9.589 -11.796 -9.918 1.00 0.00 C ATOM 1310 O ASN A 86 -10.808 -11.822 -9.750 1.00 0.00 O ATOM 1311 CB ASN A 86 -8.724 -13.812 -11.121 1.00 0.00 C ATOM 1312 CG ASN A 86 -8.990 -14.524 -12.433 1.00 0.00 C ATOM 1313 OD1 ASN A 86 -9.558 -15.616 -12.456 1.00 0.00 O ATOM 1314 ND2 ASN A 86 -8.580 -13.906 -13.534 1.00 0.00 N ATOM 0 H ASN A 86 -6.939 -11.877 -10.917 1.00 0.00 H new ATOM 0 HA ASN A 86 -9.668 -12.106 -12.029 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -7.693 -13.991 -10.816 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -9.363 -14.234 -10.346 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -8.732 -14.336 -14.447 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -8.113 -13.001 -13.467 1.00 0.00 H new ATOM 1321 N ASP A 87 -8.744 -11.338 -9.002 1.00 0.00 N ATOM 1322 CA ASP A 87 -9.212 -10.826 -7.718 1.00 0.00 C ATOM 1323 C ASP A 87 -10.093 -9.597 -7.911 1.00 0.00 C ATOM 1324 O ASP A 87 -9.743 -8.681 -8.657 1.00 0.00 O ATOM 1325 CB ASP A 87 -8.025 -10.482 -6.817 1.00 0.00 C ATOM 1326 CG ASP A 87 -7.327 -11.716 -6.282 1.00 0.00 C ATOM 1327 OD1 ASP A 87 -6.745 -12.468 -7.093 1.00 0.00 O ATOM 1328 OD2 ASP A 87 -7.362 -11.932 -5.053 1.00 0.00 O ATOM 0 H ASP A 87 -7.732 -11.310 -9.124 1.00 0.00 H new ATOM 0 HA ASP A 87 -9.806 -11.605 -7.240 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -7.311 -9.878 -7.377 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -8.371 -9.873 -5.982 1.00 0.00 H new ATOM 1333 N ARG A 88 -11.236 -9.581 -7.234 1.00 0.00 N ATOM 1334 CA ARG A 88 -12.167 -8.462 -7.331 1.00 0.00 C ATOM 1335 C ARG A 88 -12.922 -8.267 -6.020 1.00 0.00 C ATOM 1336 O ARG A 88 -13.232 -9.231 -5.320 1.00 0.00 O ATOM 1337 CB ARG A 88 -13.158 -8.692 -8.475 1.00 0.00 C ATOM 1338 CG ARG A 88 -12.631 -8.255 -9.833 1.00 0.00 C ATOM 1339 CD ARG A 88 -13.608 -8.599 -10.946 1.00 0.00 C ATOM 1340 NE ARG A 88 -13.465 -9.982 -11.392 1.00 0.00 N ATOM 1341 CZ ARG A 88 -14.291 -10.567 -12.253 1.00 0.00 C ATOM 1342 NH1 ARG A 88 -15.312 -9.890 -12.762 1.00 0.00 N ATOM 1343 NH2 ARG A 88 -14.095 -11.829 -12.608 1.00 0.00 N ATOM 0 H ARG A 88 -11.540 -10.330 -6.612 1.00 0.00 H new ATOM 0 HA ARG A 88 -11.591 -7.560 -7.535 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -13.413 -9.751 -8.517 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -14.080 -8.151 -8.261 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -12.450 -7.180 -9.826 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -11.673 -8.738 -10.026 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -14.627 -8.434 -10.597 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -13.447 -7.928 -11.790 1.00 0.00 H new ATOM 0 HE ARG A 88 -12.688 -10.529 -11.022 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -15.464 -8.918 -12.493 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -15.945 -10.341 -13.423 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -13.310 -12.352 -12.220 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -14.730 -12.277 -13.269 1.00 0.00 H new ATOM 1357 N ILE A 89 -13.216 -7.012 -5.696 1.00 0.00 N ATOM 1358 CA ILE A 89 -13.935 -6.686 -4.470 1.00 0.00 C ATOM 1359 C ILE A 89 -15.228 -5.937 -4.779 1.00 0.00 C ATOM 1360 O ILE A 89 -15.202 -4.822 -5.300 1.00 0.00 O ATOM 1361 CB ILE A 89 -13.072 -5.833 -3.521 1.00 0.00 C ATOM 1362 CG1 ILE A 89 -11.769 -6.563 -3.189 1.00 0.00 C ATOM 1363 CG2 ILE A 89 -13.843 -5.507 -2.250 1.00 0.00 C ATOM 1364 CD1 ILE A 89 -10.748 -5.690 -2.491 1.00 0.00 C ATOM 0 H ILE A 89 -12.967 -6.204 -6.266 1.00 0.00 H new ATOM 0 HA ILE A 89 -14.172 -7.630 -3.979 1.00 0.00 H new ATOM 0 HB ILE A 89 -12.825 -4.896 -4.021 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -11.994 -7.422 -2.556 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -11.334 -6.951 -4.110 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -13.219 -4.904 -1.590 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -14.745 -4.951 -2.504 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -14.118 -6.432 -1.744 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -9.850 -6.273 -2.286 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -10.494 -4.845 -3.131 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -11.164 -5.323 -1.553 1.00 0.00 H new ATOM 1376 N THR A 90 -16.356 -6.558 -4.454 1.00 0.00 N ATOM 1377 CA THR A 90 -17.660 -5.955 -4.696 1.00 0.00 C ATOM 1378 C THR A 90 -18.181 -5.257 -3.443 1.00 0.00 C ATOM 1379 O THR A 90 -18.294 -5.869 -2.379 1.00 0.00 O ATOM 1380 CB THR A 90 -18.660 -7.018 -5.153 1.00 0.00 C ATOM 1381 OG1 THR A 90 -18.191 -7.680 -6.314 1.00 0.00 O ATOM 1382 CG2 THR A 90 -20.031 -6.458 -5.467 1.00 0.00 C ATOM 0 H THR A 90 -16.393 -7.481 -4.021 1.00 0.00 H new ATOM 0 HA THR A 90 -17.545 -5.210 -5.483 1.00 0.00 H new ATOM 0 HB THR A 90 -18.752 -7.707 -4.313 1.00 0.00 H new ATOM 0 HG1 THR A 90 -18.843 -8.357 -6.590 1.00 0.00 H new ATOM 0 HG21 THR A 90 -20.690 -7.266 -5.785 1.00 0.00 H new ATOM 0 HG22 THR A 90 -20.443 -5.983 -4.577 1.00 0.00 H new ATOM 0 HG23 THR A 90 -19.949 -5.721 -6.266 1.00 0.00 H new ATOM 1390 N ILE A 91 -18.500 -3.974 -3.580 1.00 0.00 N ATOM 1391 CA ILE A 91 -19.015 -3.184 -2.469 1.00 0.00 C ATOM 1392 C ILE A 91 -20.437 -2.716 -2.751 1.00 0.00 C ATOM 1393 O ILE A 91 -20.668 -1.910 -3.652 1.00 0.00 O ATOM 1394 CB ILE A 91 -18.129 -1.954 -2.194 1.00 0.00 C ATOM 1395 CG1 ILE A 91 -16.673 -2.381 -2.005 1.00 0.00 C ATOM 1396 CG2 ILE A 91 -18.631 -1.201 -0.972 1.00 0.00 C ATOM 1397 CD1 ILE A 91 -15.907 -2.504 -3.304 1.00 0.00 C ATOM 0 H ILE A 91 -18.410 -3.458 -4.455 1.00 0.00 H new ATOM 0 HA ILE A 91 -19.009 -3.828 -1.590 1.00 0.00 H new ATOM 0 HB ILE A 91 -18.183 -1.286 -3.053 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -16.171 -1.657 -1.363 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -16.648 -3.339 -1.485 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -17.994 -0.335 -0.791 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -19.655 -0.869 -1.144 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -18.604 -1.859 -0.103 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -14.882 -2.810 -3.094 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -16.386 -3.249 -3.939 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -15.901 -1.541 -3.815 1.00 0.00 H new ATOM 1409 N GLU A 92 -21.388 -3.227 -1.978 1.00 0.00 N ATOM 1410 CA GLU A 92 -22.790 -2.861 -2.151 1.00 0.00 C ATOM 1411 C GLU A 92 -23.286 -2.026 -0.977 1.00 0.00 C ATOM 1412 O GLU A 92 -22.745 -2.103 0.125 1.00 0.00 O ATOM 1413 CB GLU A 92 -23.651 -4.115 -2.299 1.00 0.00 C ATOM 1414 CG GLU A 92 -22.982 -5.221 -3.098 1.00 0.00 C ATOM 1415 CD GLU A 92 -23.882 -6.425 -3.294 1.00 0.00 C ATOM 1416 OE1 GLU A 92 -25.118 -6.248 -3.300 1.00 0.00 O ATOM 1417 OE2 GLU A 92 -23.351 -7.546 -3.441 1.00 0.00 O ATOM 0 H GLU A 92 -21.215 -3.895 -1.227 1.00 0.00 H new ATOM 0 HA GLU A 92 -22.872 -2.262 -3.058 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -23.900 -4.494 -1.308 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -24.590 -3.846 -2.782 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -22.685 -4.832 -4.072 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -22.071 -5.533 -2.588 1.00 0.00 H new ATOM 1424 N TRP A 93 -24.320 -1.230 -1.221 1.00 0.00 N ATOM 1425 CA TRP A 93 -24.894 -0.380 -0.184 1.00 0.00 C ATOM 1426 C TRP A 93 -26.356 -0.066 -0.489 1.00 0.00 C ATOM 1427 O TRP A 93 -26.691 0.365 -1.592 1.00 0.00 O ATOM 1428 CB TRP A 93 -24.093 0.918 -0.052 1.00 0.00 C ATOM 1429 CG TRP A 93 -24.282 1.857 -1.204 1.00 0.00 C ATOM 1430 CD1 TRP A 93 -24.953 3.047 -1.191 1.00 0.00 C ATOM 1431 CD2 TRP A 93 -23.794 1.686 -2.540 1.00 0.00 C ATOM 1432 NE1 TRP A 93 -24.914 3.624 -2.437 1.00 0.00 N ATOM 1433 CE2 TRP A 93 -24.207 2.808 -3.283 1.00 0.00 C ATOM 1434 CE3 TRP A 93 -23.048 0.692 -3.180 1.00 0.00 C ATOM 1435 CZ2 TRP A 93 -23.899 2.963 -4.631 1.00 0.00 C ATOM 1436 CZ3 TRP A 93 -22.743 0.848 -4.519 1.00 0.00 C ATOM 1437 CH2 TRP A 93 -23.167 1.976 -5.232 1.00 0.00 C ATOM 0 H TRP A 93 -24.779 -1.155 -2.129 1.00 0.00 H new ATOM 0 HA TRP A 93 -24.847 -0.920 0.762 1.00 0.00 H new ATOM 0 HB2 TRP A 93 -24.384 1.423 0.869 1.00 0.00 H new ATOM 0 HB3 TRP A 93 -23.034 0.675 0.038 1.00 0.00 H new ATOM 0 HD1 TRP A 93 -25.443 3.472 -0.327 1.00 0.00 H new ATOM 0 HE1 TRP A 93 -25.341 4.514 -2.692 1.00 0.00 H new ATOM 0 HE3 TRP A 93 -22.716 -0.181 -2.638 1.00 0.00 H new ATOM 0 HZ2 TRP A 93 -24.226 3.832 -5.183 1.00 0.00 H new ATOM 0 HZ3 TRP A 93 -22.168 0.086 -5.024 1.00 0.00 H new ATOM 0 HH2 TRP A 93 -22.911 2.069 -6.277 1.00 0.00 H new ATOM 1448 N THR A 94 -27.222 -0.286 0.496 1.00 0.00 N ATOM 1449 CA THR A 94 -28.649 -0.029 0.330 1.00 0.00 C ATOM 1450 C THR A 94 -29.191 0.805 1.487 1.00 0.00 C ATOM 1451 O THR A 94 -28.888 0.540 2.650 1.00 0.00 O ATOM 1452 CB THR A 94 -29.420 -1.345 0.233 1.00 0.00 C ATOM 1453 OG1 THR A 94 -30.816 -1.107 0.195 1.00 0.00 O ATOM 1454 CG2 THR A 94 -29.145 -2.286 1.386 1.00 0.00 C ATOM 0 H THR A 94 -26.961 -0.641 1.416 1.00 0.00 H new ATOM 0 HA THR A 94 -28.784 0.532 -0.595 1.00 0.00 H new ATOM 0 HB THR A 94 -29.075 -1.815 -0.688 1.00 0.00 H new ATOM 0 HG1 THR A 94 -31.079 -0.845 -0.712 1.00 0.00 H new ATOM 0 HG21 THR A 94 -29.724 -3.200 1.255 1.00 0.00 H new ATOM 0 HG22 THR A 94 -28.083 -2.529 1.412 1.00 0.00 H new ATOM 0 HG23 THR A 94 -29.430 -1.807 2.323 1.00 0.00 H new ATOM 1462 N ASN A 95 -29.992 1.813 1.160 1.00 0.00 N ATOM 1463 CA ASN A 95 -30.578 2.685 2.172 1.00 0.00 C ATOM 1464 C ASN A 95 -31.352 1.874 3.206 1.00 0.00 C ATOM 1465 O ASN A 95 -32.064 0.930 2.862 1.00 0.00 O ATOM 1466 CB ASN A 95 -31.501 3.714 1.517 1.00 0.00 C ATOM 1467 CG ASN A 95 -31.350 5.095 2.124 1.00 0.00 C ATOM 1468 OD1 ASN A 95 -30.948 5.239 3.278 1.00 0.00 O ATOM 1469 ND2 ASN A 95 -31.672 6.122 1.345 1.00 0.00 N ATOM 0 H ASN A 95 -30.251 2.047 0.201 1.00 0.00 H new ATOM 0 HA ASN A 95 -29.767 3.207 2.680 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -31.286 3.764 0.450 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -32.536 3.387 1.619 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -31.590 7.075 1.698 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -32.001 5.957 0.394 1.00 0.00 H new ATOM 1476 N THR A 96 -31.209 2.248 4.472 1.00 0.00 N ATOM 1477 CA THR A 96 -31.895 1.554 5.556 1.00 0.00 C ATOM 1478 C THR A 96 -33.367 1.957 5.613 1.00 0.00 C ATOM 1479 O THR A 96 -33.703 3.131 5.457 1.00 0.00 O ATOM 1480 CB THR A 96 -31.223 1.860 6.895 1.00 0.00 C ATOM 1481 OG1 THR A 96 -31.247 3.251 7.162 1.00 0.00 O ATOM 1482 CG2 THR A 96 -29.782 1.405 6.961 1.00 0.00 C ATOM 0 H THR A 96 -30.624 3.028 4.773 1.00 0.00 H new ATOM 0 HA THR A 96 -31.833 0.483 5.363 1.00 0.00 H new ATOM 0 HB THR A 96 -31.796 1.305 7.638 1.00 0.00 H new ATOM 0 HG1 THR A 96 -31.737 3.416 7.994 1.00 0.00 H new ATOM 0 HG21 THR A 96 -29.366 1.653 7.938 1.00 0.00 H new ATOM 0 HG22 THR A 96 -29.734 0.327 6.809 1.00 0.00 H new ATOM 0 HG23 THR A 96 -29.206 1.907 6.184 1.00 0.00 H new ATOM 1490 N PRO A 97 -34.268 0.987 5.847 1.00 0.00 N ATOM 1491 CA PRO A 97 -35.707 1.253 5.931 1.00 0.00 C ATOM 1492 C PRO A 97 -36.025 2.368 6.916 1.00 0.00 C ATOM 1493 O PRO A 97 -35.184 2.755 7.727 1.00 0.00 O ATOM 1494 CB PRO A 97 -36.289 -0.075 6.420 1.00 0.00 C ATOM 1495 CG PRO A 97 -35.303 -1.104 5.986 1.00 0.00 C ATOM 1496 CD PRO A 97 -33.956 -0.440 6.053 1.00 0.00 C ATOM 0 HA PRO A 97 -36.118 1.585 4.978 1.00 0.00 H new ATOM 0 HB2 PRO A 97 -36.413 -0.078 7.503 1.00 0.00 H new ATOM 0 HB3 PRO A 97 -37.272 -0.260 5.986 1.00 0.00 H new ATOM 0 HG2 PRO A 97 -35.340 -1.978 6.636 1.00 0.00 H new ATOM 0 HG3 PRO A 97 -35.518 -1.449 4.975 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -33.471 -0.611 7.014 1.00 0.00 H new ATOM 0 HD3 PRO A 97 -33.282 -0.819 5.284 1.00 0.00 H new ATOM 1504 N ASP A 98 -37.245 2.882 6.840 1.00 0.00 N ATOM 1505 CA ASP A 98 -37.680 3.956 7.726 1.00 0.00 C ATOM 1506 C ASP A 98 -37.384 3.612 9.183 1.00 0.00 C ATOM 1507 O ASP A 98 -38.067 2.784 9.786 1.00 0.00 O ATOM 1508 CB ASP A 98 -39.174 4.220 7.546 1.00 0.00 C ATOM 1509 CG ASP A 98 -39.485 4.918 6.237 1.00 0.00 C ATOM 1510 OD1 ASP A 98 -38.533 5.238 5.494 1.00 0.00 O ATOM 1511 OD2 ASP A 98 -40.680 5.146 5.955 1.00 0.00 O ATOM 0 H ASP A 98 -37.953 2.573 6.174 1.00 0.00 H new ATOM 0 HA ASP A 98 -37.125 4.857 7.464 1.00 0.00 H new ATOM 0 HB2 ASP A 98 -39.715 3.274 7.588 1.00 0.00 H new ATOM 0 HB3 ASP A 98 -39.535 4.830 8.374 1.00 0.00 H new ATOM 1516 N GLY A 99 -36.361 4.249 9.742 1.00 0.00 N ATOM 1517 CA GLY A 99 -35.994 3.995 11.122 1.00 0.00 C ATOM 1518 C GLY A 99 -35.819 2.517 11.410 1.00 0.00 C ATOM 1519 O GLY A 99 -36.359 1.999 12.388 1.00 0.00 O ATOM 0 H GLY A 99 -35.779 4.937 9.264 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -35.066 4.519 11.351 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -36.761 4.402 11.780 1.00 0.00 H new ATOM 1523 N ALA A 100 -35.064 1.837 10.555 1.00 0.00 N ATOM 1524 CA ALA A 100 -34.818 0.409 10.717 1.00 0.00 C ATOM 1525 C ALA A 100 -34.213 0.107 12.083 1.00 0.00 C ATOM 1526 O ALA A 100 -34.910 -0.328 13.000 1.00 0.00 O ATOM 1527 CB ALA A 100 -33.908 -0.098 9.610 1.00 0.00 C ATOM 0 H ALA A 100 -34.611 2.252 9.741 1.00 0.00 H new ATOM 0 HA ALA A 100 -35.775 -0.109 10.651 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -33.733 -1.166 9.743 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -34.381 0.074 8.643 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -32.957 0.433 9.649 1.00 0.00 H new ATOM 1533 N ALA A 101 -32.911 0.338 12.211 1.00 0.00 N ATOM 1534 CA ALA A 101 -32.211 0.087 13.465 1.00 0.00 C ATOM 1535 C ALA A 101 -30.733 0.419 13.348 1.00 0.00 C ATOM 1536 O ALA A 101 -30.199 0.568 12.250 1.00 0.00 O ATOM 1537 CB ALA A 101 -32.388 -1.362 13.890 1.00 0.00 C ATOM 0 H ALA A 101 -32.320 0.698 11.462 1.00 0.00 H new ATOM 0 HA ALA A 101 -32.646 0.737 14.225 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -31.859 -1.533 14.828 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -33.448 -1.574 14.027 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -31.983 -2.019 13.120 1.00 0.00 H new ATOM 1543 N LYS A 102 -30.080 0.529 14.496 1.00 0.00 N ATOM 1544 CA LYS A 102 -28.657 0.839 14.540 1.00 0.00 C ATOM 1545 C LYS A 102 -27.827 -0.436 14.577 1.00 0.00 C ATOM 1546 O LYS A 102 -27.215 -0.769 15.592 1.00 0.00 O ATOM 1547 CB LYS A 102 -28.336 1.713 15.754 1.00 0.00 C ATOM 1548 CG LYS A 102 -28.493 3.202 15.489 1.00 0.00 C ATOM 1549 CD LYS A 102 -27.714 4.030 16.498 1.00 0.00 C ATOM 1550 CE LYS A 102 -27.583 5.476 16.049 1.00 0.00 C ATOM 1551 NZ LYS A 102 -27.854 6.431 17.159 1.00 0.00 N ATOM 0 H LYS A 102 -30.513 0.408 15.411 1.00 0.00 H new ATOM 0 HA LYS A 102 -28.402 1.390 13.635 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -28.989 1.428 16.579 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -27.313 1.515 16.074 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -28.146 3.432 14.482 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -29.548 3.472 15.532 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -28.215 3.992 17.465 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -26.722 3.599 16.635 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -26.578 5.646 15.662 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -28.277 5.666 15.230 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -27.754 7.406 16.810 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -28.822 6.287 17.512 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -27.176 6.268 17.931 1.00 0.00 H new ATOM 1565 N GLN A 103 -27.817 -1.143 13.456 1.00 0.00 N ATOM 1566 CA GLN A 103 -27.067 -2.389 13.333 1.00 0.00 C ATOM 1567 C GLN A 103 -27.404 -3.096 12.024 1.00 0.00 C ATOM 1568 O GLN A 103 -28.553 -3.091 11.583 1.00 0.00 O ATOM 1569 CB GLN A 103 -27.364 -3.314 14.517 1.00 0.00 C ATOM 1570 CG GLN A 103 -28.835 -3.366 14.897 1.00 0.00 C ATOM 1571 CD GLN A 103 -29.052 -3.269 16.396 1.00 0.00 C ATOM 1572 OE1 GLN A 103 -29.901 -2.512 16.864 1.00 0.00 O ATOM 1573 NE2 GLN A 103 -28.280 -4.037 17.156 1.00 0.00 N ATOM 0 H GLN A 103 -28.323 -0.874 12.612 1.00 0.00 H new ATOM 0 HA GLN A 103 -26.005 -2.145 13.334 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -27.025 -4.321 14.274 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -26.786 -2.982 15.380 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -29.364 -2.551 14.403 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -29.269 -4.296 14.530 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -27.588 -4.650 16.725 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -28.379 -4.014 18.171 1.00 0.00 H new ATOM 1582 N PHE A 104 -26.395 -3.702 11.407 1.00 0.00 N ATOM 1583 CA PHE A 104 -26.587 -4.412 10.148 1.00 0.00 C ATOM 1584 C PHE A 104 -27.735 -5.409 10.250 1.00 0.00 C ATOM 1585 O PHE A 104 -27.874 -6.111 11.252 1.00 0.00 O ATOM 1586 CB PHE A 104 -25.302 -5.138 9.745 1.00 0.00 C ATOM 1587 CG PHE A 104 -25.296 -5.600 8.315 1.00 0.00 C ATOM 1588 CD1 PHE A 104 -25.172 -4.687 7.280 1.00 0.00 C ATOM 1589 CD2 PHE A 104 -25.412 -6.946 8.007 1.00 0.00 C ATOM 1590 CE1 PHE A 104 -25.165 -5.108 5.964 1.00 0.00 C ATOM 1591 CE2 PHE A 104 -25.406 -7.373 6.693 1.00 0.00 C ATOM 1592 CZ PHE A 104 -25.283 -6.453 5.670 1.00 0.00 C ATOM 0 H PHE A 104 -25.437 -3.716 11.758 1.00 0.00 H new ATOM 0 HA PHE A 104 -26.837 -3.676 9.384 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -24.453 -4.474 9.907 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -25.162 -6.000 10.397 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -25.080 -3.635 7.504 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -25.508 -7.669 8.803 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -25.067 -4.387 5.166 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -25.497 -8.425 6.466 1.00 0.00 H new ATOM 0 HZ PHE A 104 -25.279 -6.784 4.642 1.00 0.00 H new ATOM 1602 N ARG A 105 -28.554 -5.469 9.206 1.00 0.00 N ATOM 1603 CA ARG A 105 -29.690 -6.382 9.173 1.00 0.00 C ATOM 1604 C ARG A 105 -29.648 -7.248 7.917 1.00 0.00 C ATOM 1605 O ARG A 105 -29.141 -6.825 6.878 1.00 0.00 O ATOM 1606 CB ARG A 105 -31.005 -5.601 9.230 1.00 0.00 C ATOM 1607 CG ARG A 105 -31.958 -6.090 10.308 1.00 0.00 C ATOM 1608 CD ARG A 105 -31.812 -5.285 11.590 1.00 0.00 C ATOM 1609 NE ARG A 105 -33.062 -5.231 12.344 1.00 0.00 N ATOM 1610 CZ ARG A 105 -33.168 -4.698 13.558 1.00 0.00 C ATOM 1611 NH1 ARG A 105 -32.104 -4.175 14.151 1.00 0.00 N ATOM 1612 NH2 ARG A 105 -34.339 -4.689 14.179 1.00 0.00 N ATOM 0 H ARG A 105 -28.452 -4.895 8.369 1.00 0.00 H new ATOM 0 HA ARG A 105 -29.630 -7.033 10.045 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -30.785 -4.548 9.402 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -31.500 -5.669 8.261 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -32.984 -6.018 9.947 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -31.766 -7.143 10.515 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -31.033 -5.728 12.210 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -31.490 -4.272 11.348 1.00 0.00 H new ATOM 0 HE ARG A 105 -33.900 -5.624 11.916 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -31.201 -4.181 13.676 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -32.188 -3.767 15.082 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -35.160 -5.091 13.726 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -34.419 -4.280 15.110 1.00 0.00 H new ATOM 1626 N ARG A 106 -30.176 -8.463 8.021 1.00 0.00 N ATOM 1627 CA ARG A 106 -30.190 -9.387 6.891 1.00 0.00 C ATOM 1628 C ARG A 106 -31.549 -9.391 6.199 1.00 0.00 C ATOM 1629 O ARG A 106 -31.926 -10.372 5.558 1.00 0.00 O ATOM 1630 CB ARG A 106 -29.839 -10.800 7.360 1.00 0.00 C ATOM 1631 CG ARG A 106 -29.411 -11.727 6.234 1.00 0.00 C ATOM 1632 CD ARG A 106 -29.857 -13.156 6.489 1.00 0.00 C ATOM 1633 NE ARG A 106 -29.470 -14.053 5.403 1.00 0.00 N ATOM 1634 CZ ARG A 106 -29.908 -15.303 5.288 1.00 0.00 C ATOM 1635 NH1 ARG A 106 -30.744 -15.800 6.190 1.00 0.00 N ATOM 1636 NH2 ARG A 106 -29.509 -16.055 4.272 1.00 0.00 N ATOM 0 H ARG A 106 -30.599 -8.831 8.873 1.00 0.00 H new ATOM 0 HA ARG A 106 -29.443 -9.051 6.172 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -29.037 -10.741 8.095 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -30.703 -11.231 7.865 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -29.833 -11.376 5.292 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -28.327 -11.697 6.129 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -29.422 -13.510 7.424 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -30.940 -13.181 6.611 1.00 0.00 H new ATOM 0 HE ARG A 106 -28.828 -13.701 4.693 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -31.052 -15.223 6.973 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -31.079 -16.759 6.101 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -28.866 -15.675 3.578 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -29.845 -17.014 4.184 1.00 0.00 H new ATOM 1650 N GLU A 107 -32.280 -8.289 6.330 1.00 0.00 N ATOM 1651 CA GLU A 107 -33.598 -8.169 5.715 1.00 0.00 C ATOM 1652 C GLU A 107 -33.628 -7.051 4.674 1.00 0.00 C ATOM 1653 O GLU A 107 -34.538 -6.988 3.847 1.00 0.00 O ATOM 1654 CB GLU A 107 -34.661 -7.911 6.784 1.00 0.00 C ATOM 1655 CG GLU A 107 -34.444 -6.620 7.558 1.00 0.00 C ATOM 1656 CD GLU A 107 -35.735 -6.047 8.109 1.00 0.00 C ATOM 1657 OE1 GLU A 107 -36.710 -6.813 8.255 1.00 0.00 O ATOM 1658 OE2 GLU A 107 -35.771 -4.831 8.393 1.00 0.00 O ATOM 0 H GLU A 107 -31.983 -7.467 6.856 1.00 0.00 H new ATOM 0 HA GLU A 107 -33.815 -9.110 5.210 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -35.642 -7.880 6.309 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -34.672 -8.747 7.483 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -33.753 -6.805 8.380 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -33.973 -5.884 6.906 1.00 0.00 H new ATOM 1665 N TRP A 108 -32.635 -6.166 4.717 1.00 0.00 N ATOM 1666 CA TRP A 108 -32.563 -5.054 3.777 1.00 0.00 C ATOM 1667 C TRP A 108 -32.253 -5.541 2.362 1.00 0.00 C ATOM 1668 O TRP A 108 -32.488 -4.826 1.387 1.00 0.00 O ATOM 1669 CB TRP A 108 -31.499 -4.051 4.225 1.00 0.00 C ATOM 1670 CG TRP A 108 -31.733 -3.514 5.605 1.00 0.00 C ATOM 1671 CD1 TRP A 108 -32.915 -3.489 6.286 1.00 0.00 C ATOM 1672 CD2 TRP A 108 -30.758 -2.922 6.472 1.00 0.00 C ATOM 1673 NE1 TRP A 108 -32.735 -2.918 7.523 1.00 0.00 N ATOM 1674 CE2 TRP A 108 -31.419 -2.563 7.661 1.00 0.00 C ATOM 1675 CE3 TRP A 108 -29.388 -2.662 6.358 1.00 0.00 C ATOM 1676 CZ2 TRP A 108 -30.760 -1.957 8.727 1.00 0.00 C ATOM 1677 CZ3 TRP A 108 -28.735 -2.061 7.416 1.00 0.00 C ATOM 1678 CH2 TRP A 108 -29.420 -1.714 8.588 1.00 0.00 C ATOM 0 H TRP A 108 -31.871 -6.198 5.392 1.00 0.00 H new ATOM 0 HA TRP A 108 -33.537 -4.566 3.763 1.00 0.00 H new ATOM 0 HB2 TRP A 108 -30.521 -4.530 4.190 1.00 0.00 H new ATOM 0 HB3 TRP A 108 -31.472 -3.221 3.519 1.00 0.00 H new ATOM 0 HD1 TRP A 108 -33.855 -3.863 5.908 1.00 0.00 H new ATOM 0 HE1 TRP A 108 -33.463 -2.781 8.224 1.00 0.00 H new ATOM 0 HE3 TRP A 108 -28.851 -2.926 5.459 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 -31.287 -1.688 9.631 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 -27.678 -1.855 7.339 1.00 0.00 H new ATOM 0 HH2 TRP A 108 -28.880 -1.246 9.398 1.00 0.00 H new ATOM 1689 N PHE A 109 -31.719 -6.755 2.252 1.00 0.00 N ATOM 1690 CA PHE A 109 -31.376 -7.322 0.952 1.00 0.00 C ATOM 1691 C PHE A 109 -32.306 -8.477 0.589 1.00 0.00 C ATOM 1692 O PHE A 109 -31.903 -9.418 -0.092 1.00 0.00 O ATOM 1693 CB PHE A 109 -29.924 -7.805 0.952 1.00 0.00 C ATOM 1694 CG PHE A 109 -28.944 -6.767 1.419 1.00 0.00 C ATOM 1695 CD1 PHE A 109 -28.952 -6.330 2.734 1.00 0.00 C ATOM 1696 CD2 PHE A 109 -28.016 -6.228 0.542 1.00 0.00 C ATOM 1697 CE1 PHE A 109 -28.051 -5.374 3.165 1.00 0.00 C ATOM 1698 CE2 PHE A 109 -27.114 -5.271 0.968 1.00 0.00 C ATOM 1699 CZ PHE A 109 -27.131 -4.845 2.281 1.00 0.00 C ATOM 0 H PHE A 109 -31.515 -7.363 3.045 1.00 0.00 H new ATOM 0 HA PHE A 109 -31.496 -6.539 0.204 1.00 0.00 H new ATOM 0 HB2 PHE A 109 -29.842 -8.683 1.592 1.00 0.00 H new ATOM 0 HB3 PHE A 109 -29.655 -8.119 -0.056 1.00 0.00 H new ATOM 0 HD1 PHE A 109 -29.669 -6.740 3.429 1.00 0.00 H new ATOM 0 HD2 PHE A 109 -27.997 -6.559 -0.486 1.00 0.00 H new ATOM 0 HE1 PHE A 109 -28.067 -5.041 4.192 1.00 0.00 H new ATOM 0 HE2 PHE A 109 -26.397 -4.857 0.275 1.00 0.00 H new ATOM 0 HZ PHE A 109 -26.426 -4.099 2.617 1.00 0.00 H new ATOM 1709 N GLN A 110 -33.551 -8.401 1.048 1.00 0.00 N ATOM 1710 CA GLN A 110 -34.533 -9.443 0.766 1.00 0.00 C ATOM 1711 C GLN A 110 -35.683 -8.909 -0.085 1.00 0.00 C ATOM 1712 O GLN A 110 -36.380 -9.675 -0.751 1.00 0.00 O ATOM 1713 CB GLN A 110 -35.078 -10.027 2.071 1.00 0.00 C ATOM 1714 CG GLN A 110 -35.927 -9.048 2.867 1.00 0.00 C ATOM 1715 CD GLN A 110 -37.392 -9.437 2.896 1.00 0.00 C ATOM 1716 OE1 GLN A 110 -38.258 -8.667 2.482 1.00 0.00 O ATOM 1717 NE2 GLN A 110 -37.678 -10.636 3.391 1.00 0.00 N ATOM 0 H GLN A 110 -33.904 -7.631 1.616 1.00 0.00 H new ATOM 0 HA GLN A 110 -34.030 -10.229 0.203 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -35.674 -10.911 1.843 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -34.243 -10.357 2.689 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -35.549 -8.992 3.888 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -35.828 -8.052 2.435 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -36.928 -11.243 3.723 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -38.647 -10.950 3.439 1.00 0.00 H new ATOM 1726 N GLY A 111 -35.879 -7.594 -0.058 1.00 0.00 N ATOM 1727 CA GLY A 111 -36.948 -6.989 -0.830 1.00 0.00 C ATOM 1728 C GLY A 111 -36.640 -6.936 -2.314 1.00 0.00 C ATOM 1729 O GLY A 111 -35.578 -7.382 -2.750 1.00 0.00 O ATOM 0 H GLY A 111 -35.317 -6.938 0.484 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -37.868 -7.553 -0.674 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -37.128 -5.978 -0.464 1.00 0.00 H new ATOM 1733 N ASP A 112 -37.569 -6.388 -3.090 1.00 0.00 N ATOM 1734 CA ASP A 112 -37.394 -6.276 -4.532 1.00 0.00 C ATOM 1735 C ASP A 112 -36.900 -4.883 -4.910 1.00 0.00 C ATOM 1736 O ASP A 112 -37.502 -3.878 -4.534 1.00 0.00 O ATOM 1737 CB ASP A 112 -38.710 -6.575 -5.252 1.00 0.00 C ATOM 1738 CG ASP A 112 -38.800 -8.014 -5.720 1.00 0.00 C ATOM 1739 OD1 ASP A 112 -38.022 -8.852 -5.216 1.00 0.00 O ATOM 1740 OD2 ASP A 112 -39.649 -8.305 -6.589 1.00 0.00 O ATOM 0 H ASP A 112 -38.452 -6.014 -2.743 1.00 0.00 H new ATOM 0 HA ASP A 112 -36.646 -7.006 -4.841 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -39.544 -6.361 -4.583 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -38.811 -5.910 -6.110 1.00 0.00 H new ATOM 1745 N GLY A 113 -35.799 -4.831 -5.651 1.00 0.00 N ATOM 1746 CA GLY A 113 -35.243 -3.555 -6.060 1.00 0.00 C ATOM 1747 C GLY A 113 -34.323 -2.966 -5.009 1.00 0.00 C ATOM 1748 O GLY A 113 -33.991 -3.628 -4.026 1.00 0.00 O ATOM 0 H GLY A 113 -35.282 -5.648 -5.975 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -34.692 -3.683 -6.992 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -36.054 -2.856 -6.263 1.00 0.00 H new ATOM 1752 N MET A 114 -33.910 -1.720 -5.213 1.00 0.00 N ATOM 1753 CA MET A 114 -33.025 -1.048 -4.269 1.00 0.00 C ATOM 1754 C MET A 114 -31.726 -1.823 -4.094 1.00 0.00 C ATOM 1755 O MET A 114 -31.633 -2.995 -4.459 1.00 0.00 O ATOM 1756 CB MET A 114 -33.720 -0.884 -2.916 1.00 0.00 C ATOM 1757 CG MET A 114 -34.799 0.185 -2.913 1.00 0.00 C ATOM 1758 SD MET A 114 -36.324 -0.372 -2.125 1.00 0.00 S ATOM 1759 CE MET A 114 -37.064 1.196 -1.671 1.00 0.00 C ATOM 0 H MET A 114 -34.173 -1.156 -6.021 1.00 0.00 H new ATOM 0 HA MET A 114 -32.787 -0.063 -4.671 1.00 0.00 H new ATOM 0 HB2 MET A 114 -34.163 -1.837 -2.627 1.00 0.00 H new ATOM 0 HB3 MET A 114 -32.974 -0.637 -2.161 1.00 0.00 H new ATOM 0 HG2 MET A 114 -34.428 1.069 -2.394 1.00 0.00 H new ATOM 0 HG3 MET A 114 -35.013 0.484 -3.939 1.00 0.00 H new ATOM 0 HE1 MET A 114 -38.017 1.018 -1.172 1.00 0.00 H new ATOM 0 HE2 MET A 114 -36.396 1.732 -0.997 1.00 0.00 H new ATOM 0 HE3 MET A 114 -37.230 1.793 -2.568 1.00 0.00 H new ATOM 1769 N VAL A 115 -30.725 -1.154 -3.531 1.00 0.00 N ATOM 1770 CA VAL A 115 -29.415 -1.761 -3.294 1.00 0.00 C ATOM 1771 C VAL A 115 -28.549 -1.713 -4.548 1.00 0.00 C ATOM 1772 O VAL A 115 -28.832 -2.388 -5.537 1.00 0.00 O ATOM 1773 CB VAL A 115 -29.532 -3.227 -2.826 1.00 0.00 C ATOM 1774 CG1 VAL A 115 -28.220 -3.700 -2.217 1.00 0.00 C ATOM 1775 CG2 VAL A 115 -30.675 -3.382 -1.834 1.00 0.00 C ATOM 0 H VAL A 115 -30.795 -0.183 -3.227 1.00 0.00 H new ATOM 0 HA VAL A 115 -28.947 -1.176 -2.503 1.00 0.00 H new ATOM 0 HB VAL A 115 -29.748 -3.850 -3.694 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -28.322 -4.736 -1.893 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -27.427 -3.629 -2.961 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -27.970 -3.074 -1.360 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -30.742 -4.422 -1.515 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -30.492 -2.748 -0.966 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -31.611 -3.087 -2.308 1.00 0.00 H new ATOM 1785 N ARG A 116 -27.488 -0.914 -4.495 1.00 0.00 N ATOM 1786 CA ARG A 116 -26.573 -0.781 -5.622 1.00 0.00 C ATOM 1787 C ARG A 116 -25.326 -1.628 -5.403 1.00 0.00 C ATOM 1788 O ARG A 116 -24.930 -1.881 -4.265 1.00 0.00 O ATOM 1789 CB ARG A 116 -26.185 0.685 -5.820 1.00 0.00 C ATOM 1790 CG ARG A 116 -27.329 1.557 -6.312 1.00 0.00 C ATOM 1791 CD ARG A 116 -27.204 1.853 -7.797 1.00 0.00 C ATOM 1792 NE ARG A 116 -26.832 3.242 -8.048 1.00 0.00 N ATOM 1793 CZ ARG A 116 -26.738 3.771 -9.264 1.00 0.00 C ATOM 1794 NH1 ARG A 116 -26.991 3.029 -10.333 1.00 0.00 N ATOM 1795 NH2 ARG A 116 -26.392 5.042 -9.411 1.00 0.00 N ATOM 0 H ARG A 116 -27.241 -0.349 -3.683 1.00 0.00 H new ATOM 0 HA ARG A 116 -27.080 -1.136 -6.519 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -25.815 1.085 -4.876 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -25.363 0.741 -6.534 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -28.278 1.057 -6.118 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -27.341 2.493 -5.753 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -26.457 1.192 -8.237 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -28.151 1.636 -8.291 1.00 0.00 H new ATOM 0 HE ARG A 116 -26.633 3.840 -7.246 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -27.258 2.051 -10.223 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -26.918 3.436 -11.265 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -26.197 5.616 -8.590 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -26.320 5.446 -10.345 1.00 0.00 H new ATOM 1809 N ARG A 117 -24.712 -2.071 -6.496 1.00 0.00 N ATOM 1810 CA ARG A 117 -23.514 -2.896 -6.412 1.00 0.00 C ATOM 1811 C ARG A 117 -22.326 -2.217 -7.086 1.00 0.00 C ATOM 1812 O ARG A 117 -22.465 -1.599 -8.142 1.00 0.00 O ATOM 1813 CB ARG A 117 -23.766 -4.261 -7.055 1.00 0.00 C ATOM 1814 CG ARG A 117 -22.544 -5.164 -7.065 1.00 0.00 C ATOM 1815 CD ARG A 117 -22.886 -6.558 -7.565 1.00 0.00 C ATOM 1816 NE ARG A 117 -23.767 -7.271 -6.642 1.00 0.00 N ATOM 1817 CZ ARG A 117 -23.904 -8.592 -6.630 1.00 0.00 C ATOM 1818 NH1 ARG A 117 -23.226 -9.339 -7.491 1.00 0.00 N ATOM 1819 NH2 ARG A 117 -24.723 -9.169 -5.761 1.00 0.00 N ATOM 0 H ARG A 117 -25.024 -1.873 -7.447 1.00 0.00 H new ATOM 0 HA ARG A 117 -23.275 -3.033 -5.357 1.00 0.00 H new ATOM 0 HB2 ARG A 117 -24.573 -4.762 -6.520 1.00 0.00 H new ATOM 0 HB3 ARG A 117 -24.106 -4.113 -8.080 1.00 0.00 H new ATOM 0 HG2 ARG A 117 -21.773 -4.728 -7.700 1.00 0.00 H new ATOM 0 HG3 ARG A 117 -22.130 -5.229 -6.059 1.00 0.00 H new ATOM 0 HD2 ARG A 117 -23.366 -6.485 -8.541 1.00 0.00 H new ATOM 0 HD3 ARG A 117 -21.968 -7.129 -7.703 1.00 0.00 H new ATOM 0 HE ARG A 117 -24.306 -6.724 -5.970 1.00 0.00 H new ATOM 0 HH11 ARG A 117 -22.598 -8.899 -8.164 1.00 0.00 H new ATOM 0 HH12 ARG A 117 -23.332 -10.353 -7.480 1.00 0.00 H new ATOM 0 HH21 ARG A 117 -25.250 -8.598 -5.100 1.00 0.00 H new ATOM 0 HH22 ARG A 117 -24.826 -10.184 -5.754 1.00 0.00 H new ATOM 1833 N LYS A 118 -21.157 -2.343 -6.468 1.00 0.00 N ATOM 1834 CA LYS A 118 -19.936 -1.751 -7.001 1.00 0.00 C ATOM 1835 C LYS A 118 -18.846 -2.805 -7.136 1.00 0.00 C ATOM 1836 O LYS A 118 -18.925 -3.877 -6.535 1.00 0.00 O ATOM 1837 CB LYS A 118 -19.457 -0.613 -6.099 1.00 0.00 C ATOM 1838 CG LYS A 118 -18.856 0.556 -6.862 1.00 0.00 C ATOM 1839 CD LYS A 118 -19.002 1.859 -6.092 1.00 0.00 C ATOM 1840 CE LYS A 118 -17.914 2.853 -6.467 1.00 0.00 C ATOM 1841 NZ LYS A 118 -18.319 3.713 -7.614 1.00 0.00 N ATOM 0 H LYS A 118 -21.029 -2.852 -5.594 1.00 0.00 H new ATOM 0 HA LYS A 118 -20.155 -1.347 -7.989 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -20.297 -0.254 -5.504 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -18.715 -1.001 -5.402 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -17.801 0.362 -7.054 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -19.345 0.649 -7.832 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -19.980 2.295 -6.295 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -18.959 1.657 -5.022 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -17.683 3.481 -5.606 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -17.002 2.314 -6.722 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -17.550 4.377 -7.839 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -18.515 3.116 -8.443 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -19.175 4.247 -7.362 1.00 0.00 H new ATOM 1855 N ASN A 119 -17.832 -2.497 -7.932 1.00 0.00 N ATOM 1856 CA ASN A 119 -16.726 -3.422 -8.149 1.00 0.00 C ATOM 1857 C ASN A 119 -15.383 -2.724 -7.967 1.00 0.00 C ATOM 1858 O ASN A 119 -15.266 -1.516 -8.174 1.00 0.00 O ATOM 1859 CB ASN A 119 -16.811 -4.034 -9.548 1.00 0.00 C ATOM 1860 CG ASN A 119 -18.218 -4.473 -9.902 1.00 0.00 C ATOM 1861 OD1 ASN A 119 -18.830 -3.947 -10.831 1.00 0.00 O ATOM 1862 ND2 ASN A 119 -18.737 -5.445 -9.161 1.00 0.00 N ATOM 0 H ASN A 119 -17.751 -1.615 -8.438 1.00 0.00 H new ATOM 0 HA ASN A 119 -16.803 -4.217 -7.407 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -16.465 -3.306 -10.282 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -16.140 -4.891 -9.608 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -19.680 -5.784 -9.353 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -18.193 -5.852 -8.400 1.00 0.00 H new ATOM 1869 N LEU A 120 -14.373 -3.496 -7.580 1.00 0.00 N ATOM 1870 CA LEU A 120 -13.035 -2.960 -7.371 1.00 0.00 C ATOM 1871 C LEU A 120 -11.977 -3.921 -7.911 1.00 0.00 C ATOM 1872 O LEU A 120 -11.575 -4.860 -7.226 1.00 0.00 O ATOM 1873 CB LEU A 120 -12.795 -2.702 -5.880 1.00 0.00 C ATOM 1874 CG LEU A 120 -12.546 -1.239 -5.508 1.00 0.00 C ATOM 1875 CD1 LEU A 120 -13.864 -0.507 -5.304 1.00 0.00 C ATOM 1876 CD2 LEU A 120 -11.686 -1.149 -4.255 1.00 0.00 C ATOM 0 H LEU A 120 -14.457 -4.497 -7.405 1.00 0.00 H new ATOM 0 HA LEU A 120 -12.956 -2.017 -7.913 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -13.659 -3.061 -5.321 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -11.938 -3.294 -5.558 1.00 0.00 H new ATOM 0 HG LEU A 120 -12.012 -0.761 -6.329 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -13.666 0.532 -5.040 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -14.446 -0.543 -6.225 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -14.425 -0.985 -4.501 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -11.518 -0.102 -4.004 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -12.195 -1.644 -3.428 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -10.728 -1.637 -4.435 1.00 0.00 H new ATOM 1888 N PRO A 121 -11.510 -3.701 -9.152 1.00 0.00 N ATOM 1889 CA PRO A 121 -10.497 -4.558 -9.775 1.00 0.00 C ATOM 1890 C PRO A 121 -9.175 -4.534 -9.015 1.00 0.00 C ATOM 1891 O PRO A 121 -8.623 -3.469 -8.744 1.00 0.00 O ATOM 1892 CB PRO A 121 -10.322 -3.963 -11.176 1.00 0.00 C ATOM 1893 CG PRO A 121 -10.839 -2.569 -11.075 1.00 0.00 C ATOM 1894 CD PRO A 121 -11.930 -2.605 -10.044 1.00 0.00 C ATOM 0 HA PRO A 121 -10.804 -5.604 -9.784 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -9.276 -3.974 -11.481 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -10.876 -4.536 -11.919 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -10.047 -1.880 -10.781 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -11.221 -2.224 -12.036 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -12.011 -1.659 -9.509 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -12.903 -2.801 -10.494 1.00 0.00 H new ATOM 1902 N ILE A 122 -8.675 -5.717 -8.674 1.00 0.00 N ATOM 1903 CA ILE A 122 -7.420 -5.832 -7.943 1.00 0.00 C ATOM 1904 C ILE A 122 -6.249 -6.081 -8.887 1.00 0.00 C ATOM 1905 O ILE A 122 -6.423 -6.612 -9.984 1.00 0.00 O ATOM 1906 CB ILE A 122 -7.479 -6.969 -6.904 1.00 0.00 C ATOM 1907 CG1 ILE A 122 -8.818 -6.942 -6.164 1.00 0.00 C ATOM 1908 CG2 ILE A 122 -6.323 -6.853 -5.923 1.00 0.00 C ATOM 1909 CD1 ILE A 122 -9.120 -5.610 -5.512 1.00 0.00 C ATOM 0 H ILE A 122 -9.120 -6.609 -8.892 1.00 0.00 H new ATOM 0 HA ILE A 122 -7.268 -4.884 -7.428 1.00 0.00 H new ATOM 0 HB ILE A 122 -7.391 -7.922 -7.425 1.00 0.00 H new ATOM 0 HG12 ILE A 122 -9.617 -7.184 -6.865 1.00 0.00 H new ATOM 0 HG13 ILE A 122 -8.818 -7.720 -5.400 1.00 0.00 H new ATOM 0 HG21 ILE A 122 -6.380 -7.663 -5.196 1.00 0.00 H new ATOM 0 HG22 ILE A 122 -5.379 -6.916 -6.464 1.00 0.00 H new ATOM 0 HG23 ILE A 122 -6.381 -5.896 -5.404 1.00 0.00 H new ATOM 0 HD11 ILE A 122 -10.084 -5.663 -5.006 1.00 0.00 H new ATOM 0 HD12 ILE A 122 -8.341 -5.375 -4.786 1.00 0.00 H new ATOM 0 HD13 ILE A 122 -9.153 -4.831 -6.274 1.00 0.00 H new ATOM 1921 N GLU A 123 -5.054 -5.693 -8.452 1.00 0.00 N ATOM 1922 CA GLU A 123 -3.849 -5.869 -9.253 1.00 0.00 C ATOM 1923 C GLU A 123 -2.647 -6.165 -8.368 1.00 0.00 C ATOM 1924 O GLU A 123 -2.681 -5.940 -7.161 1.00 0.00 O ATOM 1925 CB GLU A 123 -3.585 -4.623 -10.099 1.00 0.00 C ATOM 1926 CG GLU A 123 -4.589 -4.427 -11.224 1.00 0.00 C ATOM 1927 CD GLU A 123 -4.218 -3.281 -12.144 1.00 0.00 C ATOM 1928 OE1 GLU A 123 -3.359 -2.461 -11.757 1.00 0.00 O ATOM 1929 OE2 GLU A 123 -4.789 -3.202 -13.253 1.00 0.00 O ATOM 0 H GLU A 123 -4.895 -5.253 -7.546 1.00 0.00 H new ATOM 0 HA GLU A 123 -4.005 -6.720 -9.916 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -3.600 -3.745 -9.453 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -2.584 -4.688 -10.524 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -4.661 -5.346 -11.806 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -5.575 -4.241 -10.798 1.00 0.00 H new ATOM 1936 N TYR A 124 -1.589 -6.678 -8.978 1.00 0.00 N ATOM 1937 CA TYR A 124 -0.374 -7.013 -8.246 1.00 0.00 C ATOM 1938 C TYR A 124 0.843 -6.327 -8.860 1.00 0.00 C ATOM 1939 O TYR A 124 1.160 -6.530 -10.032 1.00 0.00 O ATOM 1940 CB TYR A 124 -0.169 -8.528 -8.228 1.00 0.00 C ATOM 1941 CG TYR A 124 -1.328 -9.286 -7.620 1.00 0.00 C ATOM 1942 CD1 TYR A 124 -2.514 -9.457 -8.321 1.00 0.00 C ATOM 1943 CD2 TYR A 124 -1.235 -9.827 -6.343 1.00 0.00 C ATOM 1944 CE1 TYR A 124 -3.577 -10.147 -7.769 1.00 0.00 C ATOM 1945 CE2 TYR A 124 -2.293 -10.519 -5.784 1.00 0.00 C ATOM 1946 CZ TYR A 124 -3.461 -10.676 -6.500 1.00 0.00 C ATOM 1947 OH TYR A 124 -4.517 -11.363 -5.946 1.00 0.00 O ATOM 0 H TYR A 124 -1.546 -6.872 -9.978 1.00 0.00 H new ATOM 0 HA TYR A 124 -0.486 -6.656 -7.222 1.00 0.00 H new ATOM 0 HB2 TYR A 124 -0.012 -8.878 -9.248 1.00 0.00 H new ATOM 0 HB3 TYR A 124 0.738 -8.757 -7.669 1.00 0.00 H new ATOM 0 HD1 TYR A 124 -2.608 -9.044 -9.314 1.00 0.00 H new ATOM 0 HD2 TYR A 124 -0.322 -9.705 -5.779 1.00 0.00 H new ATOM 0 HE1 TYR A 124 -4.493 -10.271 -8.328 1.00 0.00 H new ATOM 0 HE2 TYR A 124 -2.205 -10.935 -4.791 1.00 0.00 H new ATOM 0 HH TYR A 124 -4.988 -11.859 -6.647 1.00 0.00 H new ATOM 1957 N ASN A 125 1.522 -5.513 -8.056 1.00 0.00 N ATOM 1958 CA ASN A 125 2.705 -4.794 -8.513 1.00 0.00 C ATOM 1959 C ASN A 125 3.980 -5.486 -8.041 1.00 0.00 C ATOM 1960 O ASN A 125 4.504 -5.180 -6.971 1.00 0.00 O ATOM 1961 CB ASN A 125 2.678 -3.351 -8.004 1.00 0.00 C ATOM 1962 CG ASN A 125 3.590 -2.438 -8.801 1.00 0.00 C ATOM 1963 OD1 ASN A 125 3.748 -2.602 -10.011 1.00 0.00 O ATOM 1964 ND2 ASN A 125 4.196 -1.469 -8.125 1.00 0.00 N ATOM 0 H ASN A 125 1.272 -5.335 -7.083 1.00 0.00 H new ATOM 0 HA ASN A 125 2.697 -4.790 -9.603 1.00 0.00 H new ATOM 0 HB2 ASN A 125 1.657 -2.971 -8.051 1.00 0.00 H new ATOM 0 HB3 ASN A 125 2.977 -3.333 -6.956 1.00 0.00 H new ATOM 0 HD21 ASN A 125 4.821 -0.824 -8.608 1.00 0.00 H new ATOM 0 HD22 ASN A 125 4.036 -1.370 -7.123 1.00 0.00 H new ATOM 1971 N LEU A 126 4.471 -6.422 -8.847 1.00 0.00 N ATOM 1972 CA LEU A 126 5.684 -7.159 -8.511 1.00 0.00 C ATOM 1973 C LEU A 126 6.897 -6.234 -8.492 1.00 0.00 C ATOM 1974 O LEU A 126 7.063 -5.460 -9.457 1.00 0.00 O ATOM 1975 CB LEU A 126 5.909 -8.295 -9.512 1.00 0.00 C ATOM 1976 CG LEU A 126 4.741 -9.271 -9.653 1.00 0.00 C ATOM 1977 CD1 LEU A 126 5.015 -10.273 -10.764 1.00 0.00 C ATOM 1978 CD2 LEU A 126 4.485 -9.990 -8.337 1.00 0.00 C ATOM 1979 OXT LEU A 126 7.668 -6.292 -7.512 1.00 0.00 O ATOM 0 H LEU A 126 4.048 -6.688 -9.736 1.00 0.00 H new ATOM 0 HA LEU A 126 5.558 -7.581 -7.514 1.00 0.00 H new ATOM 0 HB2 LEU A 126 6.121 -7.861 -10.489 1.00 0.00 H new ATOM 0 HB3 LEU A 126 6.796 -8.853 -9.212 1.00 0.00 H new ATOM 0 HG LEU A 126 3.848 -8.704 -9.914 1.00 0.00 H new ATOM 0 HD11 LEU A 126 4.173 -10.960 -10.850 1.00 0.00 H new ATOM 0 HD12 LEU A 126 5.149 -9.743 -11.707 1.00 0.00 H new ATOM 0 HD13 LEU A 126 5.920 -10.835 -10.532 1.00 0.00 H new ATOM 0 HD21 LEU A 126 3.650 -10.681 -8.456 1.00 0.00 H new ATOM 0 HD22 LEU A 126 5.377 -10.545 -8.046 1.00 0.00 H new ATOM 0 HD23 LEU A 126 4.244 -9.260 -7.564 1.00 0.00 H new TER 1991 LEU A 126 ATOM 1992 N ALA B 1 44.321 -0.624 -2.142 1.00 0.00 N ATOM 1993 CA ALA B 1 42.997 -0.988 -1.575 1.00 0.00 C ATOM 1994 C ALA B 1 42.358 -2.125 -2.365 1.00 0.00 C ATOM 1995 O ALA B 1 41.473 -1.899 -3.190 1.00 0.00 O ATOM 1996 CB ALA B 1 42.079 0.225 -1.558 1.00 0.00 C ATOM 0 H1 ALA B 1 44.735 0.152 -1.587 1.00 0.00 H new ATOM 0 H2 ALA B 1 44.952 -1.450 -2.107 1.00 0.00 H new ATOM 0 H3 ALA B 1 44.204 -0.319 -3.129 1.00 0.00 H new ATOM 0 HA ALA B 1 43.148 -1.330 -0.551 1.00 0.00 H new ATOM 0 HB1 ALA B 1 41.112 -0.056 -1.140 1.00 0.00 H new ATOM 0 HB2 ALA B 1 42.524 1.010 -0.946 1.00 0.00 H new ATOM 0 HB3 ALA B 1 41.942 0.592 -2.575 1.00 0.00 H new ATOM 2004 N GLN B 2 42.810 -3.348 -2.106 1.00 0.00 N ATOM 2005 CA GLN B 2 42.282 -4.521 -2.793 1.00 0.00 C ATOM 2006 C GLN B 2 41.661 -5.500 -1.802 1.00 0.00 C ATOM 2007 O GLN B 2 42.276 -5.856 -0.797 1.00 0.00 O ATOM 2008 CB GLN B 2 43.388 -5.216 -3.589 1.00 0.00 C ATOM 2009 CG GLN B 2 44.672 -5.415 -2.801 1.00 0.00 C ATOM 2010 CD GLN B 2 45.758 -6.088 -3.619 1.00 0.00 C ATOM 2011 OE1 GLN B 2 45.616 -6.273 -4.827 1.00 0.00 O ATOM 2012 NE2 GLN B 2 46.850 -6.459 -2.961 1.00 0.00 N ATOM 0 H GLN B 2 43.541 -3.552 -1.425 1.00 0.00 H new ATOM 0 HA GLN B 2 41.505 -4.187 -3.481 1.00 0.00 H new ATOM 0 HB2 GLN B 2 43.025 -6.187 -3.928 1.00 0.00 H new ATOM 0 HB3 GLN B 2 43.606 -4.628 -4.481 1.00 0.00 H new ATOM 0 HG2 GLN B 2 45.033 -4.448 -2.450 1.00 0.00 H new ATOM 0 HG3 GLN B 2 44.462 -6.017 -1.917 1.00 0.00 H new ATOM 0 HE21 GLN B 2 46.925 -6.286 -1.959 1.00 0.00 H new ATOM 0 HE22 GLN B 2 47.614 -6.917 -3.458 1.00 0.00 H new ATOM 2021 N SER B 3 40.439 -5.931 -2.093 1.00 0.00 N ATOM 2022 CA SER B 3 39.731 -6.870 -1.229 1.00 0.00 C ATOM 2023 C SER B 3 38.557 -7.504 -1.968 1.00 0.00 C ATOM 2024 O SER B 3 38.639 -8.646 -2.420 1.00 0.00 O ATOM 2025 CB SER B 3 39.234 -6.160 0.031 1.00 0.00 C ATOM 2026 OG SER B 3 38.302 -6.963 0.735 1.00 0.00 O ATOM 0 H SER B 3 39.917 -5.645 -2.921 1.00 0.00 H new ATOM 0 HA SER B 3 40.426 -7.659 -0.941 1.00 0.00 H new ATOM 0 HB2 SER B 3 40.079 -5.927 0.678 1.00 0.00 H new ATOM 0 HB3 SER B 3 38.770 -5.212 -0.241 1.00 0.00 H new ATOM 0 HG SER B 3 38.001 -6.487 1.537 1.00 0.00 H new ATOM 2032 N VAL B 4 37.467 -6.754 -2.088 1.00 0.00 N ATOM 2033 CA VAL B 4 36.278 -7.241 -2.776 1.00 0.00 C ATOM 2034 C VAL B 4 35.181 -6.179 -2.799 1.00 0.00 C ATOM 2035 O VAL B 4 34.947 -5.496 -1.801 1.00 0.00 O ATOM 2036 CB VAL B 4 35.728 -8.517 -2.113 1.00 0.00 C ATOM 2037 CG1 VAL B 4 35.402 -8.262 -0.649 1.00 0.00 C ATOM 2038 CG2 VAL B 4 34.501 -9.020 -2.859 1.00 0.00 C ATOM 0 H VAL B 4 37.383 -5.807 -1.718 1.00 0.00 H new ATOM 0 HA VAL B 4 36.577 -7.472 -3.798 1.00 0.00 H new ATOM 0 HB VAL B 4 36.497 -9.288 -2.161 1.00 0.00 H new ATOM 0 HG11 VAL B 4 35.015 -9.176 -0.198 1.00 0.00 H new ATOM 0 HG12 VAL B 4 36.306 -7.953 -0.124 1.00 0.00 H new ATOM 0 HG13 VAL B 4 34.652 -7.475 -0.575 1.00 0.00 H new ATOM 0 HG21 VAL B 4 34.126 -9.922 -2.376 1.00 0.00 H new ATOM 0 HG22 VAL B 4 33.727 -8.253 -2.845 1.00 0.00 H new ATOM 0 HG23 VAL B 4 34.770 -9.246 -3.891 1.00 0.00 H new ATOM 2048 N PRO B 5 34.489 -6.024 -3.941 1.00 0.00 N ATOM 2049 CA PRO B 5 33.413 -5.039 -4.086 1.00 0.00 C ATOM 2050 C PRO B 5 32.125 -5.479 -3.395 1.00 0.00 C ATOM 2051 O PRO B 5 31.935 -6.662 -3.113 1.00 0.00 O ATOM 2052 CB PRO B 5 33.211 -4.967 -5.598 1.00 0.00 C ATOM 2053 CG PRO B 5 33.600 -6.319 -6.091 1.00 0.00 C ATOM 2054 CD PRO B 5 34.701 -6.796 -5.182 1.00 0.00 C ATOM 0 HA PRO B 5 33.666 -4.083 -3.627 1.00 0.00 H new ATOM 0 HB2 PRO B 5 32.176 -4.735 -5.850 1.00 0.00 H new ATOM 0 HB3 PRO B 5 33.830 -4.188 -6.045 1.00 0.00 H new ATOM 0 HG2 PRO B 5 32.751 -7.002 -6.066 1.00 0.00 H new ATOM 0 HG3 PRO B 5 33.941 -6.273 -7.125 1.00 0.00 H new ATOM 0 HD2 PRO B 5 34.635 -7.869 -5.002 1.00 0.00 H new ATOM 0 HD3 PRO B 5 35.685 -6.604 -5.610 1.00 0.00 H new ATOM 2062 N PRO B 6 31.218 -4.528 -3.114 1.00 0.00 N ATOM 2063 CA PRO B 6 29.943 -4.825 -2.453 1.00 0.00 C ATOM 2064 C PRO B 6 29.004 -5.632 -3.343 1.00 0.00 C ATOM 2065 O PRO B 6 28.810 -5.307 -4.514 1.00 0.00 O ATOM 2066 CB PRO B 6 29.352 -3.442 -2.172 1.00 0.00 C ATOM 2067 CG PRO B 6 29.980 -2.547 -3.184 1.00 0.00 C ATOM 2068 CD PRO B 6 31.362 -3.093 -3.417 1.00 0.00 C ATOM 0 HA PRO B 6 30.083 -5.432 -1.558 1.00 0.00 H new ATOM 0 HB2 PRO B 6 28.266 -3.449 -2.269 1.00 0.00 H new ATOM 0 HB3 PRO B 6 29.579 -3.113 -1.158 1.00 0.00 H new ATOM 0 HG2 PRO B 6 29.403 -2.538 -4.109 1.00 0.00 H new ATOM 0 HG3 PRO B 6 30.022 -1.519 -2.824 1.00 0.00 H new ATOM 0 HD2 PRO B 6 31.691 -2.930 -4.443 1.00 0.00 H new ATOM 0 HD3 PRO B 6 32.097 -2.617 -2.768 1.00 0.00 H new ATOM 2076 N GLY B 7 28.424 -6.687 -2.778 1.00 0.00 N ATOM 2077 CA GLY B 7 27.513 -7.525 -3.535 1.00 0.00 C ATOM 2078 C GLY B 7 26.289 -6.767 -4.013 1.00 0.00 C ATOM 2079 O GLY B 7 26.382 -5.597 -4.385 1.00 0.00 O ATOM 0 H GLY B 7 28.569 -6.976 -1.811 1.00 0.00 H new ATOM 0 HA2 GLY B 7 28.037 -7.942 -4.395 1.00 0.00 H new ATOM 0 HA3 GLY B 7 27.198 -8.365 -2.916 1.00 0.00 H new ATOM 2083 N ASP B 8 25.141 -7.435 -4.006 1.00 0.00 N ATOM 2084 CA ASP B 8 23.895 -6.817 -4.443 1.00 0.00 C ATOM 2085 C ASP B 8 22.788 -7.043 -3.419 1.00 0.00 C ATOM 2086 O ASP B 8 22.640 -8.140 -2.882 1.00 0.00 O ATOM 2087 CB ASP B 8 23.472 -7.380 -5.801 1.00 0.00 C ATOM 2088 CG ASP B 8 22.855 -6.325 -6.697 1.00 0.00 C ATOM 2089 OD1 ASP B 8 22.771 -5.156 -6.265 1.00 0.00 O ATOM 2090 OD2 ASP B 8 22.456 -6.667 -7.830 1.00 0.00 O ATOM 0 H ASP B 8 25.047 -8.404 -3.703 1.00 0.00 H new ATOM 0 HA ASP B 8 24.064 -5.744 -4.538 1.00 0.00 H new ATOM 0 HB2 ASP B 8 24.340 -7.813 -6.298 1.00 0.00 H new ATOM 0 HB3 ASP B 8 22.756 -8.188 -5.649 1.00 0.00 H new ATOM 2095 N ILE B 9 22.013 -5.996 -3.153 1.00 0.00 N ATOM 2096 CA ILE B 9 20.920 -6.081 -2.192 1.00 0.00 C ATOM 2097 C ILE B 9 19.601 -6.404 -2.885 1.00 0.00 C ATOM 2098 O ILE B 9 19.410 -6.082 -4.057 1.00 0.00 O ATOM 2099 CB ILE B 9 20.761 -4.768 -1.401 1.00 0.00 C ATOM 2100 CG1 ILE B 9 20.376 -3.622 -2.340 1.00 0.00 C ATOM 2101 CG2 ILE B 9 22.044 -4.439 -0.654 1.00 0.00 C ATOM 2102 CD1 ILE B 9 19.764 -2.436 -1.626 1.00 0.00 C ATOM 0 H ILE B 9 22.122 -5.080 -3.589 1.00 0.00 H new ATOM 0 HA ILE B 9 21.172 -6.885 -1.501 1.00 0.00 H new ATOM 0 HB ILE B 9 19.962 -4.898 -0.671 1.00 0.00 H new ATOM 0 HG12 ILE B 9 21.263 -3.292 -2.881 1.00 0.00 H new ATOM 0 HG13 ILE B 9 19.670 -3.993 -3.083 1.00 0.00 H new ATOM 0 HG21 ILE B 9 21.915 -3.509 -0.101 1.00 0.00 H new ATOM 0 HG22 ILE B 9 22.277 -5.245 0.041 1.00 0.00 H new ATOM 0 HG23 ILE B 9 22.861 -4.327 -1.366 1.00 0.00 H new ATOM 0 HD11 ILE B 9 19.516 -1.662 -2.353 1.00 0.00 H new ATOM 0 HD12 ILE B 9 18.858 -2.751 -1.108 1.00 0.00 H new ATOM 0 HD13 ILE B 9 20.477 -2.039 -0.903 1.00 0.00 H new ATOM 2114 N ASN B 10 18.692 -7.036 -2.151 1.00 0.00 N ATOM 2115 CA ASN B 10 17.388 -7.397 -2.694 1.00 0.00 C ATOM 2116 C ASN B 10 16.308 -6.458 -2.168 1.00 0.00 C ATOM 2117 O ASN B 10 16.242 -6.184 -0.969 1.00 0.00 O ATOM 2118 CB ASN B 10 17.044 -8.844 -2.338 1.00 0.00 C ATOM 2119 CG ASN B 10 17.811 -9.843 -3.180 1.00 0.00 C ATOM 2120 OD1 ASN B 10 18.309 -9.512 -4.255 1.00 0.00 O ATOM 2121 ND2 ASN B 10 17.910 -11.075 -2.695 1.00 0.00 N ATOM 0 H ASN B 10 18.834 -7.309 -1.179 1.00 0.00 H new ATOM 0 HA ASN B 10 17.432 -7.303 -3.779 1.00 0.00 H new ATOM 0 HB2 ASN B 10 17.262 -9.018 -1.284 1.00 0.00 H new ATOM 0 HB3 ASN B 10 15.974 -9.004 -2.473 1.00 0.00 H new ATOM 0 HD21 ASN B 10 18.415 -11.790 -3.219 1.00 0.00 H new ATOM 0 HD22 ASN B 10 17.481 -11.306 -1.799 1.00 0.00 H new ATOM 2128 N THR B 11 15.466 -5.966 -3.070 1.00 0.00 N ATOM 2129 CA THR B 11 14.392 -5.055 -2.691 1.00 0.00 C ATOM 2130 C THR B 11 13.042 -5.559 -3.189 1.00 0.00 C ATOM 2131 O THR B 11 12.966 -6.310 -4.162 1.00 0.00 O ATOM 2132 CB THR B 11 14.662 -3.656 -3.249 1.00 0.00 C ATOM 2133 OG1 THR B 11 14.902 -3.710 -4.644 1.00 0.00 O ATOM 2134 CG2 THR B 11 15.850 -2.974 -2.604 1.00 0.00 C ATOM 0 H THR B 11 15.506 -6.182 -4.066 1.00 0.00 H new ATOM 0 HA THR B 11 14.361 -5.008 -1.602 1.00 0.00 H new ATOM 0 HB THR B 11 13.766 -3.077 -3.025 1.00 0.00 H new ATOM 0 HG1 THR B 11 14.161 -3.280 -5.120 1.00 0.00 H new ATOM 0 HG21 THR B 11 15.986 -1.987 -3.045 1.00 0.00 H new ATOM 0 HG22 THR B 11 15.674 -2.872 -1.533 1.00 0.00 H new ATOM 0 HG23 THR B 11 16.746 -3.572 -2.769 1.00 0.00 H new ATOM 2142 N GLN B 12 11.980 -5.139 -2.511 1.00 0.00 N ATOM 2143 CA GLN B 12 10.628 -5.540 -2.876 1.00 0.00 C ATOM 2144 C GLN B 12 9.661 -4.360 -2.740 1.00 0.00 C ATOM 2145 O GLN B 12 9.434 -3.872 -1.633 1.00 0.00 O ATOM 2146 CB GLN B 12 10.163 -6.694 -1.985 1.00 0.00 C ATOM 2147 CG GLN B 12 11.095 -7.895 -2.009 1.00 0.00 C ATOM 2148 CD GLN B 12 11.028 -8.658 -3.317 1.00 0.00 C ATOM 2149 OE1 GLN B 12 10.487 -8.167 -4.308 1.00 0.00 O ATOM 2150 NE2 GLN B 12 11.578 -9.866 -3.327 1.00 0.00 N ATOM 0 H GLN B 12 12.031 -4.519 -1.703 1.00 0.00 H new ATOM 0 HA GLN B 12 10.636 -5.869 -3.915 1.00 0.00 H new ATOM 0 HB2 GLN B 12 10.071 -6.336 -0.960 1.00 0.00 H new ATOM 0 HB3 GLN B 12 9.169 -7.009 -2.302 1.00 0.00 H new ATOM 0 HG2 GLN B 12 12.118 -7.560 -1.840 1.00 0.00 H new ATOM 0 HG3 GLN B 12 10.840 -8.565 -1.188 1.00 0.00 H new ATOM 0 HE21 GLN B 12 12.016 -10.234 -2.482 1.00 0.00 H new ATOM 0 HE22 GLN B 12 11.563 -10.426 -4.179 1.00 0.00 H new ATOM 2159 N PRO B 13 9.076 -3.871 -3.856 1.00 0.00 N ATOM 2160 CA PRO B 13 9.307 -4.408 -5.207 1.00 0.00 C ATOM 2161 C PRO B 13 10.745 -4.220 -5.674 1.00 0.00 C ATOM 2162 O PRO B 13 11.486 -3.399 -5.131 1.00 0.00 O ATOM 2163 CB PRO B 13 8.351 -3.598 -6.089 1.00 0.00 C ATOM 2164 CG PRO B 13 8.084 -2.351 -5.321 1.00 0.00 C ATOM 2165 CD PRO B 13 8.130 -2.742 -3.872 1.00 0.00 C ATOM 0 HA PRO B 13 9.135 -5.484 -5.245 1.00 0.00 H new ATOM 0 HB2 PRO B 13 8.799 -3.377 -7.058 1.00 0.00 H new ATOM 0 HB3 PRO B 13 7.430 -4.148 -6.282 1.00 0.00 H new ATOM 0 HG2 PRO B 13 8.830 -1.588 -5.543 1.00 0.00 H new ATOM 0 HG3 PRO B 13 7.112 -1.932 -5.582 1.00 0.00 H new ATOM 0 HD2 PRO B 13 8.474 -1.920 -3.244 1.00 0.00 H new ATOM 0 HD3 PRO B 13 7.147 -3.035 -3.503 1.00 0.00 H new ATOM 2173 N SER B 14 11.133 -4.991 -6.684 1.00 0.00 N ATOM 2174 CA SER B 14 12.483 -4.920 -7.232 1.00 0.00 C ATOM 2175 C SER B 14 12.831 -3.498 -7.660 1.00 0.00 C ATOM 2176 O SER B 14 13.883 -2.972 -7.296 1.00 0.00 O ATOM 2177 CB SER B 14 12.622 -5.871 -8.422 1.00 0.00 C ATOM 2178 OG SER B 14 13.849 -6.579 -8.368 1.00 0.00 O ATOM 0 H SER B 14 10.530 -5.675 -7.141 1.00 0.00 H new ATOM 0 HA SER B 14 13.179 -5.220 -6.449 1.00 0.00 H new ATOM 0 HB2 SER B 14 11.791 -6.577 -8.427 1.00 0.00 H new ATOM 0 HB3 SER B 14 12.565 -5.306 -9.352 1.00 0.00 H new ATOM 0 HG SER B 14 13.913 -7.181 -9.138 1.00 0.00 H new ATOM 2184 N GLN B 15 11.947 -2.879 -8.437 1.00 0.00 N ATOM 2185 CA GLN B 15 12.172 -1.520 -8.914 1.00 0.00 C ATOM 2186 C GLN B 15 10.903 -0.933 -9.524 1.00 0.00 C ATOM 2187 O GLN B 15 10.938 -0.341 -10.603 1.00 0.00 O ATOM 2188 CB GLN B 15 13.301 -1.502 -9.946 1.00 0.00 C ATOM 2189 CG GLN B 15 13.002 -2.324 -11.189 1.00 0.00 C ATOM 2190 CD GLN B 15 14.257 -2.853 -11.855 1.00 0.00 C ATOM 2191 OE1 GLN B 15 15.357 -2.739 -11.314 1.00 0.00 O ATOM 2192 NE2 GLN B 15 14.098 -3.438 -13.037 1.00 0.00 N ATOM 0 H GLN B 15 11.070 -3.297 -8.749 1.00 0.00 H new ATOM 0 HA GLN B 15 12.456 -0.907 -8.059 1.00 0.00 H new ATOM 0 HB2 GLN B 15 13.496 -0.471 -10.241 1.00 0.00 H new ATOM 0 HB3 GLN B 15 14.212 -1.879 -9.482 1.00 0.00 H new ATOM 0 HG2 GLN B 15 12.358 -3.161 -10.920 1.00 0.00 H new ATOM 0 HG3 GLN B 15 12.448 -1.711 -11.901 1.00 0.00 H new ATOM 0 HE21 GLN B 15 13.168 -3.511 -13.449 1.00 0.00 H new ATOM 0 HE22 GLN B 15 14.906 -3.814 -13.533 1.00 0.00 H new ATOM 2201 N LYS B 16 9.783 -1.100 -8.828 1.00 0.00 N ATOM 2202 CA LYS B 16 8.504 -0.585 -9.304 1.00 0.00 C ATOM 2203 C LYS B 16 7.484 -0.527 -8.172 1.00 0.00 C ATOM 2204 O LYS B 16 6.974 -1.557 -7.730 1.00 0.00 O ATOM 2205 CB LYS B 16 7.970 -1.454 -10.443 1.00 0.00 C ATOM 2206 CG LYS B 16 7.378 -0.653 -11.591 1.00 0.00 C ATOM 2207 CD LYS B 16 6.984 -1.551 -12.752 1.00 0.00 C ATOM 2208 CE LYS B 16 5.917 -0.905 -13.620 1.00 0.00 C ATOM 2209 NZ LYS B 16 5.443 -1.820 -14.695 1.00 0.00 N ATOM 0 H LYS B 16 9.735 -1.587 -7.933 1.00 0.00 H new ATOM 0 HA LYS B 16 8.666 0.427 -9.675 1.00 0.00 H new ATOM 0 HB2 LYS B 16 8.779 -2.077 -10.824 1.00 0.00 H new ATOM 0 HB3 LYS B 16 7.208 -2.127 -10.049 1.00 0.00 H new ATOM 0 HG2 LYS B 16 6.503 -0.105 -11.241 1.00 0.00 H new ATOM 0 HG3 LYS B 16 8.102 0.087 -11.931 1.00 0.00 H new ATOM 0 HD2 LYS B 16 7.863 -1.771 -13.358 1.00 0.00 H new ATOM 0 HD3 LYS B 16 6.615 -2.502 -12.368 1.00 0.00 H new ATOM 0 HE2 LYS B 16 5.073 -0.610 -12.997 1.00 0.00 H new ATOM 0 HE3 LYS B 16 6.316 0.005 -14.068 1.00 0.00 H new ATOM 0 HZ1 LYS B 16 4.716 -1.340 -15.264 1.00 0.00 H new ATOM 0 HZ2 LYS B 16 6.243 -2.082 -15.306 1.00 0.00 H new ATOM 0 HZ3 LYS B 16 5.038 -2.677 -14.268 1.00 0.00 H new ATOM 2223 N ILE B 17 7.189 0.683 -7.707 1.00 0.00 N ATOM 2224 CA ILE B 17 6.228 0.874 -6.627 1.00 0.00 C ATOM 2225 C ILE B 17 5.212 1.954 -6.981 1.00 0.00 C ATOM 2226 O ILE B 17 5.580 3.080 -7.315 1.00 0.00 O ATOM 2227 CB ILE B 17 6.929 1.260 -5.312 1.00 0.00 C ATOM 2228 CG1 ILE B 17 5.904 1.422 -4.188 1.00 0.00 C ATOM 2229 CG2 ILE B 17 7.730 2.540 -5.497 1.00 0.00 C ATOM 2230 CD1 ILE B 17 6.518 1.793 -2.856 1.00 0.00 C ATOM 0 H ILE B 17 7.602 1.546 -8.061 1.00 0.00 H new ATOM 0 HA ILE B 17 5.714 -0.077 -6.491 1.00 0.00 H new ATOM 0 HB ILE B 17 7.616 0.461 -5.035 1.00 0.00 H new ATOM 0 HG12 ILE B 17 5.184 2.189 -4.473 1.00 0.00 H new ATOM 0 HG13 ILE B 17 5.350 0.490 -4.076 1.00 0.00 H new ATOM 0 HG21 ILE B 17 8.220 2.801 -4.559 1.00 0.00 H new ATOM 0 HG22 ILE B 17 8.483 2.389 -6.271 1.00 0.00 H new ATOM 0 HG23 ILE B 17 7.061 3.348 -5.794 1.00 0.00 H new ATOM 0 HD11 ILE B 17 5.732 1.891 -2.108 1.00 0.00 H new ATOM 0 HD12 ILE B 17 7.217 1.015 -2.548 1.00 0.00 H new ATOM 0 HD13 ILE B 17 7.048 2.741 -2.951 1.00 0.00 H new ATOM 2242 N VAL B 18 3.933 1.604 -6.902 1.00 0.00 N ATOM 2243 CA VAL B 18 2.864 2.546 -7.211 1.00 0.00 C ATOM 2244 C VAL B 18 1.923 2.719 -6.027 1.00 0.00 C ATOM 2245 O VAL B 18 1.061 1.875 -5.782 1.00 0.00 O ATOM 2246 CB VAL B 18 2.043 2.090 -8.431 1.00 0.00 C ATOM 2247 CG1 VAL B 18 1.426 0.723 -8.180 1.00 0.00 C ATOM 2248 CG2 VAL B 18 0.964 3.114 -8.760 1.00 0.00 C ATOM 0 H VAL B 18 3.612 0.676 -6.627 1.00 0.00 H new ATOM 0 HA VAL B 18 3.344 3.498 -7.438 1.00 0.00 H new ATOM 0 HB VAL B 18 2.713 2.010 -9.287 1.00 0.00 H new ATOM 0 HG11 VAL B 18 0.850 0.418 -9.053 1.00 0.00 H new ATOM 0 HG12 VAL B 18 2.216 -0.004 -7.995 1.00 0.00 H new ATOM 0 HG13 VAL B 18 0.769 0.774 -7.312 1.00 0.00 H new ATOM 0 HG21 VAL B 18 0.393 2.776 -9.625 1.00 0.00 H new ATOM 0 HG22 VAL B 18 0.296 3.226 -7.906 1.00 0.00 H new ATOM 0 HG23 VAL B 18 1.430 4.074 -8.985 1.00 0.00 H new ATOM 2258 N PHE B 19 2.084 3.819 -5.298 1.00 0.00 N ATOM 2259 CA PHE B 19 1.236 4.101 -4.142 1.00 0.00 C ATOM 2260 C PHE B 19 -0.236 3.891 -4.492 1.00 0.00 C ATOM 2261 O PHE B 19 -0.598 3.833 -5.667 1.00 0.00 O ATOM 2262 CB PHE B 19 1.460 5.534 -3.654 1.00 0.00 C ATOM 2263 CG PHE B 19 2.863 5.797 -3.187 1.00 0.00 C ATOM 2264 CD1 PHE B 19 3.593 4.805 -2.550 1.00 0.00 C ATOM 2265 CD2 PHE B 19 3.452 7.035 -3.385 1.00 0.00 C ATOM 2266 CE1 PHE B 19 4.884 5.044 -2.120 1.00 0.00 C ATOM 2267 CE2 PHE B 19 4.744 7.280 -2.957 1.00 0.00 C ATOM 2268 CZ PHE B 19 5.460 6.283 -2.323 1.00 0.00 C ATOM 0 H PHE B 19 2.792 4.529 -5.486 1.00 0.00 H new ATOM 0 HA PHE B 19 1.506 3.411 -3.343 1.00 0.00 H new ATOM 0 HB2 PHE B 19 1.219 6.226 -4.461 1.00 0.00 H new ATOM 0 HB3 PHE B 19 0.769 5.743 -2.838 1.00 0.00 H new ATOM 0 HD1 PHE B 19 3.147 3.835 -2.388 1.00 0.00 H new ATOM 0 HD2 PHE B 19 2.896 7.818 -3.879 1.00 0.00 H new ATOM 0 HE1 PHE B 19 5.442 4.263 -1.626 1.00 0.00 H new ATOM 0 HE2 PHE B 19 5.193 8.249 -3.118 1.00 0.00 H new ATOM 0 HZ PHE B 19 6.469 6.472 -1.987 1.00 0.00 H new ATOM 2278 N ASN B 20 -1.077 3.766 -3.473 1.00 0.00 N ATOM 2279 CA ASN B 20 -2.500 3.550 -3.696 1.00 0.00 C ATOM 2280 C ASN B 20 -3.342 4.627 -3.023 1.00 0.00 C ATOM 2281 O ASN B 20 -3.311 4.784 -1.803 1.00 0.00 O ATOM 2282 CB ASN B 20 -2.914 2.170 -3.182 1.00 0.00 C ATOM 2283 CG ASN B 20 -2.442 1.050 -4.088 1.00 0.00 C ATOM 2284 OD1 ASN B 20 -3.006 0.822 -5.158 1.00 0.00 O ATOM 2285 ND2 ASN B 20 -1.400 0.343 -3.663 1.00 0.00 N ATOM 0 H ASN B 20 -0.801 3.810 -2.492 1.00 0.00 H new ATOM 0 HA ASN B 20 -2.677 3.604 -4.770 1.00 0.00 H new ATOM 0 HB2 ASN B 20 -2.507 2.021 -2.182 1.00 0.00 H new ATOM 0 HB3 ASN B 20 -4.000 2.129 -3.094 1.00 0.00 H new ATOM 0 HD21 ASN B 20 -1.038 -0.423 -4.231 1.00 0.00 H new ATOM 0 HD22 ASN B 20 -0.963 0.566 -2.769 1.00 0.00 H new ATOM 2292 N ALA B 21 -4.102 5.359 -3.831 1.00 0.00 N ATOM 2293 CA ALA B 21 -4.969 6.418 -3.321 1.00 0.00 C ATOM 2294 C ALA B 21 -5.810 5.912 -2.147 1.00 0.00 C ATOM 2295 O ALA B 21 -5.826 4.713 -1.868 1.00 0.00 O ATOM 2296 CB ALA B 21 -5.865 6.933 -4.438 1.00 0.00 C ATOM 0 H ALA B 21 -4.136 5.239 -4.843 1.00 0.00 H new ATOM 0 HA ALA B 21 -4.347 7.237 -2.960 1.00 0.00 H new ATOM 0 HB1 ALA B 21 -6.510 7.723 -4.052 1.00 0.00 H new ATOM 0 HB2 ALA B 21 -5.249 7.329 -5.245 1.00 0.00 H new ATOM 0 HB3 ALA B 21 -6.479 6.116 -4.818 1.00 0.00 H new ATOM 2302 N PRO B 22 -6.522 6.810 -1.434 1.00 0.00 N ATOM 2303 CA PRO B 22 -6.544 8.251 -1.717 1.00 0.00 C ATOM 2304 C PRO B 22 -5.286 8.964 -1.240 1.00 0.00 C ATOM 2305 O PRO B 22 -4.519 8.430 -0.439 1.00 0.00 O ATOM 2306 CB PRO B 22 -7.756 8.740 -0.927 1.00 0.00 C ATOM 2307 CG PRO B 22 -7.853 7.803 0.226 1.00 0.00 C ATOM 2308 CD PRO B 22 -7.375 6.466 -0.279 1.00 0.00 C ATOM 0 HA PRO B 22 -6.594 8.452 -2.787 1.00 0.00 H new ATOM 0 HB2 PRO B 22 -7.623 9.769 -0.592 1.00 0.00 H new ATOM 0 HB3 PRO B 22 -8.661 8.717 -1.534 1.00 0.00 H new ATOM 0 HG2 PRO B 22 -7.240 8.146 1.059 1.00 0.00 H new ATOM 0 HG3 PRO B 22 -8.878 7.738 0.590 1.00 0.00 H new ATOM 0 HD2 PRO B 22 -6.815 5.927 0.485 1.00 0.00 H new ATOM 0 HD3 PRO B 22 -8.209 5.828 -0.573 1.00 0.00 H new ATOM 2316 N TYR B 23 -5.086 10.179 -1.736 1.00 0.00 N ATOM 2317 CA TYR B 23 -3.927 10.979 -1.364 1.00 0.00 C ATOM 2318 C TYR B 23 -4.350 12.203 -0.560 1.00 0.00 C ATOM 2319 O TYR B 23 -3.821 13.298 -0.754 1.00 0.00 O ATOM 2320 CB TYR B 23 -3.160 11.410 -2.614 1.00 0.00 C ATOM 2321 CG TYR B 23 -2.667 10.245 -3.437 1.00 0.00 C ATOM 2322 CD1 TYR B 23 -2.158 9.109 -2.824 1.00 0.00 C ATOM 2323 CD2 TYR B 23 -2.713 10.278 -4.824 1.00 0.00 C ATOM 2324 CE1 TYR B 23 -1.708 8.037 -3.567 1.00 0.00 C ATOM 2325 CE2 TYR B 23 -2.266 9.209 -5.577 1.00 0.00 C ATOM 2326 CZ TYR B 23 -1.763 8.091 -4.944 1.00 0.00 C ATOM 2327 OH TYR B 23 -1.316 7.025 -5.690 1.00 0.00 O ATOM 0 H TYR B 23 -5.714 10.633 -2.399 1.00 0.00 H new ATOM 0 HA TYR B 23 -3.275 10.367 -0.741 1.00 0.00 H new ATOM 0 HB2 TYR B 23 -3.805 12.036 -3.231 1.00 0.00 H new ATOM 0 HB3 TYR B 23 -2.309 12.024 -2.318 1.00 0.00 H new ATOM 0 HD1 TYR B 23 -2.113 9.063 -1.746 1.00 0.00 H new ATOM 0 HD2 TYR B 23 -3.104 11.153 -5.322 1.00 0.00 H new ATOM 0 HE1 TYR B 23 -1.315 7.161 -3.073 1.00 0.00 H new ATOM 0 HE2 TYR B 23 -2.310 9.248 -6.655 1.00 0.00 H new ATOM 0 HH TYR B 23 -1.719 6.198 -5.353 1.00 0.00 H new ATOM 2337 N ASP B 24 -5.302 12.007 0.343 1.00 0.00 N ATOM 2338 CA ASP B 24 -5.798 13.090 1.183 1.00 0.00 C ATOM 2339 C ASP B 24 -5.333 12.933 2.632 1.00 0.00 C ATOM 2340 O ASP B 24 -5.760 13.683 3.510 1.00 0.00 O ATOM 2341 CB ASP B 24 -7.325 13.136 1.133 1.00 0.00 C ATOM 2342 CG ASP B 24 -7.874 14.505 1.484 1.00 0.00 C ATOM 2343 OD1 ASP B 24 -7.161 15.276 2.160 1.00 0.00 O ATOM 2344 OD2 ASP B 24 -9.018 14.805 1.083 1.00 0.00 O ATOM 0 H ASP B 24 -5.747 11.105 0.513 1.00 0.00 H new ATOM 0 HA ASP B 24 -5.392 14.024 0.796 1.00 0.00 H new ATOM 0 HB2 ASP B 24 -7.662 12.858 0.134 1.00 0.00 H new ATOM 0 HB3 ASP B 24 -7.731 12.397 1.824 1.00 0.00 H new ATOM 2349 N ASP B 25 -4.456 11.961 2.882 1.00 0.00 N ATOM 2350 CA ASP B 25 -3.947 11.724 4.228 1.00 0.00 C ATOM 2351 C ASP B 25 -2.504 11.232 4.182 1.00 0.00 C ATOM 2352 O ASP B 25 -1.810 11.406 3.181 1.00 0.00 O ATOM 2353 CB ASP B 25 -4.827 10.706 4.956 1.00 0.00 C ATOM 2354 CG ASP B 25 -5.257 11.190 6.327 1.00 0.00 C ATOM 2355 OD1 ASP B 25 -4.415 11.182 7.250 1.00 0.00 O ATOM 2356 OD2 ASP B 25 -6.434 11.577 6.479 1.00 0.00 O ATOM 0 H ASP B 25 -4.086 11.329 2.172 1.00 0.00 H new ATOM 0 HA ASP B 25 -3.972 12.667 4.773 1.00 0.00 H new ATOM 0 HB2 ASP B 25 -5.711 10.497 4.354 1.00 0.00 H new ATOM 0 HB3 ASP B 25 -4.283 9.767 5.059 1.00 0.00 H new ATOM 2361 N LYS B 26 -2.057 10.617 5.273 1.00 0.00 N ATOM 2362 CA LYS B 26 -0.695 10.103 5.354 1.00 0.00 C ATOM 2363 C LYS B 26 -0.662 8.598 5.108 1.00 0.00 C ATOM 2364 O LYS B 26 -1.165 7.815 5.913 1.00 0.00 O ATOM 2365 CB LYS B 26 -0.090 10.420 6.722 1.00 0.00 C ATOM 2366 CG LYS B 26 0.047 11.908 6.997 1.00 0.00 C ATOM 2367 CD LYS B 26 -0.518 12.277 8.359 1.00 0.00 C ATOM 2368 CE LYS B 26 0.527 12.959 9.227 1.00 0.00 C ATOM 2369 NZ LYS B 26 0.378 12.596 10.663 1.00 0.00 N ATOM 0 H LYS B 26 -2.617 10.463 6.111 1.00 0.00 H new ATOM 0 HA LYS B 26 -0.104 10.591 4.579 1.00 0.00 H new ATOM 0 HB2 LYS B 26 -0.711 9.972 7.497 1.00 0.00 H new ATOM 0 HB3 LYS B 26 0.893 9.954 6.792 1.00 0.00 H new ATOM 0 HG2 LYS B 26 1.098 12.193 6.949 1.00 0.00 H new ATOM 0 HG3 LYS B 26 -0.472 12.472 6.222 1.00 0.00 H new ATOM 0 HD2 LYS B 26 -1.375 12.938 8.232 1.00 0.00 H new ATOM 0 HD3 LYS B 26 -0.879 11.379 8.860 1.00 0.00 H new ATOM 0 HE2 LYS B 26 1.523 12.680 8.883 1.00 0.00 H new ATOM 0 HE3 LYS B 26 0.443 14.040 9.115 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 1.109 13.081 11.221 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 -0.563 12.885 10.998 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 0.484 11.567 10.774 1.00 0.00 H new ATOM 2383 N HIS B 27 -0.061 8.201 3.990 1.00 0.00 N ATOM 2384 CA HIS B 27 0.045 6.790 3.637 1.00 0.00 C ATOM 2385 C HIS B 27 1.500 6.333 3.693 1.00 0.00 C ATOM 2386 O HIS B 27 2.354 6.862 2.981 1.00 0.00 O ATOM 2387 CB HIS B 27 -0.528 6.547 2.240 1.00 0.00 C ATOM 2388 CG HIS B 27 -2.015 6.366 2.227 1.00 0.00 C ATOM 2389 ND1 HIS B 27 -2.852 6.818 3.222 1.00 0.00 N ATOM 2390 CD2 HIS B 27 -2.815 5.767 1.308 1.00 0.00 C ATOM 2391 CE1 HIS B 27 -4.107 6.486 2.887 1.00 0.00 C ATOM 2392 NE2 HIS B 27 -4.139 5.847 1.732 1.00 0.00 N ATOM 0 H HIS B 27 0.360 8.837 3.313 1.00 0.00 H new ATOM 0 HA HIS B 27 -0.531 6.211 4.359 1.00 0.00 H new ATOM 0 HB2 HIS B 27 -0.267 7.388 1.598 1.00 0.00 H new ATOM 0 HB3 HIS B 27 -0.058 5.661 1.812 1.00 0.00 H new ATOM 0 HD2 HIS B 27 -2.478 5.302 0.393 1.00 0.00 H new ATOM 0 HE1 HIS B 27 -4.978 6.712 3.484 1.00 0.00 H new ATOM 0 HE2 HIS B 27 -4.963 5.487 1.250 1.00 0.00 H new ATOM 2400 N THR B 28 1.777 5.356 4.550 1.00 0.00 N ATOM 2401 CA THR B 28 3.132 4.840 4.703 1.00 0.00 C ATOM 2402 C THR B 28 3.294 3.485 4.022 1.00 0.00 C ATOM 2403 O THR B 28 2.702 2.491 4.445 1.00 0.00 O ATOM 2404 CB THR B 28 3.487 4.721 6.186 1.00 0.00 C ATOM 2405 OG1 THR B 28 2.711 5.618 6.961 1.00 0.00 O ATOM 2406 CG2 THR B 28 4.944 5.006 6.478 1.00 0.00 C ATOM 0 H THR B 28 1.083 4.907 5.148 1.00 0.00 H new ATOM 0 HA THR B 28 3.811 5.544 4.222 1.00 0.00 H new ATOM 0 HB THR B 28 3.276 3.685 6.451 1.00 0.00 H new ATOM 0 HG1 THR B 28 2.951 5.526 7.907 1.00 0.00 H new ATOM 0 HG21 THR B 28 5.127 4.904 7.548 1.00 0.00 H new ATOM 0 HG22 THR B 28 5.569 4.298 5.934 1.00 0.00 H new ATOM 0 HG23 THR B 28 5.186 6.021 6.163 1.00 0.00 H new ATOM 2414 N TYR B 29 4.109 3.452 2.972 1.00 0.00 N ATOM 2415 CA TYR B 29 4.363 2.218 2.237 1.00 0.00 C ATOM 2416 C TYR B 29 5.749 1.680 2.572 1.00 0.00 C ATOM 2417 O TYR B 29 6.761 2.295 2.236 1.00 0.00 O ATOM 2418 CB TYR B 29 4.243 2.459 0.732 1.00 0.00 C ATOM 2419 CG TYR B 29 3.044 3.298 0.349 1.00 0.00 C ATOM 2420 CD1 TYR B 29 3.094 4.685 0.411 1.00 0.00 C ATOM 2421 CD2 TYR B 29 1.864 2.702 -0.076 1.00 0.00 C ATOM 2422 CE1 TYR B 29 2.001 5.454 0.062 1.00 0.00 C ATOM 2423 CE2 TYR B 29 0.766 3.464 -0.427 1.00 0.00 C ATOM 2424 CZ TYR B 29 0.840 4.839 -0.356 1.00 0.00 C ATOM 2425 OH TYR B 29 -0.251 5.601 -0.704 1.00 0.00 O ATOM 0 H TYR B 29 4.605 4.267 2.611 1.00 0.00 H new ATOM 0 HA TYR B 29 3.618 1.480 2.533 1.00 0.00 H new ATOM 0 HB2 TYR B 29 5.149 2.951 0.377 1.00 0.00 H new ATOM 0 HB3 TYR B 29 4.182 1.498 0.222 1.00 0.00 H new ATOM 0 HD1 TYR B 29 4.002 5.170 0.737 1.00 0.00 H new ATOM 0 HD2 TYR B 29 1.803 1.625 -0.133 1.00 0.00 H new ATOM 0 HE1 TYR B 29 2.056 6.531 0.116 1.00 0.00 H new ATOM 0 HE2 TYR B 29 -0.145 2.985 -0.755 1.00 0.00 H new ATOM 0 HH TYR B 29 0.048 6.491 -0.984 1.00 0.00 H new ATOM 2435 N HIS B 30 5.791 0.537 3.247 1.00 0.00 N ATOM 2436 CA HIS B 30 7.056 -0.070 3.639 1.00 0.00 C ATOM 2437 C HIS B 30 7.651 -0.911 2.513 1.00 0.00 C ATOM 2438 O HIS B 30 6.928 -1.557 1.755 1.00 0.00 O ATOM 2439 CB HIS B 30 6.866 -0.936 4.885 1.00 0.00 C ATOM 2440 CG HIS B 30 6.274 -0.196 6.045 1.00 0.00 C ATOM 2441 ND1 HIS B 30 5.855 -0.801 7.208 1.00 0.00 N ATOM 2442 CD2 HIS B 30 6.035 1.131 6.205 1.00 0.00 C ATOM 2443 CE1 HIS B 30 5.385 0.153 8.022 1.00 0.00 C ATOM 2444 NE2 HIS B 30 5.472 1.344 7.461 1.00 0.00 N ATOM 0 H HIS B 30 4.964 0.013 3.534 1.00 0.00 H new ATOM 0 HA HIS B 30 7.752 0.739 3.861 1.00 0.00 H new ATOM 0 HB2 HIS B 30 6.222 -1.780 4.636 1.00 0.00 H new ATOM 0 HB3 HIS B 30 7.831 -1.348 5.182 1.00 0.00 H new ATOM 0 HD2 HIS B 30 6.247 1.898 5.475 1.00 0.00 H new ATOM 0 HE1 HIS B 30 4.987 -0.029 9.009 1.00 0.00 H new ATOM 0 HE2 HIS B 30 5.186 2.236 7.864 1.00 0.00 H new ATOM 2452 N ILE B 31 8.977 -0.903 2.424 1.00 0.00 N ATOM 2453 CA ILE B 31 9.687 -1.669 1.407 1.00 0.00 C ATOM 2454 C ILE B 31 10.554 -2.742 2.058 1.00 0.00 C ATOM 2455 O ILE B 31 11.092 -2.539 3.146 1.00 0.00 O ATOM 2456 CB ILE B 31 10.577 -0.762 0.531 1.00 0.00 C ATOM 2457 CG1 ILE B 31 9.869 0.564 0.245 1.00 0.00 C ATOM 2458 CG2 ILE B 31 10.936 -1.469 -0.767 1.00 0.00 C ATOM 2459 CD1 ILE B 31 10.595 1.434 -0.757 1.00 0.00 C ATOM 0 H ILE B 31 9.584 -0.371 3.048 1.00 0.00 H new ATOM 0 HA ILE B 31 8.936 -2.137 0.771 1.00 0.00 H new ATOM 0 HB ILE B 31 11.498 -0.549 1.073 1.00 0.00 H new ATOM 0 HG12 ILE B 31 8.865 0.358 -0.126 1.00 0.00 H new ATOM 0 HG13 ILE B 31 9.757 1.115 1.179 1.00 0.00 H new ATOM 0 HG21 ILE B 31 11.564 -0.817 -1.375 1.00 0.00 H new ATOM 0 HG22 ILE B 31 11.477 -2.388 -0.543 1.00 0.00 H new ATOM 0 HG23 ILE B 31 10.025 -1.709 -1.315 1.00 0.00 H new ATOM 0 HD11 ILE B 31 10.036 2.357 -0.910 1.00 0.00 H new ATOM 0 HD12 ILE B 31 11.590 1.671 -0.380 1.00 0.00 H new ATOM 0 HD13 ILE B 31 10.684 0.902 -1.704 1.00 0.00 H new ATOM 2471 N LYS B 32 10.678 -3.888 1.397 1.00 0.00 N ATOM 2472 CA LYS B 32 11.471 -4.991 1.931 1.00 0.00 C ATOM 2473 C LYS B 32 12.898 -4.967 1.390 1.00 0.00 C ATOM 2474 O LYS B 32 13.116 -4.881 0.182 1.00 0.00 O ATOM 2475 CB LYS B 32 10.810 -6.329 1.597 1.00 0.00 C ATOM 2476 CG LYS B 32 11.086 -7.415 2.624 1.00 0.00 C ATOM 2477 CD LYS B 32 10.520 -8.756 2.185 1.00 0.00 C ATOM 2478 CE LYS B 32 11.289 -9.914 2.798 1.00 0.00 C ATOM 2479 NZ LYS B 32 11.574 -10.980 1.799 1.00 0.00 N ATOM 0 H LYS B 32 10.242 -4.078 0.495 1.00 0.00 H new ATOM 0 HA LYS B 32 11.518 -4.872 3.013 1.00 0.00 H new ATOM 0 HB2 LYS B 32 9.733 -6.183 1.515 1.00 0.00 H new ATOM 0 HB3 LYS B 32 11.161 -6.665 0.621 1.00 0.00 H new ATOM 0 HG2 LYS B 32 12.161 -7.506 2.778 1.00 0.00 H new ATOM 0 HG3 LYS B 32 10.649 -7.131 3.581 1.00 0.00 H new ATOM 0 HD2 LYS B 32 9.471 -8.821 2.474 1.00 0.00 H new ATOM 0 HD3 LYS B 32 10.556 -8.829 1.098 1.00 0.00 H new ATOM 0 HE2 LYS B 32 12.227 -9.547 3.215 1.00 0.00 H new ATOM 0 HE3 LYS B 32 10.715 -10.334 3.624 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 12.100 -11.752 2.256 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 10.679 -11.348 1.419 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 12.143 -10.585 1.023 1.00 0.00 H new ATOM 2493 N ILE B 33 13.866 -5.053 2.299 1.00 0.00 N ATOM 2494 CA ILE B 33 15.276 -5.053 1.925 1.00 0.00 C ATOM 2495 C ILE B 33 16.003 -6.233 2.561 1.00 0.00 C ATOM 2496 O ILE B 33 15.611 -6.712 3.626 1.00 0.00 O ATOM 2497 CB ILE B 33 15.975 -3.746 2.346 1.00 0.00 C ATOM 2498 CG1 ILE B 33 15.219 -2.537 1.794 1.00 0.00 C ATOM 2499 CG2 ILE B 33 17.418 -3.740 1.864 1.00 0.00 C ATOM 2500 CD1 ILE B 33 15.700 -1.217 2.355 1.00 0.00 C ATOM 0 H ILE B 33 13.698 -5.124 3.303 1.00 0.00 H new ATOM 0 HA ILE B 33 15.317 -5.138 0.839 1.00 0.00 H new ATOM 0 HB ILE B 33 15.975 -3.685 3.434 1.00 0.00 H new ATOM 0 HG12 ILE B 33 15.320 -2.520 0.709 1.00 0.00 H new ATOM 0 HG13 ILE B 33 14.157 -2.651 2.014 1.00 0.00 H new ATOM 0 HG21 ILE B 33 17.899 -2.811 2.169 1.00 0.00 H new ATOM 0 HG22 ILE B 33 17.951 -4.585 2.300 1.00 0.00 H new ATOM 0 HG23 ILE B 33 17.439 -3.820 0.777 1.00 0.00 H new ATOM 0 HD11 ILE B 33 15.120 -0.404 1.920 1.00 0.00 H new ATOM 0 HD12 ILE B 33 15.574 -1.214 3.438 1.00 0.00 H new ATOM 0 HD13 ILE B 33 16.754 -1.081 2.112 1.00 0.00 H new ATOM 2512 N THR B 34 17.059 -6.704 1.906 1.00 0.00 N ATOM 2513 CA THR B 34 17.828 -7.833 2.417 1.00 0.00 C ATOM 2514 C THR B 34 19.279 -7.775 1.950 1.00 0.00 C ATOM 2515 O THR B 34 19.591 -7.174 0.922 1.00 0.00 O ATOM 2516 CB THR B 34 17.191 -9.151 1.971 1.00 0.00 C ATOM 2517 OG1 THR B 34 15.909 -9.310 2.551 1.00 0.00 O ATOM 2518 CG2 THR B 34 18.012 -10.371 2.334 1.00 0.00 C ATOM 0 H THR B 34 17.401 -6.323 1.024 1.00 0.00 H new ATOM 0 HA THR B 34 17.819 -7.777 3.506 1.00 0.00 H new ATOM 0 HB THR B 34 17.130 -9.086 0.885 1.00 0.00 H new ATOM 0 HG1 THR B 34 15.518 -10.157 2.252 1.00 0.00 H new ATOM 0 HG21 THR B 34 17.501 -11.270 1.988 1.00 0.00 H new ATOM 0 HG22 THR B 34 18.991 -10.305 1.860 1.00 0.00 H new ATOM 0 HG23 THR B 34 18.135 -10.418 3.416 1.00 0.00 H new ATOM 2526 N ASN B 35 20.159 -8.415 2.714 1.00 0.00 N ATOM 2527 CA ASN B 35 21.577 -8.451 2.385 1.00 0.00 C ATOM 2528 C ASN B 35 21.914 -9.716 1.600 1.00 0.00 C ATOM 2529 O ASN B 35 22.055 -10.795 2.174 1.00 0.00 O ATOM 2530 CB ASN B 35 22.419 -8.391 3.661 1.00 0.00 C ATOM 2531 CG ASN B 35 23.078 -7.039 3.859 1.00 0.00 C ATOM 2532 OD1 ASN B 35 22.528 -6.007 3.476 1.00 0.00 O ATOM 2533 ND2 ASN B 35 24.262 -7.042 4.460 1.00 0.00 N ATOM 0 H ASN B 35 19.912 -8.917 3.567 1.00 0.00 H new ATOM 0 HA ASN B 35 21.807 -7.584 1.766 1.00 0.00 H new ATOM 0 HB2 ASN B 35 21.786 -8.613 4.521 1.00 0.00 H new ATOM 0 HB3 ASN B 35 23.187 -9.164 3.623 1.00 0.00 H new ATOM 0 HD21 ASN B 35 24.754 -6.163 4.621 1.00 0.00 H new ATOM 0 HD22 ASN B 35 24.679 -7.923 4.760 1.00 0.00 H new ATOM 2540 N ALA B 36 22.038 -9.573 0.284 1.00 0.00 N ATOM 2541 CA ALA B 36 22.354 -10.704 -0.581 1.00 0.00 C ATOM 2542 C ALA B 36 23.861 -10.869 -0.762 1.00 0.00 C ATOM 2543 O ALA B 36 24.312 -11.537 -1.692 1.00 0.00 O ATOM 2544 CB ALA B 36 21.681 -10.533 -1.934 1.00 0.00 C ATOM 0 H ALA B 36 21.925 -8.686 -0.206 1.00 0.00 H new ATOM 0 HA ALA B 36 21.975 -11.606 -0.101 1.00 0.00 H new ATOM 0 HB1 ALA B 36 21.924 -11.383 -2.571 1.00 0.00 H new ATOM 0 HB2 ALA B 36 20.601 -10.478 -1.799 1.00 0.00 H new ATOM 0 HB3 ALA B 36 22.035 -9.615 -2.403 1.00 0.00 H new ATOM 2550 N GLY B 37 24.636 -10.260 0.129 1.00 0.00 N ATOM 2551 CA GLY B 37 26.081 -10.359 0.044 1.00 0.00 C ATOM 2552 C GLY B 37 26.661 -11.294 1.086 1.00 0.00 C ATOM 2553 O GLY B 37 26.012 -12.256 1.495 1.00 0.00 O ATOM 0 H GLY B 37 24.290 -9.700 0.908 1.00 0.00 H new ATOM 0 HA2 GLY B 37 26.360 -10.710 -0.950 1.00 0.00 H new ATOM 0 HA3 GLY B 37 26.518 -9.368 0.167 1.00 0.00 H new ATOM 2557 N GLY B 38 27.886 -11.011 1.515 1.00 0.00 N ATOM 2558 CA GLY B 38 28.533 -11.844 2.513 1.00 0.00 C ATOM 2559 C GLY B 38 28.828 -11.090 3.795 1.00 0.00 C ATOM 2560 O GLY B 38 28.903 -11.684 4.869 1.00 0.00 O ATOM 0 H GLY B 38 28.443 -10.220 1.190 1.00 0.00 H new ATOM 0 HA2 GLY B 38 27.895 -12.699 2.737 1.00 0.00 H new ATOM 0 HA3 GLY B 38 29.464 -12.238 2.105 1.00 0.00 H new ATOM 2564 N ARG B 39 28.996 -9.776 3.680 1.00 0.00 N ATOM 2565 CA ARG B 39 29.284 -8.938 4.839 1.00 0.00 C ATOM 2566 C ARG B 39 28.277 -7.796 4.946 1.00 0.00 C ATOM 2567 O ARG B 39 27.589 -7.471 3.979 1.00 0.00 O ATOM 2568 CB ARG B 39 30.702 -8.372 4.744 1.00 0.00 C ATOM 2569 CG ARG B 39 31.771 -9.432 4.534 1.00 0.00 C ATOM 2570 CD ARG B 39 33.098 -8.810 4.130 1.00 0.00 C ATOM 2571 NE ARG B 39 33.639 -9.414 2.916 1.00 0.00 N ATOM 2572 CZ ARG B 39 34.092 -10.662 2.854 1.00 0.00 C ATOM 2573 NH1 ARG B 39 34.068 -11.432 3.933 1.00 0.00 N ATOM 2574 NH2 ARG B 39 34.568 -11.141 1.713 1.00 0.00 N ATOM 0 H ARG B 39 28.938 -9.269 2.797 1.00 0.00 H new ATOM 0 HA ARG B 39 29.205 -9.556 5.733 1.00 0.00 H new ATOM 0 HB2 ARG B 39 30.744 -7.658 3.921 1.00 0.00 H new ATOM 0 HB3 ARG B 39 30.925 -7.820 5.657 1.00 0.00 H new ATOM 0 HG2 ARG B 39 31.901 -10.006 5.451 1.00 0.00 H new ATOM 0 HG3 ARG B 39 31.446 -10.131 3.764 1.00 0.00 H new ATOM 0 HD2 ARG B 39 32.964 -7.740 3.973 1.00 0.00 H new ATOM 0 HD3 ARG B 39 33.815 -8.926 4.943 1.00 0.00 H new ATOM 0 HE ARG B 39 33.671 -8.847 2.069 1.00 0.00 H new ATOM 0 HH11 ARG B 39 33.702 -11.067 4.812 1.00 0.00 H new ATOM 0 HH12 ARG B 39 34.416 -12.390 3.884 1.00 0.00 H new ATOM 0 HH21 ARG B 39 34.587 -10.551 0.881 1.00 0.00 H new ATOM 0 HH22 ARG B 39 34.915 -12.099 1.667 1.00 0.00 H new ATOM 2588 N ARG B 40 28.199 -7.190 6.126 1.00 0.00 N ATOM 2589 CA ARG B 40 27.277 -6.082 6.353 1.00 0.00 C ATOM 2590 C ARG B 40 27.453 -5.011 5.281 1.00 0.00 C ATOM 2591 O ARG B 40 28.416 -5.040 4.516 1.00 0.00 O ATOM 2592 CB ARG B 40 27.498 -5.477 7.741 1.00 0.00 C ATOM 2593 CG ARG B 40 28.859 -4.824 7.910 1.00 0.00 C ATOM 2594 CD ARG B 40 29.168 -4.554 9.374 1.00 0.00 C ATOM 2595 NE ARG B 40 29.350 -5.790 10.130 1.00 0.00 N ATOM 2596 CZ ARG B 40 29.871 -5.836 11.352 1.00 0.00 C ATOM 2597 NH1 ARG B 40 30.255 -4.718 11.953 1.00 0.00 N ATOM 2598 NH2 ARG B 40 30.004 -6.998 11.974 1.00 0.00 N ATOM 0 H ARG B 40 28.761 -7.446 6.938 1.00 0.00 H new ATOM 0 HA ARG B 40 26.259 -6.468 6.297 1.00 0.00 H new ATOM 0 HB2 ARG B 40 26.722 -4.736 7.933 1.00 0.00 H new ATOM 0 HB3 ARG B 40 27.384 -6.259 8.492 1.00 0.00 H new ATOM 0 HG2 ARG B 40 29.629 -5.470 7.487 1.00 0.00 H new ATOM 0 HG3 ARG B 40 28.887 -3.888 7.352 1.00 0.00 H new ATOM 0 HD2 ARG B 40 30.070 -3.947 9.448 1.00 0.00 H new ATOM 0 HD3 ARG B 40 28.357 -3.975 9.815 1.00 0.00 H new ATOM 0 HE ARG B 40 29.061 -6.667 9.696 1.00 0.00 H new ATOM 0 HH11 ARG B 40 30.151 -3.822 11.478 1.00 0.00 H new ATOM 0 HH12 ARG B 40 30.655 -4.754 12.891 1.00 0.00 H new ATOM 0 HH21 ARG B 40 29.706 -7.859 11.515 1.00 0.00 H new ATOM 0 HH22 ARG B 40 30.404 -7.032 12.912 1.00 0.00 H new ATOM 2612 N ILE B 41 26.517 -4.070 5.225 1.00 0.00 N ATOM 2613 CA ILE B 41 26.578 -3.000 4.237 1.00 0.00 C ATOM 2614 C ILE B 41 25.843 -1.752 4.713 1.00 0.00 C ATOM 2615 O ILE B 41 24.689 -1.821 5.135 1.00 0.00 O ATOM 2616 CB ILE B 41 25.974 -3.443 2.892 1.00 0.00 C ATOM 2617 CG1 ILE B 41 24.479 -3.729 3.047 1.00 0.00 C ATOM 2618 CG2 ILE B 41 26.700 -4.669 2.362 1.00 0.00 C ATOM 2619 CD1 ILE B 41 23.845 -4.316 1.807 1.00 0.00 C ATOM 0 H ILE B 41 25.711 -4.026 5.849 1.00 0.00 H new ATOM 0 HA ILE B 41 27.634 -2.766 4.103 1.00 0.00 H new ATOM 0 HB ILE B 41 26.097 -2.633 2.173 1.00 0.00 H new ATOM 0 HG12 ILE B 41 24.333 -4.417 3.880 1.00 0.00 H new ATOM 0 HG13 ILE B 41 23.965 -2.803 3.305 1.00 0.00 H new ATOM 0 HG21 ILE B 41 26.261 -4.969 1.411 1.00 0.00 H new ATOM 0 HG22 ILE B 41 27.754 -4.433 2.216 1.00 0.00 H new ATOM 0 HG23 ILE B 41 26.606 -5.485 3.078 1.00 0.00 H new ATOM 0 HD11 ILE B 41 22.785 -4.493 1.989 1.00 0.00 H new ATOM 0 HD12 ILE B 41 23.959 -3.620 0.976 1.00 0.00 H new ATOM 0 HD13 ILE B 41 24.333 -5.259 1.560 1.00 0.00 H new ATOM 2631 N GLY B 42 26.515 -0.609 4.625 1.00 0.00 N ATOM 2632 CA GLY B 42 25.906 0.643 5.029 1.00 0.00 C ATOM 2633 C GLY B 42 25.026 1.211 3.935 1.00 0.00 C ATOM 2634 O GLY B 42 25.527 1.702 2.923 1.00 0.00 O ATOM 0 H GLY B 42 27.472 -0.528 4.281 1.00 0.00 H new ATOM 0 HA2 GLY B 42 25.313 0.486 5.930 1.00 0.00 H new ATOM 0 HA3 GLY B 42 26.685 1.363 5.281 1.00 0.00 H new ATOM 2638 N TRP B 43 23.714 1.126 4.125 1.00 0.00 N ATOM 2639 CA TRP B 43 22.772 1.618 3.130 1.00 0.00 C ATOM 2640 C TRP B 43 22.146 2.944 3.548 1.00 0.00 C ATOM 2641 O TRP B 43 22.081 3.274 4.732 1.00 0.00 O ATOM 2642 CB TRP B 43 21.674 0.582 2.886 1.00 0.00 C ATOM 2643 CG TRP B 43 20.886 0.252 4.116 1.00 0.00 C ATOM 2644 CD1 TRP B 43 21.205 -0.670 5.071 1.00 0.00 C ATOM 2645 CD2 TRP B 43 19.647 0.842 4.525 1.00 0.00 C ATOM 2646 NE1 TRP B 43 20.240 -0.691 6.049 1.00 0.00 N ATOM 2647 CE2 TRP B 43 19.273 0.229 5.737 1.00 0.00 C ATOM 2648 CE3 TRP B 43 18.817 1.829 3.985 1.00 0.00 C ATOM 2649 CZ2 TRP B 43 18.106 0.571 6.415 1.00 0.00 C ATOM 2650 CZ3 TRP B 43 17.659 2.167 4.660 1.00 0.00 C ATOM 2651 CH2 TRP B 43 17.312 1.541 5.863 1.00 0.00 C ATOM 0 H TRP B 43 23.281 0.723 4.956 1.00 0.00 H new ATOM 0 HA TRP B 43 23.328 1.786 2.208 1.00 0.00 H new ATOM 0 HB2 TRP B 43 20.996 0.955 2.118 1.00 0.00 H new ATOM 0 HB3 TRP B 43 22.125 -0.331 2.497 1.00 0.00 H new ATOM 0 HD1 TRP B 43 22.088 -1.292 5.059 1.00 0.00 H new ATOM 0 HE1 TRP B 43 20.243 -1.293 6.873 1.00 0.00 H new ATOM 0 HE3 TRP B 43 19.076 2.318 3.058 1.00 0.00 H new ATOM 0 HZ2 TRP B 43 17.836 0.089 7.343 1.00 0.00 H new ATOM 0 HZ3 TRP B 43 17.010 2.928 4.252 1.00 0.00 H new ATOM 0 HH2 TRP B 43 16.400 1.828 6.366 1.00 0.00 H new ATOM 2662 N ALA B 44 21.679 3.692 2.554 1.00 0.00 N ATOM 2663 CA ALA B 44 21.042 4.982 2.781 1.00 0.00 C ATOM 2664 C ALA B 44 19.981 5.233 1.716 1.00 0.00 C ATOM 2665 O ALA B 44 20.051 4.677 0.619 1.00 0.00 O ATOM 2666 CB ALA B 44 22.078 6.097 2.774 1.00 0.00 C ATOM 0 H ALA B 44 21.732 3.421 1.572 1.00 0.00 H new ATOM 0 HA ALA B 44 20.562 4.969 3.759 1.00 0.00 H new ATOM 0 HB1 ALA B 44 21.584 7.054 2.945 1.00 0.00 H new ATOM 0 HB2 ALA B 44 22.809 5.920 3.563 1.00 0.00 H new ATOM 0 HB3 ALA B 44 22.584 6.117 1.809 1.00 0.00 H new ATOM 2672 N ILE B 45 18.996 6.059 2.042 1.00 0.00 N ATOM 2673 CA ILE B 45 17.921 6.361 1.106 1.00 0.00 C ATOM 2674 C ILE B 45 17.728 7.863 0.934 1.00 0.00 C ATOM 2675 O ILE B 45 17.757 8.620 1.903 1.00 0.00 O ATOM 2676 CB ILE B 45 16.593 5.735 1.566 1.00 0.00 C ATOM 2677 CG1 ILE B 45 16.827 4.317 2.088 1.00 0.00 C ATOM 2678 CG2 ILE B 45 15.588 5.728 0.424 1.00 0.00 C ATOM 2679 CD1 ILE B 45 17.264 3.343 1.015 1.00 0.00 C ATOM 0 H ILE B 45 18.919 6.530 2.943 1.00 0.00 H new ATOM 0 HA ILE B 45 18.213 5.931 0.148 1.00 0.00 H new ATOM 0 HB ILE B 45 16.185 6.337 2.378 1.00 0.00 H new ATOM 0 HG12 ILE B 45 17.585 4.347 2.871 1.00 0.00 H new ATOM 0 HG13 ILE B 45 15.909 3.951 2.547 1.00 0.00 H new ATOM 0 HG21 ILE B 45 14.653 5.282 0.765 1.00 0.00 H new ATOM 0 HG22 ILE B 45 15.404 6.751 0.095 1.00 0.00 H new ATOM 0 HG23 ILE B 45 15.986 5.146 -0.407 1.00 0.00 H new ATOM 0 HD11 ILE B 45 17.411 2.357 1.456 1.00 0.00 H new ATOM 0 HD12 ILE B 45 16.497 3.284 0.243 1.00 0.00 H new ATOM 0 HD13 ILE B 45 18.199 3.686 0.572 1.00 0.00 H new ATOM 2691 N LYS B 46 17.520 8.283 -0.310 1.00 0.00 N ATOM 2692 CA LYS B 46 17.311 9.693 -0.618 1.00 0.00 C ATOM 2693 C LYS B 46 16.268 9.853 -1.719 1.00 0.00 C ATOM 2694 O LYS B 46 16.355 9.215 -2.767 1.00 0.00 O ATOM 2695 CB LYS B 46 18.624 10.351 -1.045 1.00 0.00 C ATOM 2696 CG LYS B 46 19.716 10.268 0.009 1.00 0.00 C ATOM 2697 CD LYS B 46 21.023 10.858 -0.496 1.00 0.00 C ATOM 2698 CE LYS B 46 20.850 12.301 -0.940 1.00 0.00 C ATOM 2699 NZ LYS B 46 22.107 13.084 -0.788 1.00 0.00 N ATOM 0 H LYS B 46 17.492 7.666 -1.122 1.00 0.00 H new ATOM 0 HA LYS B 46 16.948 10.186 0.284 1.00 0.00 H new ATOM 0 HB2 LYS B 46 18.977 9.877 -1.961 1.00 0.00 H new ATOM 0 HB3 LYS B 46 18.436 11.399 -1.280 1.00 0.00 H new ATOM 0 HG2 LYS B 46 19.398 10.799 0.906 1.00 0.00 H new ATOM 0 HG3 LYS B 46 19.871 9.227 0.293 1.00 0.00 H new ATOM 0 HD2 LYS B 46 21.775 10.807 0.292 1.00 0.00 H new ATOM 0 HD3 LYS B 46 21.394 10.262 -1.330 1.00 0.00 H new ATOM 0 HE2 LYS B 46 20.532 12.324 -1.982 1.00 0.00 H new ATOM 0 HE3 LYS B 46 20.058 12.768 -0.354 1.00 0.00 H new ATOM 0 HZ1 LYS B 46 21.947 14.063 -1.102 1.00 0.00 H new ATOM 0 HZ2 LYS B 46 22.398 13.084 0.211 1.00 0.00 H new ATOM 0 HZ3 LYS B 46 22.856 12.653 -1.367 1.00 0.00 H new ATOM 2713 N THR B 47 15.282 10.706 -1.475 1.00 0.00 N ATOM 2714 CA THR B 47 14.219 10.946 -2.445 1.00 0.00 C ATOM 2715 C THR B 47 14.414 12.281 -3.153 1.00 0.00 C ATOM 2716 O THR B 47 15.080 13.179 -2.638 1.00 0.00 O ATOM 2717 CB THR B 47 12.855 10.917 -1.755 1.00 0.00 C ATOM 2718 OG1 THR B 47 12.718 12.013 -0.867 1.00 0.00 O ATOM 2719 CG2 THR B 47 12.610 9.651 -0.962 1.00 0.00 C ATOM 0 H THR B 47 15.195 11.244 -0.613 1.00 0.00 H new ATOM 0 HA THR B 47 14.260 10.153 -3.191 1.00 0.00 H new ATOM 0 HB THR B 47 12.124 10.968 -2.562 1.00 0.00 H new ATOM 0 HG1 THR B 47 12.115 12.678 -1.259 1.00 0.00 H new ATOM 0 HG21 THR B 47 11.624 9.697 -0.499 1.00 0.00 H new ATOM 0 HG22 THR B 47 12.658 8.789 -1.628 1.00 0.00 H new ATOM 0 HG23 THR B 47 13.371 9.554 -0.187 1.00 0.00 H new ATOM 2727 N THR B 48 13.823 12.405 -4.337 1.00 0.00 N ATOM 2728 CA THR B 48 13.922 13.629 -5.124 1.00 0.00 C ATOM 2729 C THR B 48 13.616 14.853 -4.267 1.00 0.00 C ATOM 2730 O THR B 48 14.104 15.951 -4.534 1.00 0.00 O ATOM 2731 CB THR B 48 12.958 13.572 -6.311 1.00 0.00 C ATOM 2732 OG1 THR B 48 11.824 12.784 -5.997 1.00 0.00 O ATOM 2733 CG2 THR B 48 13.582 12.998 -7.564 1.00 0.00 C ATOM 0 H THR B 48 13.268 11.669 -4.774 1.00 0.00 H new ATOM 0 HA THR B 48 14.944 13.713 -5.494 1.00 0.00 H new ATOM 0 HB THR B 48 12.679 14.608 -6.506 1.00 0.00 H new ATOM 0 HG1 THR B 48 11.020 13.206 -6.365 1.00 0.00 H new ATOM 0 HG21 THR B 48 12.844 12.987 -8.366 1.00 0.00 H new ATOM 0 HG22 THR B 48 14.432 13.612 -7.862 1.00 0.00 H new ATOM 0 HG23 THR B 48 13.921 11.981 -7.369 1.00 0.00 H new ATOM 2741 N ASN B 49 12.805 14.652 -3.233 1.00 0.00 N ATOM 2742 CA ASN B 49 12.430 15.733 -2.330 1.00 0.00 C ATOM 2743 C ASN B 49 12.333 15.228 -0.896 1.00 0.00 C ATOM 2744 O ASN B 49 11.516 14.359 -0.587 1.00 0.00 O ATOM 2745 CB ASN B 49 11.097 16.348 -2.761 1.00 0.00 C ATOM 2746 CG ASN B 49 11.280 17.623 -3.561 1.00 0.00 C ATOM 2747 OD1 ASN B 49 12.337 18.254 -3.514 1.00 0.00 O ATOM 2748 ND2 ASN B 49 10.247 18.011 -4.301 1.00 0.00 N ATOM 0 H ASN B 49 12.394 13.748 -3.000 1.00 0.00 H new ATOM 0 HA ASN B 49 13.204 16.499 -2.376 1.00 0.00 H new ATOM 0 HB2 ASN B 49 10.542 15.624 -3.358 1.00 0.00 H new ATOM 0 HB3 ASN B 49 10.495 16.560 -1.877 1.00 0.00 H new ATOM 0 HD21 ASN B 49 10.311 18.862 -4.860 1.00 0.00 H new ATOM 0 HD22 ASN B 49 9.390 17.458 -4.310 1.00 0.00 H new ATOM 2755 N MET B 50 13.169 15.778 -0.023 1.00 0.00 N ATOM 2756 CA MET B 50 13.177 15.383 1.380 1.00 0.00 C ATOM 2757 C MET B 50 12.217 16.242 2.203 1.00 0.00 C ATOM 2758 O MET B 50 12.314 16.289 3.429 1.00 0.00 O ATOM 2759 CB MET B 50 14.592 15.492 1.952 1.00 0.00 C ATOM 2760 CG MET B 50 15.607 14.613 1.238 1.00 0.00 C ATOM 2761 SD MET B 50 16.626 13.661 2.381 1.00 0.00 S ATOM 2762 CE MET B 50 15.716 12.119 2.444 1.00 0.00 C ATOM 0 H MET B 50 13.850 16.499 -0.262 1.00 0.00 H new ATOM 0 HA MET B 50 12.843 14.347 1.438 1.00 0.00 H new ATOM 0 HB2 MET B 50 14.919 16.530 1.895 1.00 0.00 H new ATOM 0 HB3 MET B 50 14.570 15.223 3.008 1.00 0.00 H new ATOM 0 HG2 MET B 50 15.084 13.930 0.569 1.00 0.00 H new ATOM 0 HG3 MET B 50 16.250 15.237 0.618 1.00 0.00 H new ATOM 0 HE1 MET B 50 16.251 11.406 3.071 1.00 0.00 H new ATOM 0 HE2 MET B 50 14.725 12.298 2.862 1.00 0.00 H new ATOM 0 HE3 MET B 50 15.617 11.714 1.437 1.00 0.00 H new ATOM 2772 N ARG B 51 11.290 16.918 1.527 1.00 0.00 N ATOM 2773 CA ARG B 51 10.320 17.769 2.207 1.00 0.00 C ATOM 2774 C ARG B 51 8.922 17.165 2.135 1.00 0.00 C ATOM 2775 O ARG B 51 8.160 17.224 3.100 1.00 0.00 O ATOM 2776 CB ARG B 51 10.317 19.168 1.588 1.00 0.00 C ATOM 2777 CG ARG B 51 9.963 19.179 0.111 1.00 0.00 C ATOM 2778 CD ARG B 51 10.347 20.496 -0.544 1.00 0.00 C ATOM 2779 NE ARG B 51 11.795 20.660 -0.636 1.00 0.00 N ATOM 2780 CZ ARG B 51 12.382 21.749 -1.120 1.00 0.00 C ATOM 2781 NH1 ARG B 51 11.645 22.761 -1.557 1.00 0.00 N ATOM 2782 NH2 ARG B 51 13.704 21.828 -1.169 1.00 0.00 N ATOM 0 H ARG B 51 11.191 16.892 0.512 1.00 0.00 H new ATOM 0 HA ARG B 51 10.610 17.843 3.255 1.00 0.00 H new ATOM 0 HB2 ARG B 51 9.606 19.794 2.128 1.00 0.00 H new ATOM 0 HB3 ARG B 51 11.301 19.617 1.720 1.00 0.00 H new ATOM 0 HG2 ARG B 51 10.474 18.358 -0.393 1.00 0.00 H new ATOM 0 HG3 ARG B 51 8.893 19.010 -0.009 1.00 0.00 H new ATOM 0 HD2 ARG B 51 9.913 20.544 -1.543 1.00 0.00 H new ATOM 0 HD3 ARG B 51 9.924 21.322 0.028 1.00 0.00 H new ATOM 0 HE ARG B 51 12.388 19.897 -0.311 1.00 0.00 H new ATOM 0 HH11 ARG B 51 10.627 22.703 -1.522 1.00 0.00 H new ATOM 0 HH12 ARG B 51 12.096 23.597 -1.929 1.00 0.00 H new ATOM 0 HH21 ARG B 51 14.274 21.051 -0.834 1.00 0.00 H new ATOM 0 HH22 ARG B 51 14.151 22.666 -1.541 1.00 0.00 H new ATOM 2796 N ARG B 52 8.592 16.583 0.987 1.00 0.00 N ATOM 2797 CA ARG B 52 7.285 15.967 0.789 1.00 0.00 C ATOM 2798 C ARG B 52 7.343 14.469 1.068 1.00 0.00 C ATOM 2799 O ARG B 52 6.342 13.858 1.443 1.00 0.00 O ATOM 2800 CB ARG B 52 6.793 16.215 -0.637 1.00 0.00 C ATOM 2801 CG ARG B 52 6.556 17.682 -0.952 1.00 0.00 C ATOM 2802 CD ARG B 52 5.075 18.026 -0.926 1.00 0.00 C ATOM 2803 NE ARG B 52 4.562 18.134 0.437 1.00 0.00 N ATOM 2804 CZ ARG B 52 3.341 18.567 0.732 1.00 0.00 C ATOM 2805 NH1 ARG B 52 2.510 18.924 -0.237 1.00 0.00 N ATOM 2806 NH2 ARG B 52 2.949 18.642 1.997 1.00 0.00 N ATOM 0 H ARG B 52 9.212 16.525 0.179 1.00 0.00 H new ATOM 0 HA ARG B 52 6.585 16.421 1.491 1.00 0.00 H new ATOM 0 HB2 ARG B 52 7.524 15.815 -1.339 1.00 0.00 H new ATOM 0 HB3 ARG B 52 5.866 15.664 -0.793 1.00 0.00 H new ATOM 0 HG2 ARG B 52 7.087 18.301 -0.229 1.00 0.00 H new ATOM 0 HG3 ARG B 52 6.968 17.915 -1.934 1.00 0.00 H new ATOM 0 HD2 ARG B 52 4.912 18.968 -1.450 1.00 0.00 H new ATOM 0 HD3 ARG B 52 4.516 17.261 -1.464 1.00 0.00 H new ATOM 0 HE ARG B 52 5.175 17.862 1.205 1.00 0.00 H new ATOM 0 HH11 ARG B 52 2.808 18.867 -1.211 1.00 0.00 H new ATOM 0 HH12 ARG B 52 1.573 19.256 -0.009 1.00 0.00 H new ATOM 0 HH21 ARG B 52 3.585 18.367 2.745 1.00 0.00 H new ATOM 0 HH22 ARG B 52 2.011 18.975 2.221 1.00 0.00 H new ATOM 2820 N LEU B 53 8.521 13.884 0.882 1.00 0.00 N ATOM 2821 CA LEU B 53 8.712 12.457 1.113 1.00 0.00 C ATOM 2822 C LEU B 53 9.706 12.220 2.245 1.00 0.00 C ATOM 2823 O LEU B 53 10.611 13.023 2.467 1.00 0.00 O ATOM 2824 CB LEU B 53 9.201 11.774 -0.165 1.00 0.00 C ATOM 2825 CG LEU B 53 8.363 12.061 -1.411 1.00 0.00 C ATOM 2826 CD1 LEU B 53 9.260 12.260 -2.623 1.00 0.00 C ATOM 2827 CD2 LEU B 53 7.372 10.933 -1.657 1.00 0.00 C ATOM 0 H LEU B 53 9.359 14.376 0.572 1.00 0.00 H new ATOM 0 HA LEU B 53 7.752 12.027 1.400 1.00 0.00 H new ATOM 0 HB2 LEU B 53 10.228 12.086 -0.356 1.00 0.00 H new ATOM 0 HB3 LEU B 53 9.221 10.697 0.001 1.00 0.00 H new ATOM 0 HG LEU B 53 7.802 12.981 -1.246 1.00 0.00 H new ATOM 0 HD11 LEU B 53 8.646 12.463 -3.501 1.00 0.00 H new ATOM 0 HD12 LEU B 53 9.930 13.102 -2.446 1.00 0.00 H new ATOM 0 HD13 LEU B 53 9.848 11.358 -2.793 1.00 0.00 H new ATOM 0 HD21 LEU B 53 6.784 11.153 -2.548 1.00 0.00 H new ATOM 0 HD22 LEU B 53 7.913 9.998 -1.802 1.00 0.00 H new ATOM 0 HD23 LEU B 53 6.708 10.838 -0.798 1.00 0.00 H new ATOM 2839 N SER B 54 9.529 11.114 2.961 1.00 0.00 N ATOM 2840 CA SER B 54 10.411 10.779 4.071 1.00 0.00 C ATOM 2841 C SER B 54 10.738 9.289 4.085 1.00 0.00 C ATOM 2842 O SER B 54 9.897 8.455 3.753 1.00 0.00 O ATOM 2843 CB SER B 54 9.768 11.182 5.399 1.00 0.00 C ATOM 2844 OG SER B 54 10.752 11.451 6.382 1.00 0.00 O ATOM 0 H SER B 54 8.785 10.437 2.792 1.00 0.00 H new ATOM 0 HA SER B 54 11.341 11.333 3.939 1.00 0.00 H new ATOM 0 HB2 SER B 54 9.146 12.065 5.252 1.00 0.00 H new ATOM 0 HB3 SER B 54 9.112 10.384 5.746 1.00 0.00 H new ATOM 0 HG SER B 54 10.315 11.708 7.221 1.00 0.00 H new ATOM 2850 N VAL B 55 11.966 8.966 4.474 1.00 0.00 N ATOM 2851 CA VAL B 55 12.412 7.582 4.537 1.00 0.00 C ATOM 2852 C VAL B 55 13.127 7.307 5.854 1.00 0.00 C ATOM 2853 O VAL B 55 14.128 7.949 6.174 1.00 0.00 O ATOM 2854 CB VAL B 55 13.362 7.221 3.372 1.00 0.00 C ATOM 2855 CG1 VAL B 55 12.607 6.479 2.280 1.00 0.00 C ATOM 2856 CG2 VAL B 55 14.053 8.457 2.806 1.00 0.00 C ATOM 0 H VAL B 55 12.672 9.648 4.751 1.00 0.00 H new ATOM 0 HA VAL B 55 11.517 6.964 4.459 1.00 0.00 H new ATOM 0 HB VAL B 55 14.138 6.565 3.768 1.00 0.00 H new ATOM 0 HG11 VAL B 55 13.291 6.233 1.468 1.00 0.00 H new ATOM 0 HG12 VAL B 55 12.184 5.561 2.689 1.00 0.00 H new ATOM 0 HG13 VAL B 55 11.804 7.110 1.899 1.00 0.00 H new ATOM 0 HG21 VAL B 55 14.712 8.163 1.989 1.00 0.00 H new ATOM 0 HG22 VAL B 55 13.303 9.155 2.434 1.00 0.00 H new ATOM 0 HG23 VAL B 55 14.638 8.938 3.590 1.00 0.00 H new ATOM 2866 N ASP B 56 12.608 6.353 6.618 1.00 0.00 N ATOM 2867 CA ASP B 56 13.201 6.000 7.901 1.00 0.00 C ATOM 2868 C ASP B 56 13.289 4.481 8.066 1.00 0.00 C ATOM 2869 O ASP B 56 12.340 3.764 7.743 1.00 0.00 O ATOM 2870 CB ASP B 56 12.382 6.599 9.046 1.00 0.00 C ATOM 2871 CG ASP B 56 12.380 8.115 9.024 1.00 0.00 C ATOM 2872 OD1 ASP B 56 11.625 8.695 8.215 1.00 0.00 O ATOM 2873 OD2 ASP B 56 13.131 8.722 9.815 1.00 0.00 O ATOM 0 H ASP B 56 11.780 5.811 6.372 1.00 0.00 H new ATOM 0 HA ASP B 56 14.211 6.409 7.929 1.00 0.00 H new ATOM 0 HB2 ASP B 56 11.356 6.236 8.984 1.00 0.00 H new ATOM 0 HB3 ASP B 56 12.785 6.253 9.998 1.00 0.00 H new ATOM 2878 N PRO B 57 14.427 3.959 8.571 1.00 0.00 N ATOM 2879 CA PRO B 57 15.586 4.769 8.970 1.00 0.00 C ATOM 2880 C PRO B 57 16.358 5.299 7.763 1.00 0.00 C ATOM 2881 O PRO B 57 16.660 4.547 6.835 1.00 0.00 O ATOM 2882 CB PRO B 57 16.444 3.784 9.763 1.00 0.00 C ATOM 2883 CG PRO B 57 16.114 2.453 9.185 1.00 0.00 C ATOM 2884 CD PRO B 57 14.663 2.519 8.789 1.00 0.00 C ATOM 0 HA PRO B 57 15.296 5.654 9.536 1.00 0.00 H new ATOM 0 HB2 PRO B 57 17.505 4.010 9.660 1.00 0.00 H new ATOM 0 HB3 PRO B 57 16.212 3.823 10.827 1.00 0.00 H new ATOM 0 HG2 PRO B 57 16.744 2.235 8.323 1.00 0.00 H new ATOM 0 HG3 PRO B 57 16.284 1.659 9.912 1.00 0.00 H new ATOM 0 HD2 PRO B 57 14.467 1.940 7.887 1.00 0.00 H new ATOM 0 HD3 PRO B 57 14.016 2.121 9.570 1.00 0.00 H new ATOM 2892 N PRO B 58 16.693 6.601 7.753 1.00 0.00 N ATOM 2893 CA PRO B 58 17.435 7.213 6.646 1.00 0.00 C ATOM 2894 C PRO B 58 18.673 6.407 6.271 1.00 0.00 C ATOM 2895 O PRO B 58 18.995 6.255 5.093 1.00 0.00 O ATOM 2896 CB PRO B 58 17.833 8.581 7.202 1.00 0.00 C ATOM 2897 CG PRO B 58 16.781 8.895 8.209 1.00 0.00 C ATOM 2898 CD PRO B 58 16.382 7.578 8.815 1.00 0.00 C ATOM 0 HA PRO B 58 16.842 7.267 5.733 1.00 0.00 H new ATOM 0 HB2 PRO B 58 18.823 8.551 7.658 1.00 0.00 H new ATOM 0 HB3 PRO B 58 17.867 9.335 6.415 1.00 0.00 H new ATOM 0 HG2 PRO B 58 17.161 9.576 8.971 1.00 0.00 H new ATOM 0 HG3 PRO B 58 15.927 9.384 7.741 1.00 0.00 H new ATOM 0 HD2 PRO B 58 16.941 7.370 9.727 1.00 0.00 H new ATOM 0 HD3 PRO B 58 15.324 7.561 9.078 1.00 0.00 H new ATOM 2906 N CYS B 59 19.360 5.888 7.281 1.00 0.00 N ATOM 2907 CA CYS B 59 20.562 5.091 7.062 1.00 0.00 C ATOM 2908 C CYS B 59 20.671 3.995 8.117 1.00 0.00 C ATOM 2909 O CYS B 59 20.007 4.051 9.152 1.00 0.00 O ATOM 2910 CB CYS B 59 21.805 5.981 7.104 1.00 0.00 C ATOM 2911 SG CYS B 59 22.125 6.726 8.720 1.00 0.00 S ATOM 0 H CYS B 59 19.105 6.005 8.262 1.00 0.00 H new ATOM 0 HA CYS B 59 20.494 4.627 6.078 1.00 0.00 H new ATOM 0 HB2 CYS B 59 22.672 5.390 6.810 1.00 0.00 H new ATOM 0 HB3 CYS B 59 21.696 6.775 6.365 1.00 0.00 H new ATOM 0 HG CYS B 59 23.408 6.830 8.903 1.00 0.00 H new ATOM 2917 N GLY B 60 21.510 2.999 7.854 1.00 0.00 N ATOM 2918 CA GLY B 60 21.680 1.912 8.799 1.00 0.00 C ATOM 2919 C GLY B 60 22.542 0.790 8.256 1.00 0.00 C ATOM 2920 O GLY B 60 22.635 0.599 7.044 1.00 0.00 O ATOM 0 H GLY B 60 22.073 2.925 7.007 1.00 0.00 H new ATOM 0 HA2 GLY B 60 22.129 2.299 9.714 1.00 0.00 H new ATOM 0 HA3 GLY B 60 20.701 1.514 9.068 1.00 0.00 H new ATOM 2924 N VAL B 61 23.172 0.045 9.158 1.00 0.00 N ATOM 2925 CA VAL B 61 24.029 -1.068 8.769 1.00 0.00 C ATOM 2926 C VAL B 61 23.265 -2.387 8.812 1.00 0.00 C ATOM 2927 O VAL B 61 22.721 -2.766 9.849 1.00 0.00 O ATOM 2928 CB VAL B 61 25.262 -1.171 9.686 1.00 0.00 C ATOM 2929 CG1 VAL B 61 26.192 -2.276 9.211 1.00 0.00 C ATOM 2930 CG2 VAL B 61 25.995 0.161 9.747 1.00 0.00 C ATOM 0 H VAL B 61 23.105 0.193 10.165 1.00 0.00 H new ATOM 0 HA VAL B 61 24.359 -0.875 7.748 1.00 0.00 H new ATOM 0 HB VAL B 61 24.923 -1.421 10.691 1.00 0.00 H new ATOM 0 HG11 VAL B 61 27.057 -2.333 9.872 1.00 0.00 H new ATOM 0 HG12 VAL B 61 25.662 -3.228 9.224 1.00 0.00 H new ATOM 0 HG13 VAL B 61 26.525 -2.060 8.196 1.00 0.00 H new ATOM 0 HG21 VAL B 61 26.863 0.069 10.400 1.00 0.00 H new ATOM 0 HG22 VAL B 61 26.322 0.443 8.746 1.00 0.00 H new ATOM 0 HG23 VAL B 61 25.326 0.927 10.139 1.00 0.00 H new ATOM 2940 N LEU B 62 23.226 -3.081 7.679 1.00 0.00 N ATOM 2941 CA LEU B 62 22.525 -4.356 7.591 1.00 0.00 C ATOM 2942 C LEU B 62 23.498 -5.522 7.726 1.00 0.00 C ATOM 2943 O LEU B 62 24.660 -5.421 7.337 1.00 0.00 O ATOM 2944 CB LEU B 62 21.770 -4.458 6.264 1.00 0.00 C ATOM 2945 CG LEU B 62 20.329 -4.956 6.376 1.00 0.00 C ATOM 2946 CD1 LEU B 62 19.562 -4.142 7.408 1.00 0.00 C ATOM 2947 CD2 LEU B 62 19.637 -4.892 5.023 1.00 0.00 C ATOM 0 H LEU B 62 23.671 -2.782 6.811 1.00 0.00 H new ATOM 0 HA LEU B 62 21.810 -4.405 8.412 1.00 0.00 H new ATOM 0 HB2 LEU B 62 21.763 -3.476 5.791 1.00 0.00 H new ATOM 0 HB3 LEU B 62 22.319 -5.127 5.602 1.00 0.00 H new ATOM 0 HG LEU B 62 20.348 -5.995 6.704 1.00 0.00 H new ATOM 0 HD11 LEU B 62 18.538 -4.510 7.474 1.00 0.00 H new ATOM 0 HD12 LEU B 62 20.046 -4.238 8.380 1.00 0.00 H new ATOM 0 HD13 LEU B 62 19.552 -3.094 7.110 1.00 0.00 H new ATOM 0 HD21 LEU B 62 18.612 -5.250 5.121 1.00 0.00 H new ATOM 0 HD22 LEU B 62 19.629 -3.862 4.667 1.00 0.00 H new ATOM 0 HD23 LEU B 62 20.173 -5.518 4.310 1.00 0.00 H new ATOM 2959 N ASP B 63 23.013 -6.629 8.279 1.00 0.00 N ATOM 2960 CA ASP B 63 23.839 -7.815 8.465 1.00 0.00 C ATOM 2961 C ASP B 63 23.690 -8.772 7.284 1.00 0.00 C ATOM 2962 O ASP B 63 22.797 -8.609 6.452 1.00 0.00 O ATOM 2963 CB ASP B 63 23.462 -8.527 9.766 1.00 0.00 C ATOM 2964 CG ASP B 63 24.333 -8.099 10.931 1.00 0.00 C ATOM 2965 OD1 ASP B 63 24.674 -6.900 11.008 1.00 0.00 O ATOM 2966 OD2 ASP B 63 24.674 -8.962 11.765 1.00 0.00 O ATOM 0 H ASP B 63 22.052 -6.729 8.606 1.00 0.00 H new ATOM 0 HA ASP B 63 24.880 -7.497 8.523 1.00 0.00 H new ATOM 0 HB2 ASP B 63 22.418 -8.320 10.001 1.00 0.00 H new ATOM 0 HB3 ASP B 63 23.550 -9.604 9.626 1.00 0.00 H new ATOM 2971 N PRO B 64 24.569 -9.786 7.194 1.00 0.00 N ATOM 2972 CA PRO B 64 24.533 -10.769 6.105 1.00 0.00 C ATOM 2973 C PRO B 64 23.255 -11.600 6.116 1.00 0.00 C ATOM 2974 O PRO B 64 22.954 -12.281 7.096 1.00 0.00 O ATOM 2975 CB PRO B 64 25.750 -11.665 6.379 1.00 0.00 C ATOM 2976 CG PRO B 64 26.606 -10.892 7.325 1.00 0.00 C ATOM 2977 CD PRO B 64 25.665 -10.050 8.136 1.00 0.00 C ATOM 0 HA PRO B 64 24.556 -10.286 5.128 1.00 0.00 H new ATOM 0 HB2 PRO B 64 25.447 -12.618 6.813 1.00 0.00 H new ATOM 0 HB3 PRO B 64 26.287 -11.891 5.458 1.00 0.00 H new ATOM 0 HG2 PRO B 64 27.183 -11.560 7.965 1.00 0.00 H new ATOM 0 HG3 PRO B 64 27.321 -10.270 6.786 1.00 0.00 H new ATOM 0 HD2 PRO B 64 25.316 -10.575 9.025 1.00 0.00 H new ATOM 0 HD3 PRO B 64 26.137 -9.128 8.475 1.00 0.00 H new ATOM 2985 N LYS B 65 22.509 -11.546 5.017 1.00 0.00 N ATOM 2986 CA LYS B 65 21.266 -12.300 4.899 1.00 0.00 C ATOM 2987 C LYS B 65 20.195 -11.766 5.848 1.00 0.00 C ATOM 2988 O LYS B 65 19.218 -12.455 6.142 1.00 0.00 O ATOM 2989 CB LYS B 65 21.518 -13.782 5.186 1.00 0.00 C ATOM 2990 CG LYS B 65 20.382 -14.689 4.743 1.00 0.00 C ATOM 2991 CD LYS B 65 20.879 -15.794 3.826 1.00 0.00 C ATOM 2992 CE LYS B 65 21.425 -15.233 2.523 1.00 0.00 C ATOM 2993 NZ LYS B 65 20.350 -14.630 1.687 1.00 0.00 N ATOM 0 H LYS B 65 22.744 -10.988 4.196 1.00 0.00 H new ATOM 0 HA LYS B 65 20.904 -12.183 3.878 1.00 0.00 H new ATOM 0 HB2 LYS B 65 22.435 -14.090 4.683 1.00 0.00 H new ATOM 0 HB3 LYS B 65 21.681 -13.914 6.256 1.00 0.00 H new ATOM 0 HG2 LYS B 65 19.903 -15.128 5.618 1.00 0.00 H new ATOM 0 HG3 LYS B 65 19.624 -14.100 4.227 1.00 0.00 H new ATOM 0 HD2 LYS B 65 21.657 -16.365 4.332 1.00 0.00 H new ATOM 0 HD3 LYS B 65 20.064 -16.485 3.612 1.00 0.00 H new ATOM 0 HE2 LYS B 65 22.182 -14.480 2.741 1.00 0.00 H new ATOM 0 HE3 LYS B 65 21.918 -16.028 1.963 1.00 0.00 H new ATOM 0 HZ1 LYS B 65 20.721 -14.428 0.737 1.00 0.00 H new ATOM 0 HZ2 LYS B 65 19.553 -15.295 1.614 1.00 0.00 H new ATOM 0 HZ3 LYS B 65 20.024 -13.746 2.126 1.00 0.00 H new ATOM 3007 N GLU B 66 20.377 -10.537 6.323 1.00 0.00 N ATOM 3008 CA GLU B 66 19.418 -9.924 7.234 1.00 0.00 C ATOM 3009 C GLU B 66 18.337 -9.177 6.459 1.00 0.00 C ATOM 3010 O GLU B 66 18.567 -8.718 5.341 1.00 0.00 O ATOM 3011 CB GLU B 66 20.130 -8.967 8.191 1.00 0.00 C ATOM 3012 CG GLU B 66 20.133 -9.443 9.635 1.00 0.00 C ATOM 3013 CD GLU B 66 19.710 -8.360 10.608 1.00 0.00 C ATOM 3014 OE1 GLU B 66 18.980 -7.437 10.188 1.00 0.00 O ATOM 3015 OE2 GLU B 66 20.108 -8.434 11.789 1.00 0.00 O ATOM 0 H GLU B 66 21.177 -9.948 6.093 1.00 0.00 H new ATOM 0 HA GLU B 66 18.945 -10.717 7.813 1.00 0.00 H new ATOM 0 HB2 GLU B 66 21.160 -8.833 7.859 1.00 0.00 H new ATOM 0 HB3 GLU B 66 19.649 -7.990 8.140 1.00 0.00 H new ATOM 0 HG2 GLU B 66 19.462 -10.297 9.733 1.00 0.00 H new ATOM 0 HG3 GLU B 66 21.132 -9.791 9.897 1.00 0.00 H new ATOM 3022 N LYS B 67 17.158 -9.060 7.061 1.00 0.00 N ATOM 3023 CA LYS B 67 16.043 -8.370 6.426 1.00 0.00 C ATOM 3024 C LYS B 67 15.544 -7.220 7.294 1.00 0.00 C ATOM 3025 O LYS B 67 15.684 -7.246 8.517 1.00 0.00 O ATOM 3026 CB LYS B 67 14.900 -9.349 6.151 1.00 0.00 C ATOM 3027 CG LYS B 67 15.285 -10.486 5.220 1.00 0.00 C ATOM 3028 CD LYS B 67 15.067 -11.841 5.872 1.00 0.00 C ATOM 3029 CE LYS B 67 15.460 -12.976 4.943 1.00 0.00 C ATOM 3030 NZ LYS B 67 14.618 -14.185 5.155 1.00 0.00 N ATOM 0 H LYS B 67 16.951 -9.434 7.987 1.00 0.00 H new ATOM 0 HA LYS B 67 16.397 -7.958 5.481 1.00 0.00 H new ATOM 0 HB2 LYS B 67 14.554 -9.766 7.097 1.00 0.00 H new ATOM 0 HB3 LYS B 67 14.062 -8.804 5.718 1.00 0.00 H new ATOM 0 HG2 LYS B 67 14.696 -10.423 4.305 1.00 0.00 H new ATOM 0 HG3 LYS B 67 16.332 -10.384 4.933 1.00 0.00 H new ATOM 0 HD2 LYS B 67 15.651 -11.902 6.790 1.00 0.00 H new ATOM 0 HD3 LYS B 67 14.019 -11.946 6.153 1.00 0.00 H new ATOM 0 HE2 LYS B 67 15.368 -12.646 3.908 1.00 0.00 H new ATOM 0 HE3 LYS B 67 16.508 -13.231 5.104 1.00 0.00 H new ATOM 0 HZ1 LYS B 67 14.918 -14.936 4.502 1.00 0.00 H new ATOM 0 HZ2 LYS B 67 14.725 -14.515 6.135 1.00 0.00 H new ATOM 0 HZ3 LYS B 67 13.621 -13.949 4.976 1.00 0.00 H new ATOM 3044 N VAL B 68 14.962 -6.212 6.653 1.00 0.00 N ATOM 3045 CA VAL B 68 14.439 -5.052 7.365 1.00 0.00 C ATOM 3046 C VAL B 68 13.215 -4.483 6.658 1.00 0.00 C ATOM 3047 O VAL B 68 13.062 -4.631 5.444 1.00 0.00 O ATOM 3048 CB VAL B 68 15.502 -3.947 7.497 1.00 0.00 C ATOM 3049 CG1 VAL B 68 16.489 -4.285 8.605 1.00 0.00 C ATOM 3050 CG2 VAL B 68 16.225 -3.739 6.175 1.00 0.00 C ATOM 0 H VAL B 68 14.841 -6.175 5.641 1.00 0.00 H new ATOM 0 HA VAL B 68 14.156 -5.392 8.361 1.00 0.00 H new ATOM 0 HB VAL B 68 15.000 -3.016 7.760 1.00 0.00 H new ATOM 0 HG11 VAL B 68 17.233 -3.492 8.684 1.00 0.00 H new ATOM 0 HG12 VAL B 68 15.956 -4.378 9.551 1.00 0.00 H new ATOM 0 HG13 VAL B 68 16.986 -5.228 8.375 1.00 0.00 H new ATOM 0 HG21 VAL B 68 16.973 -2.954 6.289 1.00 0.00 H new ATOM 0 HG22 VAL B 68 16.715 -4.666 5.878 1.00 0.00 H new ATOM 0 HG23 VAL B 68 15.506 -3.447 5.409 1.00 0.00 H new ATOM 3060 N LEU B 69 12.342 -3.836 7.423 1.00 0.00 N ATOM 3061 CA LEU B 69 11.128 -3.248 6.868 1.00 0.00 C ATOM 3062 C LEU B 69 11.178 -1.725 6.921 1.00 0.00 C ATOM 3063 O LEU B 69 10.781 -1.115 7.914 1.00 0.00 O ATOM 3064 CB LEU B 69 9.899 -3.755 7.623 1.00 0.00 C ATOM 3065 CG LEU B 69 8.575 -3.615 6.870 1.00 0.00 C ATOM 3066 CD1 LEU B 69 8.700 -4.180 5.463 1.00 0.00 C ATOM 3067 CD2 LEU B 69 7.457 -4.313 7.629 1.00 0.00 C ATOM 0 H LEU B 69 12.452 -3.706 8.429 1.00 0.00 H new ATOM 0 HA LEU B 69 11.058 -3.551 5.823 1.00 0.00 H new ATOM 0 HB2 LEU B 69 10.050 -4.806 7.869 1.00 0.00 H new ATOM 0 HB3 LEU B 69 9.822 -3.214 8.566 1.00 0.00 H new ATOM 0 HG LEU B 69 8.331 -2.556 6.794 1.00 0.00 H new ATOM 0 HD11 LEU B 69 7.749 -4.072 4.942 1.00 0.00 H new ATOM 0 HD12 LEU B 69 9.475 -3.638 4.921 1.00 0.00 H new ATOM 0 HD13 LEU B 69 8.966 -5.236 5.517 1.00 0.00 H new ATOM 0 HD21 LEU B 69 6.522 -4.204 7.080 1.00 0.00 H new ATOM 0 HD22 LEU B 69 7.695 -5.371 7.735 1.00 0.00 H new ATOM 0 HD23 LEU B 69 7.352 -3.864 8.617 1.00 0.00 H new ATOM 3079 N MET B 70 11.663 -1.116 5.844 1.00 0.00 N ATOM 3080 CA MET B 70 11.758 0.336 5.762 1.00 0.00 C ATOM 3081 C MET B 70 10.377 0.953 5.585 1.00 0.00 C ATOM 3082 O MET B 70 9.440 0.282 5.154 1.00 0.00 O ATOM 3083 CB MET B 70 12.669 0.742 4.600 1.00 0.00 C ATOM 3084 CG MET B 70 12.669 2.235 4.314 1.00 0.00 C ATOM 3085 SD MET B 70 13.661 2.664 2.872 1.00 0.00 S ATOM 3086 CE MET B 70 12.952 1.580 1.635 1.00 0.00 C ATOM 0 H MET B 70 11.997 -1.607 5.015 1.00 0.00 H new ATOM 0 HA MET B 70 12.187 0.707 6.693 1.00 0.00 H new ATOM 0 HB2 MET B 70 13.688 0.424 4.821 1.00 0.00 H new ATOM 0 HB3 MET B 70 12.356 0.209 3.702 1.00 0.00 H new ATOM 0 HG2 MET B 70 11.644 2.571 4.158 1.00 0.00 H new ATOM 0 HG3 MET B 70 13.051 2.768 5.185 1.00 0.00 H new ATOM 0 HE1 MET B 70 13.294 1.884 0.646 1.00 0.00 H new ATOM 0 HE2 MET B 70 13.266 0.554 1.827 1.00 0.00 H new ATOM 0 HE3 MET B 70 11.865 1.641 1.678 1.00 0.00 H new ATOM 3096 N ALA B 71 10.258 2.230 5.922 1.00 0.00 N ATOM 3097 CA ALA B 71 8.988 2.937 5.801 1.00 0.00 C ATOM 3098 C ALA B 71 9.133 4.191 4.945 1.00 0.00 C ATOM 3099 O ALA B 71 10.026 5.008 5.169 1.00 0.00 O ATOM 3100 CB ALA B 71 8.451 3.296 7.178 1.00 0.00 C ATOM 0 H ALA B 71 11.025 2.799 6.281 1.00 0.00 H new ATOM 0 HA ALA B 71 8.279 2.273 5.307 1.00 0.00 H new ATOM 0 HB1 ALA B 71 7.503 3.823 7.073 1.00 0.00 H new ATOM 0 HB2 ALA B 71 8.298 2.386 7.757 1.00 0.00 H new ATOM 0 HB3 ALA B 71 9.167 3.937 7.692 1.00 0.00 H new ATOM 3106 N VAL B 72 8.248 4.336 3.964 1.00 0.00 N ATOM 3107 CA VAL B 72 8.273 5.492 3.074 1.00 0.00 C ATOM 3108 C VAL B 72 7.073 6.400 3.320 1.00 0.00 C ATOM 3109 O VAL B 72 6.003 6.199 2.746 1.00 0.00 O ATOM 3110 CB VAL B 72 8.280 5.062 1.595 1.00 0.00 C ATOM 3111 CG1 VAL B 72 8.379 6.277 0.686 1.00 0.00 C ATOM 3112 CG2 VAL B 72 9.419 4.090 1.326 1.00 0.00 C ATOM 0 H VAL B 72 7.504 3.667 3.765 1.00 0.00 H new ATOM 0 HA VAL B 72 9.191 6.038 3.291 1.00 0.00 H new ATOM 0 HB VAL B 72 7.341 4.552 1.380 1.00 0.00 H new ATOM 0 HG11 VAL B 72 8.383 5.953 -0.355 1.00 0.00 H new ATOM 0 HG12 VAL B 72 7.525 6.932 0.859 1.00 0.00 H new ATOM 0 HG13 VAL B 72 9.301 6.818 0.901 1.00 0.00 H new ATOM 0 HG21 VAL B 72 9.407 3.798 0.276 1.00 0.00 H new ATOM 0 HG22 VAL B 72 10.370 4.570 1.559 1.00 0.00 H new ATOM 0 HG23 VAL B 72 9.297 3.205 1.950 1.00 0.00 H new ATOM 3122 N SER B 73 7.257 7.399 4.178 1.00 0.00 N ATOM 3123 CA SER B 73 6.189 8.336 4.502 1.00 0.00 C ATOM 3124 C SER B 73 5.826 9.192 3.292 1.00 0.00 C ATOM 3125 O SER B 73 6.691 9.813 2.676 1.00 0.00 O ATOM 3126 CB SER B 73 6.608 9.233 5.667 1.00 0.00 C ATOM 3127 OG SER B 73 7.615 8.617 6.450 1.00 0.00 O ATOM 0 H SER B 73 8.137 7.580 4.661 1.00 0.00 H new ATOM 0 HA SER B 73 5.310 7.759 4.791 1.00 0.00 H new ATOM 0 HB2 SER B 73 6.974 10.185 5.283 1.00 0.00 H new ATOM 0 HB3 SER B 73 5.741 9.452 6.291 1.00 0.00 H new ATOM 0 HG SER B 73 7.866 9.212 7.187 1.00 0.00 H new ATOM 3133 N CYS B 74 4.538 9.221 2.960 1.00 0.00 N ATOM 3134 CA CYS B 74 4.057 10.003 1.828 1.00 0.00 C ATOM 3135 C CYS B 74 2.868 10.867 2.236 1.00 0.00 C ATOM 3136 O CYS B 74 1.745 10.377 2.356 1.00 0.00 O ATOM 3137 CB CYS B 74 3.661 9.082 0.673 1.00 0.00 C ATOM 3138 SG CYS B 74 4.020 9.758 -0.966 1.00 0.00 S ATOM 0 H CYS B 74 3.810 8.711 3.460 1.00 0.00 H new ATOM 0 HA CYS B 74 4.865 10.656 1.498 1.00 0.00 H new ATOM 0 HB2 CYS B 74 4.183 8.132 0.785 1.00 0.00 H new ATOM 0 HB3 CYS B 74 2.594 8.870 0.741 1.00 0.00 H new ATOM 0 HG CYS B 74 3.939 8.811 -1.853 1.00 0.00 H new ATOM 3144 N ASP B 75 3.122 12.153 2.452 1.00 0.00 N ATOM 3145 CA ASP B 75 2.072 13.082 2.850 1.00 0.00 C ATOM 3146 C ASP B 75 1.159 13.418 1.676 1.00 0.00 C ATOM 3147 O ASP B 75 1.605 13.506 0.532 1.00 0.00 O ATOM 3148 CB ASP B 75 2.684 14.365 3.415 1.00 0.00 C ATOM 3149 CG ASP B 75 3.146 14.202 4.850 1.00 0.00 C ATOM 3150 OD1 ASP B 75 2.716 13.230 5.507 1.00 0.00 O ATOM 3151 OD2 ASP B 75 3.939 15.046 5.318 1.00 0.00 O ATOM 0 H ASP B 75 4.046 12.575 2.358 1.00 0.00 H new ATOM 0 HA ASP B 75 1.474 12.599 3.622 1.00 0.00 H new ATOM 0 HB2 ASP B 75 3.530 14.664 2.796 1.00 0.00 H new ATOM 0 HB3 ASP B 75 1.950 15.169 3.362 1.00 0.00 H new ATOM 3156 N THR B 76 -0.123 13.606 1.971 1.00 0.00 N ATOM 3157 CA THR B 76 -1.109 13.934 0.946 1.00 0.00 C ATOM 3158 C THR B 76 -0.624 15.081 0.063 1.00 0.00 C ATOM 3159 O THR B 76 0.290 15.819 0.433 1.00 0.00 O ATOM 3160 CB THR B 76 -2.447 14.307 1.592 1.00 0.00 C ATOM 3161 OG1 THR B 76 -3.215 15.120 0.723 1.00 0.00 O ATOM 3162 CG2 THR B 76 -2.298 15.053 2.901 1.00 0.00 C ATOM 0 H THR B 76 -0.505 13.537 2.914 1.00 0.00 H new ATOM 0 HA THR B 76 -1.246 13.052 0.321 1.00 0.00 H new ATOM 0 HB THR B 76 -2.943 13.357 1.789 1.00 0.00 H new ATOM 0 HG1 THR B 76 -3.423 14.620 -0.094 1.00 0.00 H new ATOM 0 HG21 THR B 76 -3.285 15.285 3.302 1.00 0.00 H new ATOM 0 HG22 THR B 76 -1.754 14.433 3.613 1.00 0.00 H new ATOM 0 HG23 THR B 76 -1.748 15.979 2.732 1.00 0.00 H new ATOM 3170 N PHE B 77 -1.245 15.225 -1.104 1.00 0.00 N ATOM 3171 CA PHE B 77 -0.883 16.283 -2.040 1.00 0.00 C ATOM 3172 C PHE B 77 -1.919 16.401 -3.156 1.00 0.00 C ATOM 3173 O PHE B 77 -3.034 15.895 -3.036 1.00 0.00 O ATOM 3174 CB PHE B 77 0.509 16.024 -2.629 1.00 0.00 C ATOM 3175 CG PHE B 77 0.538 14.958 -3.691 1.00 0.00 C ATOM 3176 CD1 PHE B 77 -0.026 13.713 -3.460 1.00 0.00 C ATOM 3177 CD2 PHE B 77 1.130 15.204 -4.920 1.00 0.00 C ATOM 3178 CE1 PHE B 77 0.001 12.734 -4.435 1.00 0.00 C ATOM 3179 CE2 PHE B 77 1.160 14.228 -5.898 1.00 0.00 C ATOM 3180 CZ PHE B 77 0.594 12.992 -5.655 1.00 0.00 C ATOM 0 H PHE B 77 -2.002 14.621 -1.424 1.00 0.00 H new ATOM 0 HA PHE B 77 -0.861 17.226 -1.494 1.00 0.00 H new ATOM 0 HB2 PHE B 77 0.892 16.953 -3.051 1.00 0.00 H new ATOM 0 HB3 PHE B 77 1.185 15.738 -1.823 1.00 0.00 H new ATOM 0 HD1 PHE B 77 -0.492 13.506 -2.508 1.00 0.00 H new ATOM 0 HD2 PHE B 77 1.573 16.169 -5.116 1.00 0.00 H new ATOM 0 HE1 PHE B 77 -0.441 11.768 -4.243 1.00 0.00 H new ATOM 0 HE2 PHE B 77 1.625 14.432 -6.851 1.00 0.00 H new ATOM 0 HZ PHE B 77 0.615 12.228 -6.418 1.00 0.00 H new ATOM 3190 N ASN B 78 -1.541 17.069 -4.241 1.00 0.00 N ATOM 3191 CA ASN B 78 -2.437 17.250 -5.377 1.00 0.00 C ATOM 3192 C ASN B 78 -1.955 16.449 -6.583 1.00 0.00 C ATOM 3193 O ASN B 78 -0.854 16.669 -7.085 1.00 0.00 O ATOM 3194 CB ASN B 78 -2.540 18.731 -5.743 1.00 0.00 C ATOM 3195 CG ASN B 78 -3.346 19.523 -4.731 1.00 0.00 C ATOM 3196 OD1 ASN B 78 -2.798 20.316 -3.968 1.00 0.00 O ATOM 3197 ND2 ASN B 78 -4.657 19.309 -4.723 1.00 0.00 N ATOM 0 H ASN B 78 -0.621 17.494 -4.357 1.00 0.00 H new ATOM 0 HA ASN B 78 -3.423 16.885 -5.091 1.00 0.00 H new ATOM 0 HB2 ASN B 78 -1.538 19.155 -5.817 1.00 0.00 H new ATOM 0 HB3 ASN B 78 -3.001 18.828 -6.726 1.00 0.00 H new ATOM 0 HD21 ASN B 78 -5.252 19.813 -4.065 1.00 0.00 H new ATOM 0 HD22 ASN B 78 -5.069 18.641 -5.375 1.00 0.00 H new ATOM 3204 N ALA B 79 -2.787 15.519 -7.042 1.00 0.00 N ATOM 3205 CA ALA B 79 -2.444 14.686 -8.189 1.00 0.00 C ATOM 3206 C ALA B 79 -3.288 15.041 -9.412 1.00 0.00 C ATOM 3207 O ALA B 79 -3.391 14.255 -10.353 1.00 0.00 O ATOM 3208 CB ALA B 79 -2.620 13.217 -7.839 1.00 0.00 C ATOM 0 H ALA B 79 -3.703 15.324 -6.637 1.00 0.00 H new ATOM 0 HA ALA B 79 -1.400 14.874 -8.439 1.00 0.00 H new ATOM 0 HB1 ALA B 79 -2.361 12.604 -8.702 1.00 0.00 H new ATOM 0 HB2 ALA B 79 -1.968 12.961 -7.004 1.00 0.00 H new ATOM 0 HB3 ALA B 79 -3.657 13.031 -7.560 1.00 0.00 H new ATOM 3214 N ALA B 80 -3.890 16.227 -9.392 1.00 0.00 N ATOM 3215 CA ALA B 80 -4.722 16.679 -10.500 1.00 0.00 C ATOM 3216 C ALA B 80 -3.960 17.638 -11.407 1.00 0.00 C ATOM 3217 O ALA B 80 -4.303 17.804 -12.578 1.00 0.00 O ATOM 3218 CB ALA B 80 -5.984 17.347 -9.974 1.00 0.00 C ATOM 0 H ALA B 80 -3.817 16.891 -8.621 1.00 0.00 H new ATOM 0 HA ALA B 80 -5.000 15.805 -11.089 1.00 0.00 H new ATOM 0 HB1 ALA B 80 -6.596 17.680 -10.812 1.00 0.00 H new ATOM 0 HB2 ALA B 80 -6.549 16.635 -9.372 1.00 0.00 H new ATOM 0 HB3 ALA B 80 -5.712 18.206 -9.360 1.00 0.00 H new ATOM 3224 N THR B 81 -2.931 18.274 -10.858 1.00 0.00 N ATOM 3225 CA THR B 81 -2.131 19.223 -11.619 1.00 0.00 C ATOM 3226 C THR B 81 -0.652 19.102 -11.265 1.00 0.00 C ATOM 3227 O THR B 81 0.012 20.098 -10.979 1.00 0.00 O ATOM 3228 CB THR B 81 -2.619 20.644 -11.354 1.00 0.00 C ATOM 3229 OG1 THR B 81 -2.464 20.983 -9.986 1.00 0.00 O ATOM 3230 CG2 THR B 81 -4.074 20.840 -11.716 1.00 0.00 C ATOM 0 H THR B 81 -2.633 18.149 -9.891 1.00 0.00 H new ATOM 0 HA THR B 81 -2.245 18.994 -12.679 1.00 0.00 H new ATOM 0 HB THR B 81 -2.008 21.289 -11.986 1.00 0.00 H new ATOM 0 HG1 THR B 81 -2.781 21.898 -9.838 1.00 0.00 H new ATOM 0 HG21 THR B 81 -4.366 21.869 -11.506 1.00 0.00 H new ATOM 0 HG22 THR B 81 -4.216 20.631 -12.776 1.00 0.00 H new ATOM 0 HG23 THR B 81 -4.690 20.161 -11.127 1.00 0.00 H new ATOM 3238 N GLU B 82 -0.141 17.874 -11.285 1.00 0.00 N ATOM 3239 CA GLU B 82 1.259 17.624 -10.967 1.00 0.00 C ATOM 3240 C GLU B 82 1.733 16.310 -11.578 1.00 0.00 C ATOM 3241 O GLU B 82 0.961 15.360 -11.708 1.00 0.00 O ATOM 3242 CB GLU B 82 1.461 17.594 -9.451 1.00 0.00 C ATOM 3243 CG GLU B 82 1.285 18.948 -8.785 1.00 0.00 C ATOM 3244 CD GLU B 82 1.662 18.928 -7.317 1.00 0.00 C ATOM 3245 OE1 GLU B 82 0.926 18.305 -6.523 1.00 0.00 O ATOM 3246 OE2 GLU B 82 2.695 19.534 -6.961 1.00 0.00 O ATOM 0 H GLU B 82 -0.676 17.038 -11.518 1.00 0.00 H new ATOM 0 HA GLU B 82 1.850 18.435 -11.392 1.00 0.00 H new ATOM 0 HB2 GLU B 82 0.755 16.889 -9.013 1.00 0.00 H new ATOM 0 HB3 GLU B 82 2.461 17.219 -9.234 1.00 0.00 H new ATOM 0 HG2 GLU B 82 1.897 19.686 -9.304 1.00 0.00 H new ATOM 0 HG3 GLU B 82 0.247 19.266 -8.886 1.00 0.00 H new ATOM 3253 N ASP B 83 3.008 16.261 -11.952 1.00 0.00 N ATOM 3254 CA ASP B 83 3.583 15.061 -12.548 1.00 0.00 C ATOM 3255 C ASP B 83 3.493 13.882 -11.585 1.00 0.00 C ATOM 3256 O ASP B 83 3.717 14.031 -10.384 1.00 0.00 O ATOM 3257 CB ASP B 83 5.042 15.308 -12.936 1.00 0.00 C ATOM 3258 CG ASP B 83 5.175 16.262 -14.107 1.00 0.00 C ATOM 3259 OD1 ASP B 83 4.144 16.814 -14.544 1.00 0.00 O ATOM 3260 OD2 ASP B 83 6.312 16.458 -14.588 1.00 0.00 O ATOM 0 H ASP B 83 3.662 17.038 -11.853 1.00 0.00 H new ATOM 0 HA ASP B 83 3.012 14.820 -13.445 1.00 0.00 H new ATOM 0 HB2 ASP B 83 5.580 15.712 -12.078 1.00 0.00 H new ATOM 0 HB3 ASP B 83 5.514 14.358 -13.189 1.00 0.00 H new ATOM 3265 N LEU B 84 3.161 12.711 -12.118 1.00 0.00 N ATOM 3266 CA LEU B 84 3.038 11.509 -11.302 1.00 0.00 C ATOM 3267 C LEU B 84 4.071 10.463 -11.706 1.00 0.00 C ATOM 3268 O LEU B 84 3.856 9.263 -11.531 1.00 0.00 O ATOM 3269 CB LEU B 84 1.632 10.924 -11.431 1.00 0.00 C ATOM 3270 CG LEU B 84 0.496 11.878 -11.057 1.00 0.00 C ATOM 3271 CD1 LEU B 84 -0.854 11.237 -11.337 1.00 0.00 C ATOM 3272 CD2 LEU B 84 0.603 12.287 -9.595 1.00 0.00 C ATOM 0 H LEU B 84 2.973 12.569 -13.110 1.00 0.00 H new ATOM 0 HA LEU B 84 3.218 11.788 -10.264 1.00 0.00 H new ATOM 0 HB2 LEU B 84 1.485 10.594 -12.460 1.00 0.00 H new ATOM 0 HB3 LEU B 84 1.564 10.038 -10.800 1.00 0.00 H new ATOM 0 HG LEU B 84 0.583 12.774 -11.671 1.00 0.00 H new ATOM 0 HD11 LEU B 84 -1.650 11.931 -11.065 1.00 0.00 H new ATOM 0 HD12 LEU B 84 -0.930 10.996 -12.397 1.00 0.00 H new ATOM 0 HD13 LEU B 84 -0.952 10.324 -10.750 1.00 0.00 H new ATOM 0 HD21 LEU B 84 -0.213 12.966 -9.346 1.00 0.00 H new ATOM 0 HD22 LEU B 84 0.543 11.400 -8.964 1.00 0.00 H new ATOM 0 HD23 LEU B 84 1.556 12.788 -9.426 1.00 0.00 H new ATOM 3284 N ASN B 85 5.193 10.925 -12.245 1.00 0.00 N ATOM 3285 CA ASN B 85 6.261 10.028 -12.671 1.00 0.00 C ATOM 3286 C ASN B 85 7.623 10.679 -12.470 1.00 0.00 C ATOM 3287 O ASN B 85 8.583 10.370 -13.176 1.00 0.00 O ATOM 3288 CB ASN B 85 6.078 9.643 -14.140 1.00 0.00 C ATOM 3289 CG ASN B 85 6.946 8.466 -14.540 1.00 0.00 C ATOM 3290 OD1 ASN B 85 7.204 7.569 -13.737 1.00 0.00 O ATOM 3291 ND2 ASN B 85 7.403 8.464 -15.787 1.00 0.00 N ATOM 0 H ASN B 85 5.387 11.915 -12.397 1.00 0.00 H new ATOM 0 HA ASN B 85 6.213 9.127 -12.060 1.00 0.00 H new ATOM 0 HB2 ASN B 85 5.032 9.398 -14.321 1.00 0.00 H new ATOM 0 HB3 ASN B 85 6.318 10.499 -14.770 1.00 0.00 H new ATOM 0 HD21 ASN B 85 7.993 7.698 -16.113 1.00 0.00 H new ATOM 0 HD22 ASN B 85 7.164 9.228 -16.419 1.00 0.00 H new ATOM 3298 N ASN B 86 7.698 11.586 -11.503 1.00 0.00 N ATOM 3299 CA ASN B 86 8.943 12.288 -11.207 1.00 0.00 C ATOM 3300 C ASN B 86 9.563 11.781 -9.908 1.00 0.00 C ATOM 3301 O ASN B 86 10.783 11.812 -9.739 1.00 0.00 O ATOM 3302 CB ASN B 86 8.693 13.794 -11.112 1.00 0.00 C ATOM 3303 CG ASN B 86 8.950 14.507 -12.426 1.00 0.00 C ATOM 3304 OD1 ASN B 86 9.512 15.602 -12.451 1.00 0.00 O ATOM 3305 ND2 ASN B 86 8.538 13.888 -13.526 1.00 0.00 N ATOM 0 H ASN B 86 6.912 11.853 -10.910 1.00 0.00 H new ATOM 0 HA ASN B 86 9.642 12.092 -12.020 1.00 0.00 H new ATOM 0 HB2 ASN B 86 7.663 13.970 -10.802 1.00 0.00 H new ATOM 0 HB3 ASN B 86 9.335 14.218 -10.340 1.00 0.00 H new ATOM 0 HD21 ASN B 86 8.683 14.320 -14.439 1.00 0.00 H new ATOM 0 HD22 ASN B 86 8.076 12.981 -13.458 1.00 0.00 H new ATOM 3312 N ASP B 87 8.719 11.317 -8.992 1.00 0.00 N ATOM 3313 CA ASP B 87 9.189 10.806 -7.709 1.00 0.00 C ATOM 3314 C ASP B 87 10.074 9.579 -7.902 1.00 0.00 C ATOM 3315 O ASP B 87 9.728 8.663 -8.648 1.00 0.00 O ATOM 3316 CB ASP B 87 8.002 10.456 -6.809 1.00 0.00 C ATOM 3317 CG ASP B 87 7.299 11.688 -6.273 1.00 0.00 C ATOM 3318 OD1 ASP B 87 6.717 12.439 -7.084 1.00 0.00 O ATOM 3319 OD2 ASP B 87 7.331 11.902 -5.043 1.00 0.00 O ATOM 0 H ASP B 87 7.707 11.284 -9.114 1.00 0.00 H new ATOM 0 HA ASP B 87 9.781 11.587 -7.231 1.00 0.00 H new ATOM 0 HB2 ASP B 87 7.290 9.850 -7.370 1.00 0.00 H new ATOM 0 HB3 ASP B 87 8.350 9.847 -5.974 1.00 0.00 H new ATOM 3324 N ARG B 88 11.217 9.569 -7.225 1.00 0.00 N ATOM 3325 CA ARG B 88 12.153 8.454 -7.321 1.00 0.00 C ATOM 3326 C ARG B 88 12.909 8.261 -6.011 1.00 0.00 C ATOM 3327 O ARG B 88 13.215 9.228 -5.312 1.00 0.00 O ATOM 3328 CB ARG B 88 13.143 8.686 -8.465 1.00 0.00 C ATOM 3329 CG ARG B 88 12.616 8.250 -9.823 1.00 0.00 C ATOM 3330 CD ARG B 88 13.591 8.598 -10.936 1.00 0.00 C ATOM 3331 NE ARG B 88 13.443 9.981 -11.381 1.00 0.00 N ATOM 3332 CZ ARG B 88 14.268 10.570 -12.239 1.00 0.00 C ATOM 3333 NH1 ARG B 88 15.294 9.900 -12.745 1.00 0.00 N ATOM 3334 NH2 ARG B 88 14.068 11.833 -12.593 1.00 0.00 N ATOM 0 H ARG B 88 11.518 10.320 -6.604 1.00 0.00 H new ATOM 0 HA ARG B 88 11.579 7.550 -7.524 1.00 0.00 H new ATOM 0 HB2 ARG B 88 13.397 9.745 -8.506 1.00 0.00 H new ATOM 0 HB3 ARG B 88 14.065 8.146 -8.252 1.00 0.00 H new ATOM 0 HG2 ARG B 88 12.437 7.175 -9.817 1.00 0.00 H new ATOM 0 HG3 ARG B 88 11.657 8.731 -10.014 1.00 0.00 H new ATOM 0 HD2 ARG B 88 14.611 8.437 -10.588 1.00 0.00 H new ATOM 0 HD3 ARG B 88 13.432 7.927 -11.780 1.00 0.00 H new ATOM 0 HE ARG B 88 12.663 10.525 -11.012 1.00 0.00 H new ATOM 0 HH11 ARG B 88 15.452 8.929 -12.476 1.00 0.00 H new ATOM 0 HH12 ARG B 88 15.926 10.356 -13.404 1.00 0.00 H new ATOM 0 HH21 ARG B 88 13.280 12.352 -12.206 1.00 0.00 H new ATOM 0 HH22 ARG B 88 14.702 12.284 -13.252 1.00 0.00 H new ATOM 3348 N ILE B 89 13.207 7.008 -5.685 1.00 0.00 N ATOM 3349 CA ILE B 89 13.928 6.685 -4.460 1.00 0.00 C ATOM 3350 C ILE B 89 15.224 5.940 -4.768 1.00 0.00 C ATOM 3351 O ILE B 89 15.201 4.824 -5.287 1.00 0.00 O ATOM 3352 CB ILE B 89 13.068 5.828 -3.511 1.00 0.00 C ATOM 3353 CG1 ILE B 89 11.763 6.552 -3.178 1.00 0.00 C ATOM 3354 CG2 ILE B 89 13.840 5.501 -2.241 1.00 0.00 C ATOM 3355 CD1 ILE B 89 10.743 5.676 -2.483 1.00 0.00 C ATOM 0 H ILE B 89 12.960 6.198 -6.254 1.00 0.00 H new ATOM 0 HA ILE B 89 14.162 7.630 -3.970 1.00 0.00 H new ATOM 0 HB ILE B 89 12.824 4.891 -4.013 1.00 0.00 H new ATOM 0 HG12 ILE B 89 11.985 7.410 -2.543 1.00 0.00 H new ATOM 0 HG13 ILE B 89 11.328 6.941 -4.099 1.00 0.00 H new ATOM 0 HG21 ILE B 89 13.217 4.895 -1.582 1.00 0.00 H new ATOM 0 HG22 ILE B 89 14.743 4.947 -2.497 1.00 0.00 H new ATOM 0 HG23 ILE B 89 14.113 6.426 -1.733 1.00 0.00 H new ATOM 0 HD11 ILE B 89 9.844 6.257 -2.278 1.00 0.00 H new ATOM 0 HD12 ILE B 89 10.491 4.832 -3.125 1.00 0.00 H new ATOM 0 HD13 ILE B 89 11.158 5.308 -1.545 1.00 0.00 H new ATOM 3367 N THR B 90 16.350 6.566 -4.445 1.00 0.00 N ATOM 3368 CA THR B 90 17.656 5.966 -4.687 1.00 0.00 C ATOM 3369 C THR B 90 18.179 5.268 -3.433 1.00 0.00 C ATOM 3370 O THR B 90 18.289 5.880 -2.370 1.00 0.00 O ATOM 3371 CB THR B 90 18.651 7.033 -5.142 1.00 0.00 C ATOM 3372 OG1 THR B 90 18.180 7.695 -6.303 1.00 0.00 O ATOM 3373 CG2 THR B 90 20.024 6.478 -5.456 1.00 0.00 C ATOM 0 H THR B 90 16.384 7.490 -4.014 1.00 0.00 H new ATOM 0 HA THR B 90 17.545 5.220 -5.474 1.00 0.00 H new ATOM 0 HB THR B 90 18.739 7.722 -4.302 1.00 0.00 H new ATOM 0 HG1 THR B 90 18.830 8.375 -6.578 1.00 0.00 H new ATOM 0 HG21 THR B 90 20.680 7.289 -5.773 1.00 0.00 H new ATOM 0 HG22 THR B 90 20.437 6.003 -4.566 1.00 0.00 H new ATOM 0 HG23 THR B 90 19.945 5.742 -6.256 1.00 0.00 H new ATOM 3381 N ILE B 91 18.502 3.985 -3.571 1.00 0.00 N ATOM 3382 CA ILE B 91 19.019 3.198 -2.459 1.00 0.00 C ATOM 3383 C ILE B 91 20.443 2.734 -2.740 1.00 0.00 C ATOM 3384 O ILE B 91 20.676 1.928 -3.642 1.00 0.00 O ATOM 3385 CB ILE B 91 18.137 1.966 -2.184 1.00 0.00 C ATOM 3386 CG1 ILE B 91 16.679 2.388 -1.995 1.00 0.00 C ATOM 3387 CG2 ILE B 91 18.641 1.215 -0.960 1.00 0.00 C ATOM 3388 CD1 ILE B 91 15.914 2.508 -3.295 1.00 0.00 C ATOM 0 H ILE B 91 18.414 3.468 -4.446 1.00 0.00 H new ATOM 0 HA ILE B 91 19.011 3.843 -1.580 1.00 0.00 H new ATOM 0 HB ILE B 91 18.194 1.298 -3.043 1.00 0.00 H new ATOM 0 HG12 ILE B 91 16.179 1.662 -1.354 1.00 0.00 H new ATOM 0 HG13 ILE B 91 16.650 3.346 -1.476 1.00 0.00 H new ATOM 0 HG21 ILE B 91 18.007 0.347 -0.779 1.00 0.00 H new ATOM 0 HG22 ILE B 91 19.666 0.886 -1.131 1.00 0.00 H new ATOM 0 HG23 ILE B 91 18.612 1.873 -0.092 1.00 0.00 H new ATOM 0 HD11 ILE B 91 14.888 2.810 -3.087 1.00 0.00 H new ATOM 0 HD12 ILE B 91 16.391 3.255 -3.930 1.00 0.00 H new ATOM 0 HD13 ILE B 91 15.912 1.545 -3.806 1.00 0.00 H new ATOM 3400 N GLU B 92 21.393 3.249 -1.968 1.00 0.00 N ATOM 3401 CA GLU B 92 22.796 2.888 -2.139 1.00 0.00 C ATOM 3402 C GLU B 92 23.294 2.054 -0.965 1.00 0.00 C ATOM 3403 O GLU B 92 22.750 2.127 0.136 1.00 0.00 O ATOM 3404 CB GLU B 92 23.651 4.146 -2.286 1.00 0.00 C ATOM 3405 CG GLU B 92 22.978 5.249 -3.088 1.00 0.00 C ATOM 3406 CD GLU B 92 23.872 6.458 -3.283 1.00 0.00 C ATOM 3407 OE1 GLU B 92 25.109 6.288 -3.284 1.00 0.00 O ATOM 3408 OE2 GLU B 92 23.335 7.575 -3.436 1.00 0.00 O ATOM 0 H GLU B 92 21.218 3.918 -1.218 1.00 0.00 H new ATOM 0 HA GLU B 92 22.882 2.289 -3.045 1.00 0.00 H new ATOM 0 HB2 GLU B 92 23.896 4.527 -1.294 1.00 0.00 H new ATOM 0 HB3 GLU B 92 24.593 3.881 -2.767 1.00 0.00 H new ATOM 0 HG2 GLU B 92 22.685 4.858 -4.062 1.00 0.00 H new ATOM 0 HG3 GLU B 92 22.064 5.556 -2.580 1.00 0.00 H new ATOM 3415 N TRP B 93 24.332 1.261 -1.209 1.00 0.00 N ATOM 3416 CA TRP B 93 24.907 0.413 -0.171 1.00 0.00 C ATOM 3417 C TRP B 93 26.370 0.102 -0.475 1.00 0.00 C ATOM 3418 O TRP B 93 26.707 -0.335 -1.576 1.00 0.00 O ATOM 3419 CB TRP B 93 24.108 -0.888 -0.043 1.00 0.00 C ATOM 3420 CG TRP B 93 24.302 -1.825 -1.198 1.00 0.00 C ATOM 3421 CD1 TRP B 93 24.980 -3.010 -1.184 1.00 0.00 C ATOM 3422 CD2 TRP B 93 23.814 -1.655 -2.532 1.00 0.00 C ATOM 3423 NE1 TRP B 93 24.944 -3.587 -2.430 1.00 0.00 N ATOM 3424 CE2 TRP B 93 24.234 -2.775 -3.276 1.00 0.00 C ATOM 3425 CE3 TRP B 93 23.063 -0.665 -3.173 1.00 0.00 C ATOM 3426 CZ2 TRP B 93 23.928 -2.931 -4.625 1.00 0.00 C ATOM 3427 CZ3 TRP B 93 22.758 -0.822 -4.513 1.00 0.00 C ATOM 3428 CH2 TRP B 93 23.190 -1.948 -5.225 1.00 0.00 C ATOM 0 H TRP B 93 24.792 1.188 -2.116 1.00 0.00 H new ATOM 0 HA TRP B 93 24.858 0.952 0.775 1.00 0.00 H new ATOM 0 HB2 TRP B 93 24.398 -1.394 0.878 1.00 0.00 H new ATOM 0 HB3 TRP B 93 23.049 -0.647 0.045 1.00 0.00 H new ATOM 0 HD1 TRP B 93 25.472 -3.432 -0.320 1.00 0.00 H new ATOM 0 HE1 TRP B 93 25.376 -4.475 -2.684 1.00 0.00 H new ATOM 0 HE3 TRP B 93 22.727 0.207 -2.631 1.00 0.00 H new ATOM 0 HZ2 TRP B 93 24.261 -3.797 -5.178 1.00 0.00 H new ATOM 0 HZ3 TRP B 93 22.178 -0.064 -5.018 1.00 0.00 H new ATOM 0 HH2 TRP B 93 22.935 -2.042 -6.270 1.00 0.00 H new ATOM 3439 N THR B 94 27.236 0.332 0.508 1.00 0.00 N ATOM 3440 CA THR B 94 28.662 0.077 0.343 1.00 0.00 C ATOM 3441 C THR B 94 29.206 -0.755 1.499 1.00 0.00 C ATOM 3442 O THR B 94 28.908 -0.489 2.664 1.00 0.00 O ATOM 3443 CB THR B 94 29.430 1.397 0.246 1.00 0.00 C ATOM 3444 OG1 THR B 94 30.826 1.163 0.212 1.00 0.00 O ATOM 3445 CG2 THR B 94 29.150 2.338 1.398 1.00 0.00 C ATOM 0 H THR B 94 26.975 0.694 1.425 1.00 0.00 H new ATOM 0 HA THR B 94 28.798 -0.485 -0.581 1.00 0.00 H new ATOM 0 HB THR B 94 29.085 1.865 -0.676 1.00 0.00 H new ATOM 0 HG1 THR B 94 31.084 0.854 -0.681 1.00 0.00 H new ATOM 0 HG21 THR B 94 29.726 3.254 1.268 1.00 0.00 H new ATOM 0 HG22 THR B 94 28.087 2.578 1.422 1.00 0.00 H new ATOM 0 HG23 THR B 94 29.435 1.861 2.335 1.00 0.00 H new ATOM 3453 N ASN B 95 30.008 -1.763 1.171 1.00 0.00 N ATOM 3454 CA ASN B 95 30.597 -2.634 2.182 1.00 0.00 C ATOM 3455 C ASN B 95 31.369 -1.820 3.216 1.00 0.00 C ATOM 3456 O ASN B 95 32.075 -0.873 2.873 1.00 0.00 O ATOM 3457 CB ASN B 95 31.525 -3.659 1.526 1.00 0.00 C ATOM 3458 CG ASN B 95 31.381 -5.041 2.132 1.00 0.00 C ATOM 3459 OD1 ASN B 95 30.980 -5.186 3.287 1.00 0.00 O ATOM 3460 ND2 ASN B 95 31.708 -6.065 1.353 1.00 0.00 N ATOM 0 H ASN B 95 30.265 -1.997 0.212 1.00 0.00 H new ATOM 0 HA ASN B 95 29.788 -3.160 2.689 1.00 0.00 H new ATOM 0 HB2 ASN B 95 31.310 -3.709 0.459 1.00 0.00 H new ATOM 0 HB3 ASN B 95 32.558 -3.327 1.627 1.00 0.00 H new ATOM 0 HD21 ASN B 95 31.631 -7.019 1.706 1.00 0.00 H new ATOM 0 HD22 ASN B 95 32.036 -5.898 0.402 1.00 0.00 H new ATOM 3467 N THR B 96 31.229 -2.195 4.483 1.00 0.00 N ATOM 3468 CA THR B 96 31.913 -1.497 5.566 1.00 0.00 C ATOM 3469 C THR B 96 33.386 -1.894 5.625 1.00 0.00 C ATOM 3470 O THR B 96 33.727 -3.067 5.468 1.00 0.00 O ATOM 3471 CB THR B 96 31.241 -1.804 6.906 1.00 0.00 C ATOM 3472 OG1 THR B 96 31.270 -3.196 7.173 1.00 0.00 O ATOM 3473 CG2 THR B 96 29.799 -1.353 6.975 1.00 0.00 C ATOM 0 H THR B 96 30.649 -2.978 4.785 1.00 0.00 H new ATOM 0 HA THR B 96 31.848 -0.427 5.370 1.00 0.00 H new ATOM 0 HB THR B 96 31.812 -1.246 7.648 1.00 0.00 H new ATOM 0 HG1 THR B 96 31.761 -3.359 8.005 1.00 0.00 H new ATOM 0 HG21 THR B 96 29.386 -1.603 7.952 1.00 0.00 H new ATOM 0 HG22 THR B 96 29.747 -0.275 6.824 1.00 0.00 H new ATOM 0 HG23 THR B 96 29.223 -1.856 6.199 1.00 0.00 H new ATOM 3481 N PRO B 97 34.284 -0.920 5.858 1.00 0.00 N ATOM 3482 CA PRO B 97 35.725 -1.180 5.944 1.00 0.00 C ATOM 3483 C PRO B 97 36.047 -2.294 6.930 1.00 0.00 C ATOM 3484 O PRO B 97 35.208 -2.681 7.742 1.00 0.00 O ATOM 3485 CB PRO B 97 36.301 0.150 6.432 1.00 0.00 C ATOM 3486 CG PRO B 97 35.311 1.176 5.999 1.00 0.00 C ATOM 3487 CD PRO B 97 33.966 0.505 6.064 1.00 0.00 C ATOM 0 HA PRO B 97 36.139 -1.511 4.991 1.00 0.00 H new ATOM 0 HB2 PRO B 97 36.426 0.153 7.515 1.00 0.00 H new ATOM 0 HB3 PRO B 97 37.282 0.339 5.997 1.00 0.00 H new ATOM 0 HG2 PRO B 97 35.344 2.049 6.650 1.00 0.00 H new ATOM 0 HG3 PRO B 97 35.526 1.524 4.988 1.00 0.00 H new ATOM 0 HD2 PRO B 97 33.479 0.673 7.025 1.00 0.00 H new ATOM 0 HD3 PRO B 97 33.292 0.881 5.295 1.00 0.00 H new ATOM 3495 N ASP B 98 37.268 -2.806 6.853 1.00 0.00 N ATOM 3496 CA ASP B 98 37.706 -3.879 7.740 1.00 0.00 C ATOM 3497 C ASP B 98 37.408 -3.536 9.197 1.00 0.00 C ATOM 3498 O ASP B 98 38.088 -2.706 9.800 1.00 0.00 O ATOM 3499 CB ASP B 98 39.203 -4.135 7.562 1.00 0.00 C ATOM 3500 CG ASP B 98 39.519 -4.835 6.256 1.00 0.00 C ATOM 3501 OD1 ASP B 98 38.570 -5.159 5.511 1.00 0.00 O ATOM 3502 OD2 ASP B 98 40.715 -5.059 5.975 1.00 0.00 O ATOM 0 H ASP B 98 37.974 -2.496 6.185 1.00 0.00 H new ATOM 0 HA ASP B 98 37.155 -4.782 7.477 1.00 0.00 H new ATOM 0 HB2 ASP B 98 39.738 -3.186 7.601 1.00 0.00 H new ATOM 0 HB3 ASP B 98 39.566 -4.740 8.392 1.00 0.00 H new ATOM 3507 N GLY B 99 36.388 -4.178 9.755 1.00 0.00 N ATOM 3508 CA GLY B 99 36.019 -3.924 11.135 1.00 0.00 C ATOM 3509 C GLY B 99 35.838 -2.446 11.422 1.00 0.00 C ATOM 3510 O GLY B 99 36.379 -1.925 12.397 1.00 0.00 O ATOM 0 H GLY B 99 35.810 -4.869 9.277 1.00 0.00 H new ATOM 0 HA2 GLY B 99 35.093 -4.452 11.364 1.00 0.00 H new ATOM 0 HA3 GLY B 99 36.787 -4.328 11.794 1.00 0.00 H new ATOM 3514 N ALA B 100 35.077 -1.770 10.567 1.00 0.00 N ATOM 3515 CA ALA B 100 34.828 -0.344 10.730 1.00 0.00 C ATOM 3516 C ALA B 100 34.220 -0.042 12.095 1.00 0.00 C ATOM 3517 O ALA B 100 34.916 0.395 13.012 1.00 0.00 O ATOM 3518 CB ALA B 100 33.915 0.161 9.622 1.00 0.00 C ATOM 0 H ALA B 100 34.623 -2.188 9.755 1.00 0.00 H new ATOM 0 HA ALA B 100 35.784 0.175 10.666 1.00 0.00 H new ATOM 0 HB1 ALA B 100 33.737 1.228 9.755 1.00 0.00 H new ATOM 0 HB2 ALA B 100 34.388 -0.010 8.655 1.00 0.00 H new ATOM 0 HB3 ALA B 100 32.966 -0.373 9.661 1.00 0.00 H new ATOM 3524 N ALA B 101 32.919 -0.277 12.223 1.00 0.00 N ATOM 3525 CA ALA B 101 32.218 -0.030 13.478 1.00 0.00 C ATOM 3526 C ALA B 101 30.741 -0.367 13.361 1.00 0.00 C ATOM 3527 O ALA B 101 30.207 -0.518 12.262 1.00 0.00 O ATOM 3528 CB ALA B 101 32.389 1.420 13.902 1.00 0.00 C ATOM 0 H ALA B 101 32.328 -0.638 11.474 1.00 0.00 H new ATOM 0 HA ALA B 101 32.655 -0.679 14.237 1.00 0.00 H new ATOM 0 HB1 ALA B 101 31.860 1.590 14.840 1.00 0.00 H new ATOM 0 HB2 ALA B 101 33.449 1.637 14.038 1.00 0.00 H new ATOM 0 HB3 ALA B 101 31.981 2.075 13.132 1.00 0.00 H new ATOM 3534 N LYS B 102 30.087 -0.479 14.508 1.00 0.00 N ATOM 3535 CA LYS B 102 28.665 -0.795 14.551 1.00 0.00 C ATOM 3536 C LYS B 102 27.832 0.478 14.589 1.00 0.00 C ATOM 3537 O LYS B 102 27.217 0.807 15.603 1.00 0.00 O ATOM 3538 CB LYS B 102 28.346 -1.670 15.764 1.00 0.00 C ATOM 3539 CG LYS B 102 28.512 -3.158 15.501 1.00 0.00 C ATOM 3540 CD LYS B 102 27.738 -3.991 16.508 1.00 0.00 C ATOM 3541 CE LYS B 102 27.613 -5.437 16.056 1.00 0.00 C ATOM 3542 NZ LYS B 102 27.888 -6.393 17.164 1.00 0.00 N ATOM 0 H LYS B 102 30.519 -0.356 15.424 1.00 0.00 H new ATOM 0 HA LYS B 102 28.413 -1.347 13.646 1.00 0.00 H new ATOM 0 HB2 LYS B 102 28.995 -1.381 16.591 1.00 0.00 H new ATOM 0 HB3 LYS B 102 27.321 -1.478 16.081 1.00 0.00 H new ATOM 0 HG2 LYS B 102 28.168 -3.391 14.493 1.00 0.00 H new ATOM 0 HG3 LYS B 102 29.569 -3.421 15.546 1.00 0.00 H new ATOM 0 HD2 LYS B 102 28.239 -3.953 17.475 1.00 0.00 H new ATOM 0 HD3 LYS B 102 26.744 -3.565 16.647 1.00 0.00 H new ATOM 0 HE2 LYS B 102 26.609 -5.610 15.668 1.00 0.00 H new ATOM 0 HE3 LYS B 102 28.307 -5.622 15.237 1.00 0.00 H new ATOM 0 HZ1 LYS B 102 27.792 -7.367 16.814 1.00 0.00 H new ATOM 0 HZ2 LYS B 102 28.855 -6.246 17.518 1.00 0.00 H new ATOM 0 HZ3 LYS B 102 27.209 -6.234 17.936 1.00 0.00 H new ATOM 3556 N GLN B 103 27.820 1.185 13.468 1.00 0.00 N ATOM 3557 CA GLN B 103 27.067 2.430 13.347 1.00 0.00 C ATOM 3558 C GLN B 103 27.403 3.138 12.038 1.00 0.00 C ATOM 3559 O GLN B 103 28.552 3.136 11.598 1.00 0.00 O ATOM 3560 CB GLN B 103 27.362 3.354 14.531 1.00 0.00 C ATOM 3561 CG GLN B 103 28.832 3.412 14.910 1.00 0.00 C ATOM 3562 CD GLN B 103 29.050 3.316 16.407 1.00 0.00 C ATOM 3563 OE1 GLN B 103 29.908 2.568 16.876 1.00 0.00 O ATOM 3564 NE2 GLN B 103 28.272 4.078 17.168 1.00 0.00 N ATOM 0 H GLN B 103 28.326 0.917 12.623 1.00 0.00 H new ATOM 0 HA GLN B 103 26.005 2.184 13.349 1.00 0.00 H new ATOM 0 HB2 GLN B 103 27.018 4.360 14.290 1.00 0.00 H new ATOM 0 HB3 GLN B 103 26.787 3.019 15.394 1.00 0.00 H new ATOM 0 HG2 GLN B 103 29.364 2.599 14.416 1.00 0.00 H new ATOM 0 HG3 GLN B 103 29.262 4.344 14.543 1.00 0.00 H new ATOM 0 HE21 GLN B 103 27.573 4.684 16.738 1.00 0.00 H new ATOM 0 HE22 GLN B 103 28.373 4.057 18.183 1.00 0.00 H new ATOM 3573 N PHE B 104 26.392 3.740 11.421 1.00 0.00 N ATOM 3574 CA PHE B 104 26.581 4.451 10.160 1.00 0.00 C ATOM 3575 C PHE B 104 27.724 5.454 10.263 1.00 0.00 C ATOM 3576 O PHE B 104 27.856 6.161 11.262 1.00 0.00 O ATOM 3577 CB PHE B 104 25.291 5.169 9.758 1.00 0.00 C ATOM 3578 CG PHE B 104 25.284 5.632 8.328 1.00 0.00 C ATOM 3579 CD1 PHE B 104 25.164 4.720 7.291 1.00 0.00 C ATOM 3580 CD2 PHE B 104 25.396 6.978 8.021 1.00 0.00 C ATOM 3581 CE1 PHE B 104 25.157 5.142 5.975 1.00 0.00 C ATOM 3582 CE2 PHE B 104 25.388 7.406 6.707 1.00 0.00 C ATOM 3583 CZ PHE B 104 25.268 6.487 5.682 1.00 0.00 C ATOM 0 H PHE B 104 25.434 3.750 11.772 1.00 0.00 H new ATOM 0 HA PHE B 104 26.836 3.718 9.395 1.00 0.00 H new ATOM 0 HB2 PHE B 104 24.446 4.499 9.919 1.00 0.00 H new ATOM 0 HB3 PHE B 104 25.145 6.029 10.411 1.00 0.00 H new ATOM 0 HD1 PHE B 104 25.075 3.667 7.514 1.00 0.00 H new ATOM 0 HD2 PHE B 104 25.491 7.701 8.818 1.00 0.00 H new ATOM 0 HE1 PHE B 104 25.065 4.421 5.177 1.00 0.00 H new ATOM 0 HE2 PHE B 104 25.476 8.459 6.481 1.00 0.00 H new ATOM 0 HZ PHE B 104 25.261 6.820 4.655 1.00 0.00 H new ATOM 3593 N ARG B 105 28.545 5.513 9.220 1.00 0.00 N ATOM 3594 CA ARG B 105 29.676 6.432 9.186 1.00 0.00 C ATOM 3595 C ARG B 105 29.631 7.297 7.930 1.00 0.00 C ATOM 3596 O ARG B 105 29.128 6.870 6.890 1.00 0.00 O ATOM 3597 CB ARG B 105 30.994 5.656 9.244 1.00 0.00 C ATOM 3598 CG ARG B 105 31.944 6.148 10.323 1.00 0.00 C ATOM 3599 CD ARG B 105 31.804 5.340 11.604 1.00 0.00 C ATOM 3600 NE ARG B 105 33.054 5.292 12.358 1.00 0.00 N ATOM 3601 CZ ARG B 105 33.163 4.759 13.571 1.00 0.00 C ATOM 3602 NH1 ARG B 105 32.102 4.232 14.164 1.00 0.00 N ATOM 3603 NH2 ARG B 105 34.335 4.754 14.191 1.00 0.00 N ATOM 0 H ARG B 105 28.448 4.934 8.386 1.00 0.00 H new ATOM 0 HA ARG B 105 29.612 7.084 10.057 1.00 0.00 H new ATOM 0 HB2 ARG B 105 30.778 4.602 9.416 1.00 0.00 H new ATOM 0 HB3 ARG B 105 31.490 5.726 8.276 1.00 0.00 H new ATOM 0 HG2 ARG B 105 32.970 6.083 9.962 1.00 0.00 H new ATOM 0 HG3 ARG B 105 31.745 7.199 10.532 1.00 0.00 H new ATOM 0 HD2 ARG B 105 31.022 5.777 12.225 1.00 0.00 H new ATOM 0 HD3 ARG B 105 31.488 4.326 11.361 1.00 0.00 H new ATOM 0 HE ARG B 105 33.890 5.690 11.930 1.00 0.00 H new ATOM 0 HH11 ARG B 105 31.199 4.235 13.690 1.00 0.00 H new ATOM 0 HH12 ARG B 105 32.188 3.824 15.095 1.00 0.00 H new ATOM 0 HH21 ARG B 105 35.154 5.159 13.737 1.00 0.00 H new ATOM 0 HH22 ARG B 105 34.418 4.345 15.122 1.00 0.00 H new ATOM 3617 N ARG B 106 30.154 8.514 8.033 1.00 0.00 N ATOM 3618 CA ARG B 106 30.167 9.439 6.904 1.00 0.00 C ATOM 3619 C ARG B 106 31.526 9.446 6.213 1.00 0.00 C ATOM 3620 O ARG B 106 31.901 10.429 5.572 1.00 0.00 O ATOM 3621 CB ARG B 106 29.813 10.851 7.372 1.00 0.00 C ATOM 3622 CG ARG B 106 29.382 11.776 6.245 1.00 0.00 C ATOM 3623 CD ARG B 106 29.821 13.207 6.504 1.00 0.00 C ATOM 3624 NE ARG B 106 29.429 14.103 5.419 1.00 0.00 N ATOM 3625 CZ ARG B 106 29.862 15.354 5.305 1.00 0.00 C ATOM 3626 NH1 ARG B 106 30.695 15.854 6.207 1.00 0.00 N ATOM 3627 NH2 ARG B 106 29.461 16.106 4.289 1.00 0.00 N ATOM 0 H ARG B 106 30.574 8.883 8.886 1.00 0.00 H new ATOM 0 HA ARG B 106 29.420 9.101 6.185 1.00 0.00 H new ATOM 0 HB2 ARG B 106 29.011 10.790 8.108 1.00 0.00 H new ATOM 0 HB3 ARG B 106 30.676 11.285 7.877 1.00 0.00 H new ATOM 0 HG2 ARG B 106 29.808 11.428 5.304 1.00 0.00 H new ATOM 0 HG3 ARG B 106 28.298 11.740 6.137 1.00 0.00 H new ATOM 0 HD2 ARG B 106 29.384 13.557 7.439 1.00 0.00 H new ATOM 0 HD3 ARG B 106 30.904 13.238 6.627 1.00 0.00 H new ATOM 0 HE ARG B 106 28.787 13.749 4.710 1.00 0.00 H new ATOM 0 HH11 ARG B 106 31.004 15.278 6.990 1.00 0.00 H new ATOM 0 HH12 ARG B 106 31.026 16.815 6.118 1.00 0.00 H new ATOM 0 HH21 ARG B 106 28.819 15.724 3.594 1.00 0.00 H new ATOM 0 HH22 ARG B 106 29.794 17.066 4.203 1.00 0.00 H new ATOM 3641 N GLU B 107 32.260 8.348 6.344 1.00 0.00 N ATOM 3642 CA GLU B 107 33.579 8.231 5.731 1.00 0.00 C ATOM 3643 C GLU B 107 33.614 7.113 4.689 1.00 0.00 C ATOM 3644 O GLU B 107 34.523 7.054 3.862 1.00 0.00 O ATOM 3645 CB GLU B 107 34.641 7.978 6.800 1.00 0.00 C ATOM 3646 CG GLU B 107 34.429 6.688 7.574 1.00 0.00 C ATOM 3647 CD GLU B 107 35.722 6.117 8.124 1.00 0.00 C ATOM 3648 OE1 GLU B 107 36.694 6.886 8.273 1.00 0.00 O ATOM 3649 OE2 GLU B 107 35.761 4.901 8.407 1.00 0.00 O ATOM 0 H GLU B 107 31.965 7.525 6.869 1.00 0.00 H new ATOM 0 HA GLU B 107 33.793 9.173 5.226 1.00 0.00 H new ATOM 0 HB2 GLU B 107 35.622 7.951 6.326 1.00 0.00 H new ATOM 0 HB3 GLU B 107 34.648 8.814 7.499 1.00 0.00 H new ATOM 0 HG2 GLU B 107 33.739 6.872 8.397 1.00 0.00 H new ATOM 0 HG3 GLU B 107 33.959 5.951 6.923 1.00 0.00 H new ATOM 3656 N TRP B 108 32.624 6.225 4.732 1.00 0.00 N ATOM 3657 CA TRP B 108 32.555 5.114 3.790 1.00 0.00 C ATOM 3658 C TRP B 108 32.244 5.601 2.376 1.00 0.00 C ATOM 3659 O TRP B 108 32.482 4.888 1.401 1.00 0.00 O ATOM 3660 CB TRP B 108 31.495 4.108 4.239 1.00 0.00 C ATOM 3661 CG TRP B 108 31.729 3.572 5.618 1.00 0.00 C ATOM 3662 CD1 TRP B 108 32.912 3.552 6.300 1.00 0.00 C ATOM 3663 CD2 TRP B 108 30.757 2.976 6.484 1.00 0.00 C ATOM 3664 NE1 TRP B 108 32.735 2.981 7.536 1.00 0.00 N ATOM 3665 CE2 TRP B 108 31.420 2.620 7.673 1.00 0.00 C ATOM 3666 CE3 TRP B 108 29.389 2.711 6.370 1.00 0.00 C ATOM 3667 CZ2 TRP B 108 30.761 2.011 8.740 1.00 0.00 C ATOM 3668 CZ3 TRP B 108 28.737 2.107 7.428 1.00 0.00 C ATOM 3669 CH2 TRP B 108 29.424 1.763 8.600 1.00 0.00 C ATOM 0 H TRP B 108 31.861 6.254 5.408 1.00 0.00 H new ATOM 0 HA TRP B 108 33.531 4.629 3.774 1.00 0.00 H new ATOM 0 HB2 TRP B 108 30.515 4.584 4.204 1.00 0.00 H new ATOM 0 HB3 TRP B 108 31.471 3.277 3.534 1.00 0.00 H new ATOM 0 HD1 TRP B 108 33.850 3.930 5.922 1.00 0.00 H new ATOM 0 HE1 TRP B 108 33.463 2.847 8.238 1.00 0.00 H new ATOM 0 HE3 TRP B 108 28.851 2.974 5.471 1.00 0.00 H new ATOM 0 HZ2 TRP B 108 31.288 1.745 9.644 1.00 0.00 H new ATOM 0 HZ3 TRP B 108 27.681 1.897 7.350 1.00 0.00 H new ATOM 0 HH2 TRP B 108 28.886 1.292 9.409 1.00 0.00 H new ATOM 3680 N PHE B 109 31.706 6.813 2.267 1.00 0.00 N ATOM 3681 CA PHE B 109 31.363 7.380 0.966 1.00 0.00 C ATOM 3682 C PHE B 109 32.289 8.537 0.604 1.00 0.00 C ATOM 3683 O PHE B 109 31.882 9.478 -0.078 1.00 0.00 O ATOM 3684 CB PHE B 109 29.909 7.857 0.965 1.00 0.00 C ATOM 3685 CG PHE B 109 28.933 6.815 1.433 1.00 0.00 C ATOM 3686 CD1 PHE B 109 28.943 6.378 2.748 1.00 0.00 C ATOM 3687 CD2 PHE B 109 28.007 6.271 0.557 1.00 0.00 C ATOM 3688 CE1 PHE B 109 28.046 5.420 3.181 1.00 0.00 C ATOM 3689 CE2 PHE B 109 27.108 5.313 0.984 1.00 0.00 C ATOM 3690 CZ PHE B 109 27.127 4.886 2.297 1.00 0.00 C ATOM 0 H PHE B 109 31.499 7.419 3.061 1.00 0.00 H new ATOM 0 HA PHE B 109 31.487 6.598 0.217 1.00 0.00 H new ATOM 0 HB2 PHE B 109 29.823 8.736 1.604 1.00 0.00 H new ATOM 0 HB3 PHE B 109 29.639 8.169 -0.044 1.00 0.00 H new ATOM 0 HD1 PHE B 109 29.660 6.791 3.442 1.00 0.00 H new ATOM 0 HD2 PHE B 109 27.988 6.600 -0.472 1.00 0.00 H new ATOM 0 HE1 PHE B 109 28.063 5.089 4.209 1.00 0.00 H new ATOM 0 HE2 PHE B 109 26.391 4.898 0.291 1.00 0.00 H new ATOM 0 HZ PHE B 109 26.426 4.137 2.633 1.00 0.00 H new ATOM 3700 N GLN B 110 33.534 8.464 1.063 1.00 0.00 N ATOM 3701 CA GLN B 110 34.512 9.511 0.783 1.00 0.00 C ATOM 3702 C GLN B 110 35.665 8.982 -0.067 1.00 0.00 C ATOM 3703 O GLN B 110 36.360 9.750 -0.732 1.00 0.00 O ATOM 3704 CB GLN B 110 35.053 10.097 2.088 1.00 0.00 C ATOM 3705 CG GLN B 110 35.906 9.123 2.884 1.00 0.00 C ATOM 3706 CD GLN B 110 37.370 9.515 2.910 1.00 0.00 C ATOM 3707 OE1 GLN B 110 38.237 8.750 2.490 1.00 0.00 O ATOM 3708 NE2 GLN B 110 37.653 10.714 3.407 1.00 0.00 N ATOM 0 H GLN B 110 33.890 7.694 1.629 1.00 0.00 H new ATOM 0 HA GLN B 110 34.006 10.295 0.220 1.00 0.00 H new ATOM 0 HB2 GLN B 110 35.645 10.984 1.861 1.00 0.00 H new ATOM 0 HB3 GLN B 110 34.216 10.422 2.705 1.00 0.00 H new ATOM 0 HG2 GLN B 110 35.530 9.068 3.906 1.00 0.00 H new ATOM 0 HG3 GLN B 110 35.808 8.126 2.455 1.00 0.00 H new ATOM 0 HE21 GLN B 110 36.902 11.316 3.744 1.00 0.00 H new ATOM 0 HE22 GLN B 110 38.621 11.032 3.451 1.00 0.00 H new ATOM 3717 N GLY B 111 35.868 7.668 -0.040 1.00 0.00 N ATOM 3718 CA GLY B 111 36.940 7.067 -0.812 1.00 0.00 C ATOM 3719 C GLY B 111 36.631 7.012 -2.296 1.00 0.00 C ATOM 3720 O GLY B 111 35.567 7.453 -2.733 1.00 0.00 O ATOM 0 H GLY B 111 35.309 7.009 0.503 1.00 0.00 H new ATOM 0 HA2 GLY B 111 37.857 7.635 -0.657 1.00 0.00 H new ATOM 0 HA3 GLY B 111 37.125 6.057 -0.446 1.00 0.00 H new ATOM 3724 N ASP B 112 37.564 6.469 -3.072 1.00 0.00 N ATOM 3725 CA ASP B 112 37.388 6.356 -4.516 1.00 0.00 C ATOM 3726 C ASP B 112 36.898 4.962 -4.893 1.00 0.00 C ATOM 3727 O ASP B 112 37.505 3.958 -4.518 1.00 0.00 O ATOM 3728 CB ASP B 112 38.702 6.659 -5.238 1.00 0.00 C ATOM 3729 CG ASP B 112 38.788 8.100 -5.701 1.00 0.00 C ATOM 3730 OD1 ASP B 112 38.014 8.936 -5.192 1.00 0.00 O ATOM 3731 OD2 ASP B 112 39.633 8.391 -6.575 1.00 0.00 O ATOM 0 H ASP B 112 38.450 6.100 -2.725 1.00 0.00 H new ATOM 0 HA ASP B 112 36.638 7.084 -4.824 1.00 0.00 H new ATOM 0 HB2 ASP B 112 39.537 6.444 -4.572 1.00 0.00 H new ATOM 0 HB3 ASP B 112 38.802 5.997 -6.098 1.00 0.00 H new ATOM 3736 N GLY B 113 35.797 4.905 -5.633 1.00 0.00 N ATOM 3737 CA GLY B 113 35.246 3.628 -6.042 1.00 0.00 C ATOM 3738 C GLY B 113 34.329 3.035 -4.992 1.00 0.00 C ATOM 3739 O GLY B 113 33.997 3.694 -4.007 1.00 0.00 O ATOM 0 H GLY B 113 35.277 5.720 -5.957 1.00 0.00 H new ATOM 0 HA2 GLY B 113 34.694 3.754 -6.974 1.00 0.00 H new ATOM 0 HA3 GLY B 113 36.060 2.932 -6.245 1.00 0.00 H new ATOM 3743 N MET B 114 33.918 1.788 -5.198 1.00 0.00 N ATOM 3744 CA MET B 114 33.035 1.114 -4.255 1.00 0.00 C ATOM 3745 C MET B 114 31.733 1.884 -4.080 1.00 0.00 C ATOM 3746 O MET B 114 31.636 3.056 -4.447 1.00 0.00 O ATOM 3747 CB MET B 114 33.730 0.952 -2.901 1.00 0.00 C ATOM 3748 CG MET B 114 34.813 -0.114 -2.896 1.00 0.00 C ATOM 3749 SD MET B 114 36.337 0.447 -2.109 1.00 0.00 S ATOM 3750 CE MET B 114 37.080 -1.118 -1.654 1.00 0.00 C ATOM 0 H MET B 114 34.182 1.226 -6.007 1.00 0.00 H new ATOM 0 HA MET B 114 32.801 0.129 -4.658 1.00 0.00 H new ATOM 0 HB2 MET B 114 34.170 1.906 -2.612 1.00 0.00 H new ATOM 0 HB3 MET B 114 32.984 0.703 -2.147 1.00 0.00 H new ATOM 0 HG2 MET B 114 34.444 -0.998 -2.376 1.00 0.00 H new ATOM 0 HG3 MET B 114 35.027 -0.413 -3.922 1.00 0.00 H new ATOM 0 HE1 MET B 114 38.032 -0.937 -1.156 1.00 0.00 H new ATOM 0 HE2 MET B 114 36.413 -1.655 -0.979 1.00 0.00 H new ATOM 0 HE3 MET B 114 37.247 -1.716 -2.550 1.00 0.00 H new ATOM 3760 N VAL B 115 30.735 1.211 -3.517 1.00 0.00 N ATOM 3761 CA VAL B 115 29.422 1.813 -3.281 1.00 0.00 C ATOM 3762 C VAL B 115 28.557 1.761 -4.535 1.00 0.00 C ATOM 3763 O VAL B 115 28.840 2.433 -5.526 1.00 0.00 O ATOM 3764 CB VAL B 115 29.534 3.279 -2.814 1.00 0.00 C ATOM 3765 CG1 VAL B 115 28.220 3.749 -2.207 1.00 0.00 C ATOM 3766 CG2 VAL B 115 30.675 3.437 -1.821 1.00 0.00 C ATOM 0 H VAL B 115 30.809 0.240 -3.213 1.00 0.00 H new ATOM 0 HA VAL B 115 28.955 1.227 -2.490 1.00 0.00 H new ATOM 0 HB VAL B 115 29.749 3.902 -3.682 1.00 0.00 H new ATOM 0 HG11 VAL B 115 28.319 4.785 -1.883 1.00 0.00 H new ATOM 0 HG12 VAL B 115 27.428 3.675 -2.952 1.00 0.00 H new ATOM 0 HG13 VAL B 115 27.971 3.123 -1.350 1.00 0.00 H new ATOM 0 HG21 VAL B 115 30.739 4.478 -1.503 1.00 0.00 H new ATOM 0 HG22 VAL B 115 30.493 2.803 -0.954 1.00 0.00 H new ATOM 0 HG23 VAL B 115 31.612 3.144 -2.294 1.00 0.00 H new ATOM 3776 N ARG B 116 27.498 0.960 -4.481 1.00 0.00 N ATOM 3777 CA ARG B 116 26.585 0.823 -5.610 1.00 0.00 C ATOM 3778 C ARG B 116 25.335 1.667 -5.393 1.00 0.00 C ATOM 3779 O ARG B 116 24.936 1.921 -4.256 1.00 0.00 O ATOM 3780 CB ARG B 116 26.200 -0.644 -5.807 1.00 0.00 C ATOM 3781 CG ARG B 116 27.346 -1.513 -6.299 1.00 0.00 C ATOM 3782 CD ARG B 116 27.224 -1.808 -7.786 1.00 0.00 C ATOM 3783 NE ARG B 116 26.856 -3.197 -8.039 1.00 0.00 N ATOM 3784 CZ ARG B 116 26.767 -3.726 -9.255 1.00 0.00 C ATOM 3785 NH1 ARG B 116 27.018 -2.982 -10.325 1.00 0.00 N ATOM 3786 NH2 ARG B 116 26.427 -4.998 -9.404 1.00 0.00 N ATOM 0 H ARG B 116 27.251 0.396 -3.668 1.00 0.00 H new ATOM 0 HA ARG B 116 27.093 1.178 -6.507 1.00 0.00 H new ATOM 0 HB2 ARG B 116 25.831 -1.044 -4.863 1.00 0.00 H new ATOM 0 HB3 ARG B 116 25.378 -0.703 -6.521 1.00 0.00 H new ATOM 0 HG2 ARG B 116 28.294 -1.012 -6.103 1.00 0.00 H new ATOM 0 HG3 ARG B 116 27.359 -2.449 -5.741 1.00 0.00 H new ATOM 0 HD2 ARG B 116 26.476 -1.149 -8.226 1.00 0.00 H new ATOM 0 HD3 ARG B 116 28.171 -1.588 -8.278 1.00 0.00 H new ATOM 0 HE ARG B 116 26.656 -3.796 -7.238 1.00 0.00 H new ATOM 0 HH11 ARG B 116 27.280 -2.002 -10.215 1.00 0.00 H new ATOM 0 HH12 ARG B 116 26.949 -3.390 -11.257 1.00 0.00 H new ATOM 0 HH21 ARG B 116 26.233 -5.573 -8.584 1.00 0.00 H new ATOM 0 HH22 ARG B 116 26.359 -5.402 -10.338 1.00 0.00 H new ATOM 3800 N ARG B 117 24.722 2.107 -6.487 1.00 0.00 N ATOM 3801 CA ARG B 117 23.520 2.929 -6.406 1.00 0.00 C ATOM 3802 C ARG B 117 22.335 2.246 -7.080 1.00 0.00 C ATOM 3803 O ARG B 117 22.475 1.631 -8.137 1.00 0.00 O ATOM 3804 CB ARG B 117 23.768 4.295 -7.049 1.00 0.00 C ATOM 3805 CG ARG B 117 22.543 5.194 -7.054 1.00 0.00 C ATOM 3806 CD ARG B 117 22.880 6.589 -7.555 1.00 0.00 C ATOM 3807 NE ARG B 117 23.755 7.304 -6.631 1.00 0.00 N ATOM 3808 CZ ARG B 117 23.889 8.626 -6.619 1.00 0.00 C ATOM 3809 NH1 ARG B 117 23.206 9.372 -7.477 1.00 0.00 N ATOM 3810 NH2 ARG B 117 24.705 9.204 -5.748 1.00 0.00 N ATOM 0 H ARG B 117 25.036 1.909 -7.437 1.00 0.00 H new ATOM 0 HA ARG B 117 23.280 3.065 -5.352 1.00 0.00 H new ATOM 0 HB2 ARG B 117 24.575 4.797 -6.516 1.00 0.00 H new ATOM 0 HB3 ARG B 117 24.106 4.149 -8.075 1.00 0.00 H new ATOM 0 HG2 ARG B 117 21.771 4.756 -7.686 1.00 0.00 H new ATOM 0 HG3 ARG B 117 22.132 5.257 -6.046 1.00 0.00 H new ATOM 0 HD2 ARG B 117 23.363 6.518 -8.530 1.00 0.00 H new ATOM 0 HD3 ARG B 117 21.960 7.156 -7.696 1.00 0.00 H new ATOM 0 HE ARG B 117 24.293 6.759 -5.957 1.00 0.00 H new ATOM 0 HH11 ARG B 117 22.576 8.931 -8.148 1.00 0.00 H new ATOM 0 HH12 ARG B 117 23.310 10.387 -7.466 1.00 0.00 H new ATOM 0 HH21 ARG B 117 25.231 8.634 -5.086 1.00 0.00 H new ATOM 0 HH22 ARG B 117 24.807 10.219 -5.740 1.00 0.00 H new ATOM 3824 N LYS B 118 21.166 2.366 -6.460 1.00 0.00 N ATOM 3825 CA LYS B 118 19.946 1.772 -6.993 1.00 0.00 C ATOM 3826 C LYS B 118 18.852 2.822 -7.125 1.00 0.00 C ATOM 3827 O LYS B 118 18.928 3.894 -6.525 1.00 0.00 O ATOM 3828 CB LYS B 118 19.470 0.631 -6.090 1.00 0.00 C ATOM 3829 CG LYS B 118 18.875 -0.540 -6.854 1.00 0.00 C ATOM 3830 CD LYS B 118 19.025 -1.843 -6.084 1.00 0.00 C ATOM 3831 CE LYS B 118 17.939 -2.839 -6.458 1.00 0.00 C ATOM 3832 NZ LYS B 118 18.344 -3.696 -7.606 1.00 0.00 N ATOM 0 H LYS B 118 21.038 2.872 -5.584 1.00 0.00 H new ATOM 0 HA LYS B 118 20.166 1.371 -7.982 1.00 0.00 H new ATOM 0 HB2 LYS B 118 20.310 0.276 -5.494 1.00 0.00 H new ATOM 0 HB3 LYS B 118 18.725 1.016 -5.394 1.00 0.00 H new ATOM 0 HG2 LYS B 118 17.819 -0.350 -7.048 1.00 0.00 H new ATOM 0 HG3 LYS B 118 19.366 -0.630 -7.823 1.00 0.00 H new ATOM 0 HD2 LYS B 118 20.004 -2.277 -6.288 1.00 0.00 H new ATOM 0 HD3 LYS B 118 18.982 -1.641 -5.014 1.00 0.00 H new ATOM 0 HE2 LYS B 118 17.711 -3.468 -5.598 1.00 0.00 H new ATOM 0 HE3 LYS B 118 17.025 -2.302 -6.711 1.00 0.00 H new ATOM 0 HZ1 LYS B 118 17.577 -4.361 -7.830 1.00 0.00 H new ATOM 0 HZ2 LYS B 118 18.537 -3.098 -8.435 1.00 0.00 H new ATOM 0 HZ3 LYS B 118 19.202 -4.228 -7.356 1.00 0.00 H new ATOM 3846 N ASN B 119 17.839 2.510 -7.920 1.00 0.00 N ATOM 3847 CA ASN B 119 16.729 3.431 -8.136 1.00 0.00 C ATOM 3848 C ASN B 119 15.389 2.727 -7.956 1.00 0.00 C ATOM 3849 O ASN B 119 15.277 1.519 -8.161 1.00 0.00 O ATOM 3850 CB ASN B 119 16.812 4.045 -9.534 1.00 0.00 C ATOM 3851 CG ASN B 119 18.217 4.489 -9.888 1.00 0.00 C ATOM 3852 OD1 ASN B 119 18.832 3.962 -10.816 1.00 0.00 O ATOM 3853 ND2 ASN B 119 18.733 5.462 -9.148 1.00 0.00 N ATOM 0 H ASN B 119 17.761 1.628 -8.426 1.00 0.00 H new ATOM 0 HA ASN B 119 16.802 4.225 -7.393 1.00 0.00 H new ATOM 0 HB2 ASN B 119 16.468 3.317 -10.269 1.00 0.00 H new ATOM 0 HB3 ASN B 119 16.138 4.900 -9.593 1.00 0.00 H new ATOM 0 HD21 ASN B 119 19.676 5.802 -9.338 1.00 0.00 H new ATOM 0 HD22 ASN B 119 18.187 5.870 -8.389 1.00 0.00 H new ATOM 3860 N LEU B 120 14.375 3.496 -7.570 1.00 0.00 N ATOM 3861 CA LEU B 120 13.038 2.953 -7.362 1.00 0.00 C ATOM 3862 C LEU B 120 11.978 3.910 -7.903 1.00 0.00 C ATOM 3863 O LEU B 120 11.574 4.849 -7.218 1.00 0.00 O ATOM 3864 CB LEU B 120 12.798 2.694 -5.871 1.00 0.00 C ATOM 3865 CG LEU B 120 12.554 1.231 -5.500 1.00 0.00 C ATOM 3866 CD1 LEU B 120 13.875 0.504 -5.299 1.00 0.00 C ATOM 3867 CD2 LEU B 120 11.696 1.138 -4.246 1.00 0.00 C ATOM 0 H LEU B 120 14.455 4.498 -7.395 1.00 0.00 H new ATOM 0 HA LEU B 120 12.963 2.010 -7.903 1.00 0.00 H new ATOM 0 HB2 LEU B 120 13.660 3.056 -5.311 1.00 0.00 H new ATOM 0 HB3 LEU B 120 11.939 3.283 -5.549 1.00 0.00 H new ATOM 0 HG LEU B 120 12.020 0.751 -6.320 1.00 0.00 H new ATOM 0 HD11 LEU B 120 13.682 -0.536 -5.036 1.00 0.00 H new ATOM 0 HD12 LEU B 120 14.456 0.543 -6.221 1.00 0.00 H new ATOM 0 HD13 LEU B 120 14.436 0.983 -4.497 1.00 0.00 H new ATOM 0 HD21 LEU B 120 11.531 0.090 -3.995 1.00 0.00 H new ATOM 0 HD22 LEU B 120 12.205 1.634 -3.419 1.00 0.00 H new ATOM 0 HD23 LEU B 120 10.737 1.624 -4.425 1.00 0.00 H new ATOM 3879 N PRO B 121 11.512 3.687 -9.143 1.00 0.00 N ATOM 3880 CA PRO B 121 10.496 4.541 -9.767 1.00 0.00 C ATOM 3881 C PRO B 121 9.175 4.512 -9.006 1.00 0.00 C ATOM 3882 O PRO B 121 8.629 3.444 -8.732 1.00 0.00 O ATOM 3883 CB PRO B 121 10.323 3.946 -11.168 1.00 0.00 C ATOM 3884 CG PRO B 121 10.845 2.554 -11.067 1.00 0.00 C ATOM 3885 CD PRO B 121 11.934 2.592 -10.034 1.00 0.00 C ATOM 0 HA PRO B 121 10.799 5.588 -9.778 1.00 0.00 H new ATOM 0 HB2 PRO B 121 9.276 3.953 -11.473 1.00 0.00 H new ATOM 0 HB3 PRO B 121 10.875 4.521 -11.911 1.00 0.00 H new ATOM 0 HG2 PRO B 121 10.055 1.862 -10.775 1.00 0.00 H new ATOM 0 HG3 PRO B 121 11.230 2.212 -12.027 1.00 0.00 H new ATOM 0 HD2 PRO B 121 12.015 1.646 -9.499 1.00 0.00 H new ATOM 0 HD3 PRO B 121 12.908 2.790 -10.482 1.00 0.00 H new ATOM 3893 N ILE B 122 8.670 5.694 -8.666 1.00 0.00 N ATOM 3894 CA ILE B 122 7.414 5.804 -7.934 1.00 0.00 C ATOM 3895 C ILE B 122 6.244 6.050 -8.878 1.00 0.00 C ATOM 3896 O ILE B 122 6.418 6.581 -9.975 1.00 0.00 O ATOM 3897 CB ILE B 122 7.468 6.940 -6.896 1.00 0.00 C ATOM 3898 CG1 ILE B 122 8.805 6.919 -6.154 1.00 0.00 C ATOM 3899 CG2 ILE B 122 6.310 6.820 -5.917 1.00 0.00 C ATOM 3900 CD1 ILE B 122 9.115 5.588 -5.506 1.00 0.00 C ATOM 0 H ILE B 122 9.111 6.587 -8.885 1.00 0.00 H new ATOM 0 HA ILE B 122 7.266 4.855 -7.418 1.00 0.00 H new ATOM 0 HB ILE B 122 7.379 7.893 -7.418 1.00 0.00 H new ATOM 0 HG12 ILE B 122 9.603 7.168 -6.853 1.00 0.00 H new ATOM 0 HG13 ILE B 122 8.798 7.694 -5.388 1.00 0.00 H new ATOM 0 HG21 ILE B 122 6.363 7.630 -5.190 1.00 0.00 H new ATOM 0 HG22 ILE B 122 5.367 6.880 -6.460 1.00 0.00 H new ATOM 0 HG23 ILE B 122 6.370 5.863 -5.399 1.00 0.00 H new ATOM 0 HD11 ILE B 122 10.078 5.646 -4.998 1.00 0.00 H new ATOM 0 HD12 ILE B 122 8.337 5.346 -4.782 1.00 0.00 H new ATOM 0 HD13 ILE B 122 9.154 4.812 -6.270 1.00 0.00 H new ATOM 3912 N GLU B 123 5.051 5.657 -8.444 1.00 0.00 N ATOM 3913 CA GLU B 123 3.846 5.831 -9.247 1.00 0.00 C ATOM 3914 C GLU B 123 2.644 6.122 -8.362 1.00 0.00 C ATOM 3915 O GLU B 123 2.678 5.898 -7.155 1.00 0.00 O ATOM 3916 CB GLU B 123 3.587 4.583 -10.091 1.00 0.00 C ATOM 3917 CG GLU B 123 4.591 4.392 -11.217 1.00 0.00 C ATOM 3918 CD GLU B 123 4.225 3.243 -12.135 1.00 0.00 C ATOM 3919 OE1 GLU B 123 3.371 2.420 -11.744 1.00 0.00 O ATOM 3920 OE2 GLU B 123 4.793 3.166 -13.244 1.00 0.00 O ATOM 0 H GLU B 123 4.893 5.215 -7.539 1.00 0.00 H new ATOM 0 HA GLU B 123 3.999 6.682 -9.911 1.00 0.00 H new ATOM 0 HB2 GLU B 123 3.608 3.706 -9.444 1.00 0.00 H new ATOM 0 HB3 GLU B 123 2.585 4.643 -10.515 1.00 0.00 H new ATOM 0 HG2 GLU B 123 4.657 5.311 -11.800 1.00 0.00 H new ATOM 0 HG3 GLU B 123 5.578 4.212 -10.792 1.00 0.00 H new ATOM 3927 N TYR B 124 1.584 6.631 -8.973 1.00 0.00 N ATOM 3928 CA TYR B 124 0.366 6.960 -8.241 1.00 0.00 C ATOM 3929 C TYR B 124 -0.846 6.268 -8.855 1.00 0.00 C ATOM 3930 O TYR B 124 -1.160 6.466 -10.028 1.00 0.00 O ATOM 3931 CB TYR B 124 0.155 8.475 -8.220 1.00 0.00 C ATOM 3932 CG TYR B 124 1.311 9.237 -7.611 1.00 0.00 C ATOM 3933 CD1 TYR B 124 2.497 9.415 -8.314 1.00 0.00 C ATOM 3934 CD2 TYR B 124 1.216 9.778 -6.335 1.00 0.00 C ATOM 3935 CE1 TYR B 124 3.556 10.109 -7.760 1.00 0.00 C ATOM 3936 CE2 TYR B 124 2.270 10.475 -5.775 1.00 0.00 C ATOM 3937 CZ TYR B 124 3.437 10.636 -6.492 1.00 0.00 C ATOM 3938 OH TYR B 124 4.491 11.328 -5.937 1.00 0.00 O ATOM 0 H TYR B 124 1.541 6.826 -9.973 1.00 0.00 H new ATOM 0 HA TYR B 124 0.478 6.603 -7.217 1.00 0.00 H new ATOM 0 HB2 TYR B 124 -0.004 8.826 -9.240 1.00 0.00 H new ATOM 0 HB3 TYR B 124 -0.753 8.700 -7.660 1.00 0.00 H new ATOM 0 HD1 TYR B 124 2.592 9.005 -9.308 1.00 0.00 H new ATOM 0 HD2 TYR B 124 0.303 9.652 -5.771 1.00 0.00 H new ATOM 0 HE1 TYR B 124 4.472 10.238 -8.318 1.00 0.00 H new ATOM 0 HE2 TYR B 124 2.180 10.891 -4.782 1.00 0.00 H new ATOM 0 HH TYR B 124 4.911 11.889 -6.622 1.00 0.00 H new ATOM 3948 N ASN B 125 -1.525 5.457 -8.050 1.00 0.00 N ATOM 3949 CA ASN B 125 -2.705 4.733 -8.508 1.00 0.00 C ATOM 3950 C ASN B 125 -3.983 5.419 -8.036 1.00 0.00 C ATOM 3951 O ASN B 125 -4.509 5.108 -6.968 1.00 0.00 O ATOM 3952 CB ASN B 125 -2.672 3.290 -8.001 1.00 0.00 C ATOM 3953 CG ASN B 125 -3.583 2.375 -8.796 1.00 0.00 C ATOM 3954 OD1 ASN B 125 -3.745 2.541 -10.006 1.00 0.00 O ATOM 3955 ND2 ASN B 125 -4.184 1.404 -8.120 1.00 0.00 N ATOM 0 H ASN B 125 -1.278 5.285 -7.076 1.00 0.00 H new ATOM 0 HA ASN B 125 -2.697 4.730 -9.598 1.00 0.00 H new ATOM 0 HB2 ASN B 125 -1.650 2.914 -8.052 1.00 0.00 H new ATOM 0 HB3 ASN B 125 -2.968 3.270 -6.952 1.00 0.00 H new ATOM 0 HD21 ASN B 125 -4.809 0.758 -8.602 1.00 0.00 H new ATOM 0 HD22 ASN B 125 -4.021 1.303 -7.118 1.00 0.00 H new ATOM 3962 N LEU B 126 -4.477 6.355 -8.840 1.00 0.00 N ATOM 3963 CA LEU B 126 -5.693 7.086 -8.506 1.00 0.00 C ATOM 3964 C LEU B 126 -6.901 6.155 -8.491 1.00 0.00 C ATOM 3965 O LEU B 126 -7.060 5.376 -9.454 1.00 0.00 O ATOM 3966 CB LEU B 126 -5.921 8.220 -9.508 1.00 0.00 C ATOM 3967 CG LEU B 126 -4.757 9.202 -9.648 1.00 0.00 C ATOM 3968 CD1 LEU B 126 -5.033 10.203 -10.759 1.00 0.00 C ATOM 3969 CD2 LEU B 126 -4.506 9.919 -8.330 1.00 0.00 C ATOM 3970 OXT LEU B 126 -7.677 6.211 -7.514 1.00 0.00 O ATOM 0 H LEU B 126 -4.053 6.625 -9.728 1.00 0.00 H new ATOM 0 HA LEU B 126 -5.571 7.509 -7.509 1.00 0.00 H new ATOM 0 HB2 LEU B 126 -6.129 7.785 -10.485 1.00 0.00 H new ATOM 0 HB3 LEU B 126 -6.811 8.775 -9.210 1.00 0.00 H new ATOM 0 HG LEU B 126 -3.861 8.640 -9.910 1.00 0.00 H new ATOM 0 HD11 LEU B 126 -4.194 10.893 -10.844 1.00 0.00 H new ATOM 0 HD12 LEU B 126 -5.163 9.673 -11.702 1.00 0.00 H new ATOM 0 HD13 LEU B 126 -5.940 10.761 -10.529 1.00 0.00 H new ATOM 0 HD21 LEU B 126 -3.675 10.614 -8.447 1.00 0.00 H new ATOM 0 HD22 LEU B 126 -5.401 10.469 -8.039 1.00 0.00 H new ATOM 0 HD23 LEU B 126 -4.262 9.188 -7.559 1.00 0.00 H new TER 3982 LEU B 126