#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ikw s ILE 2 N 0.00 -0.57 -0.04 4.25 1.01 -1.26 -4.48 121.20 120.11 1ikw s ILE 2 Ca 0.00 -0.61 -0.28 0.00 0.00 0.00 0.00 60.65 59.75 1ikw s ILE 2 Cb 0.00 -0.51 -0.14 0.00 0.01 0.00 0.00 42.46 41.82 1ikw s ILE 2 CO 0.00 -0.37 0.79 -0.24 0.00 0.00 0.00 174.94 175.12 1ikw n SER 3 N 4.43 0.08 -0.19 3.58 2.88 -0.58 -4.87 113.62 118.96 1ikw n SER 3 Ca 0.10 0.81 0.01 0.00 -1.33 0.00 0.00 58.87 58.46 1ikw n SER 3 Cb 0.49 -0.64 0.27 0.00 -0.75 0.00 0.00 64.21 63.58 1ikw n SER 3 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 1ikw h PRO 4 N 2.25 0.93 -0.54 -1.46 0.13 -1.90 -3.41 132.00 127.99 1ikw h PRO 4 Ca -0.35 -0.06 -0.06 0.00 -0.87 0.00 0.00 66.00 64.66 1ikw h PRO 4 Cb 1.00 -0.21 0.01 0.00 0.13 0.00 0.00 31.00 31.93 1ikw h PRO 4 CO 0.48 0.62 -0.04 1.51 -0.23 0.00 0.00 178.00 180.34 1ikw n ILE 5 N -4.43 0.16 -0.74 -3.56 3.06 -1.26 -4.85 119.36 107.74 1ikw n ILE 5 Ca 0.07 -0.04 -0.33 0.00 -2.50 0.00 0.00 62.75 59.96 1ikw n ILE 5 Cb 0.04 0.00 0.15 0.00 0.54 0.00 0.00 39.64 40.36 1ikw n ILE 5 CO 0.00 0.00 0.00 1.21 -2.50 0.00 0.00 176.55 175.26 1ikw n GLU 6 N 0.10 -0.90 -4.57 9.51 4.07 -1.26 -4.86 120.64 122.72 1ikw n GLU 6 Ca 0.02 -0.23 -0.32 0.00 -0.06 0.00 0.00 57.16 56.56 1ikw n GLU 6 Cb 0.02 -1.79 -0.11 0.00 -0.06 0.00 0.00 31.44 29.50 1ikw n GLU 6 CO 0.00 0.00 0.00 0.95 -0.06 0.00 0.00 177.13 178.02 1ikw s THR 7 N -2.32 3.46 -0.27 6.31 -4.23 -1.26 -4.95 115.64 112.37 1ikw s THR 7 Ca 0.56 -0.79 -0.29 0.00 -1.18 0.00 0.00 61.69 60.00 1ikw s THR 7 Cb -0.17 -2.47 0.00 0.00 1.34 0.00 0.00 72.50 71.20 1ikw s THR 7 CO 0.67 0.44 1.25 -0.69 -0.54 0.00 0.00 174.62 175.75 1ikw s VAL 8 N -0.93 4.24 -0.28 2.29 1.01 -1.26 -4.95 120.40 120.52 1ikw s VAL 8 Ca 0.15 1.43 -0.29 0.00 0.00 0.00 0.00 61.98 63.28 1ikw s VAL 8 Cb -0.11 -4.17 -0.02 0.00 0.00 0.00 0.00 36.38 32.08 1ikw s VAL 8 CO 0.05 -0.40 1.58 -2.16 0.00 0.00 0.00 175.10 174.17 1ikw s PRO 9 N 3.92 3.69 0.22 2.72 0.04 -1.26 -4.40 135.00 139.94 1ikw s PRO 9 Ca 0.54 1.45 0.08 0.00 0.04 0.00 0.00 61.00 63.11 1ikw s PRO 9 Cb -0.17 -4.04 -0.04 0.00 0.04 0.00 0.00 34.50 30.29 1ikw s PRO 9 CO 0.20 -1.41 0.05 0.54 0.04 0.00 0.00 177.00 176.41 1ikw s VAL 10 N 5.43 3.82 0.19 -0.36 0.11 -1.26 -5.12 120.40 123.21 1ikw s VAL 10 Ca 0.69 -1.57 -0.03 0.00 -2.93 0.00 0.00 61.98 58.15 1ikw s VAL 10 Cb -0.22 -2.99 -0.04 0.00 -1.53 0.00 0.00 36.38 31.60 1ikw s VAL 10 CO 0.30 -0.25 0.16 -1.59 -3.33 0.00 0.00 175.10 170.39 1ikw s LYS 11 N -3.38 1.19 0.47 1.54 -2.85 -1.26 -4.74 119.74 110.71 1ikw s LYS 11 Ca 0.30 -1.54 -0.03 0.00 -1.00 0.00 0.00 55.97 53.69 1ikw s LYS 11 Cb -0.08 0.29 -0.02 0.00 -2.06 0.00 0.00 37.83 35.96 1ikw s LYS 11 CO 0.21 -0.40 0.75 -0.51 0.10 0.00 0.00 175.35 175.49 1ikw s LEU 12 N -3.12 3.62 0.65 2.77 1.43 -1.26 -2.35 118.68 120.42 1ikw s LEU 12 Ca 0.34 0.68 -0.18 0.00 -1.03 0.00 0.00 54.13 53.95 1ikw s LEU 12 Cb 0.06 -3.58 -0.02 0.00 0.03 0.00 0.00 46.19 42.68 1ikw s LEU 12 CO 0.10 -0.65 1.09 0.29 0.23 0.00 0.00 176.35 177.41 1ikw n LYS 13 N -2.21 0.88 0.00 1.70 5.02 0.34 -4.65 118.16 119.24 1ikw n LYS 13 Ca 0.01 0.35 0.00 0.00 -2.02 0.00 0.00 58.31 56.65 1ikw n LYS 13 Cb 0.56 -2.32 0.00 0.00 -0.02 0.00 0.00 35.03 33.25 1ikw n LYS 13 CO 0.00 0.00 0.00 -2.30 -0.52 0.00 0.00 177.40 174.58 1ikw n PRO 14 N -1.57 0.00 -1.25 1.97 -0.02 -1.26 -2.88 135.00 129.99 1ikw n PRO 14 Ca 0.15 0.24 -0.22 0.00 -2.02 0.00 0.00 63.50 61.65 1ikw n PRO 14 Cb 0.48 -0.55 -0.11 0.00 -0.02 0.00 0.00 33.50 33.31 1ikw n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ikw n GLY 15 N -0.62 3.70 3.21 -1.23 0.00 -1.26 -4.87 105.19 104.11 1ikw n GLY 15 Ca 0.00 -1.50 -0.11 0.00 0.00 0.00 0.00 46.02 44.42 1ikw n GLY 15 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1ikw s MET 16 N 0.25 0.75 0.38 1.61 -1.94 -1.14 -5.18 119.30 114.04 1ikw s MET 16 Ca 0.64 -0.63 0.07 0.00 -1.71 0.00 0.00 55.69 54.07 1ikw s MET 16 Cb 0.31 0.31 -0.07 0.00 2.01 0.00 0.00 34.83 37.39 1ikw s MET 16 CO -0.08 -0.23 -0.01 0.34 -0.01 0.00 0.00 175.02 175.04 1ikw s ASP 17 N -2.17 3.67 1.03 3.03 2.15 -1.26 -4.78 116.67 118.34 1ikw s ASP 17 Ca -0.04 -1.33 -0.19 0.00 0.43 0.00 0.00 52.55 51.42 1ikw s ASP 17 Cb -0.00 -0.35 0.03 0.00 -0.30 0.00 0.00 42.92 42.29 1ikw s ASP 17 CO -0.05 -0.41 -0.38 0.61 -0.17 0.00 0.00 175.17 174.77 1ikw n GLY 18 N -0.89 -2.56 3.84 2.66 0.00 -1.26 -4.95 105.19 102.04 1ikw n GLY 18 Ca -0.05 -0.55 -0.33 0.00 0.00 0.00 0.00 46.02 45.09 1ikw n GLY 18 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ikw s PRO 19 N -2.95 4.03 -0.38 1.61 0.04 -1.26 -5.01 135.00 131.08 1ikw s PRO 19 Ca 0.43 0.68 0.09 0.00 0.04 0.00 0.00 61.00 62.24 1ikw s PRO 19 Cb -0.03 -2.51 0.29 0.00 0.04 0.00 0.00 34.50 32.29 1ikw s PRO 19 CO 0.55 0.20 0.61 1.63 0.04 0.00 0.00 177.00 180.03 1ikw n LYS 20 N -0.19 0.81 -3.77 4.56 5.02 -1.25 -1.07 118.16 122.28 1ikw n LYS 20 Ca 0.02 -3.25 -0.36 0.00 -2.02 0.00 0.00 58.31 52.71 1ikw n LYS 20 Cb 0.53 -1.40 -0.10 0.00 -0.02 0.00 0.00 35.03 34.04 1ikw n LYS 20 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1ikw s VAL 21 N -1.61 5.15 0.53 -0.18 1.01 0.11 -4.90 120.40 120.51 1ikw s VAL 21 Ca 0.37 0.10 -0.22 0.00 0.00 0.00 0.00 61.98 62.23 1ikw s VAL 21 Cb 0.24 -3.37 -0.06 0.00 0.00 0.00 0.00 36.38 33.19 1ikw s VAL 21 CO -0.10 0.39 1.32 1.17 0.00 0.00 0.00 175.10 177.88 1ikw n LYS 22 N 4.01 1.68 -2.86 2.72 3.00 -1.26 -4.38 118.16 121.07 1ikw n LYS 22 Ca -0.16 0.62 -0.43 0.00 -0.00 0.00 0.00 58.31 58.34 1ikw n LYS 22 Cb 0.52 -2.52 -0.04 0.00 0.00 0.00 0.00 35.03 32.99 1ikw n LYS 22 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.40 176.26 1ikw s GLN 23 N -2.77 3.41 0.27 1.64 2.00 -1.26 -4.79 119.66 118.16 1ikw s GLN 23 Ca 0.70 -0.10 -0.30 0.00 -2.00 0.00 0.00 55.36 53.66 1ikw s GLN 23 Cb -0.43 -3.99 -0.11 0.00 0.80 0.00 0.00 33.01 29.28 1ikw s GLN 23 CO 0.50 -1.33 1.50 -0.46 -0.50 0.00 0.00 175.29 175.00 1ikw s TRP 24 N 3.76 2.89 -0.00 1.67 -0.11 -1.26 -4.89 118.94 120.99 1ikw s TRP 24 Ca 0.32 0.95 -0.36 0.00 1.22 0.00 0.00 56.10 58.23 1ikw s TRP 24 Cb -0.12 -3.92 -0.14 0.00 -1.50 0.00 0.00 33.47 27.79 1ikw s TRP 24 CO 0.22 -3.02 1.63 -2.30 -4.62 0.00 0.00 176.95 168.86 1ikw n PRO 25 N 2.13 1.72 -3.90 5.86 -0.02 -1.26 -5.01 135.00 134.52 1ikw n PRO 25 Ca 0.07 0.62 -0.21 0.00 -2.02 0.00 0.00 63.50 61.96 1ikw n PRO 25 Cb 0.39 -2.37 -0.03 0.00 -0.02 0.00 0.00 33.50 31.48 1ikw n PRO 25 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1ikw s LEU 26 N 2.09 3.89 0.61 2.45 2.01 -1.26 -5.09 118.68 123.38 1ikw s LEU 26 Ca 0.87 -0.24 -0.13 0.00 0.01 0.00 0.00 54.13 54.64 1ikw s LEU 26 Cb -0.82 -2.49 -0.04 0.00 0.01 0.00 0.00 46.19 42.85 1ikw s LEU 26 CO 0.49 -0.19 1.03 0.42 1.01 0.00 0.00 176.35 179.11 1ikw s THR 27 N -2.15 4.33 0.16 5.49 -4.23 -1.26 -4.56 115.64 113.42 1ikw s THR 27 Ca 0.37 0.90 -0.23 0.00 -1.18 0.00 0.00 61.69 61.55 1ikw s THR 27 Cb -0.08 -3.62 0.06 0.00 1.34 0.00 0.00 72.50 70.20 1ikw s THR 27 CO 0.27 -0.85 1.60 -0.33 -0.54 0.00 0.00 174.62 174.77 1ikw h GLU 28 N -0.01 -0.23 -0.44 3.99 5.08 -1.98 0.09 114.58 121.07 1ikw h GLU 28 Ca -0.45 0.02 0.02 0.00 -1.00 0.00 0.00 59.36 57.95 1ikw h GLU 28 Cb 1.20 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 30.48 1ikw h GLU 28 CO 0.60 -0.16 0.29 1.05 -1.00 0.00 0.00 179.01 179.79 1ikw h GLU 29 N -0.24 0.50 0.08 2.33 4.11 -1.99 -0.55 114.58 118.81 1ikw h GLU 29 Ca 0.17 -0.03 -0.00 0.00 0.07 0.00 0.00 59.36 59.57 1ikw h GLU 29 Cb 0.53 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.66 1ikw h GLU 29 CO -0.52 0.33 -0.04 0.87 0.07 0.00 0.00 179.01 179.72 1ikw h LYS 30 N 0.51 -0.10 -0.81 1.06 1.57 -1.68 -1.99 116.57 115.13 1ikw h LYS 30 Ca 0.17 0.01 0.20 0.00 -1.87 0.00 0.00 60.65 59.16 1ikw h LYS 30 Cb 0.07 0.02 -0.05 0.00 0.08 0.00 0.00 32.23 32.35 1ikw h LYS 30 CO -0.04 0.37 0.56 0.82 -0.57 0.00 0.00 179.45 180.59 1ikw h ILE 31 N -0.63 0.68 -0.09 1.86 2.04 -0.55 0.35 117.51 121.16 1ikw h ILE 31 Ca -0.01 -0.08 -0.05 0.00 1.00 0.00 0.00 64.86 65.72 1ikw h ILE 31 Cb 0.52 0.42 -0.00 0.00 -0.74 0.00 0.00 36.82 37.02 1ikw h ILE 31 CO 0.02 0.04 -0.14 0.50 0.00 0.00 0.00 178.15 178.57 1ikw h LYS 32 N 0.24 0.26 -0.21 2.37 3.64 -1.01 -3.03 116.57 118.83 1ikw h LYS 32 Ca 0.41 -0.16 0.03 0.00 -1.27 0.00 0.00 60.65 59.66 1ikw h LYS 32 Cb 1.22 0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 33.01 1ikw h LYS 32 CO -0.10 0.72 -0.33 0.00 -2.27 0.00 0.00 179.45 177.47 1ikw h ALA 33 N 0.54 -0.62 -0.92 5.00 0.00 0.45 -1.47 119.26 122.23 1ikw h ALA 33 Ca 0.01 -0.01 0.12 0.00 0.00 0.00 0.00 54.91 55.03 1ikw h ALA 33 Cb 0.70 0.93 -0.09 0.00 0.00 0.00 0.00 17.79 19.34 1ikw h ALA 33 CO 0.03 -0.77 0.55 -0.07 0.00 0.00 0.00 179.25 178.99 1ikw h LEU 34 N -0.27 0.77 -0.34 0.00 3.38 -1.45 -1.13 115.31 116.27 1ikw h LEU 34 Ca 0.04 0.06 0.02 0.00 0.09 0.00 0.00 57.88 58.09 1ikw h LEU 34 Cb 0.37 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 1ikw h LEU 34 CO -0.34 0.39 0.17 0.58 0.09 0.00 0.00 178.44 179.34 1ikw h VAL 35 N 0.85 0.99 -0.22 1.22 2.07 -1.29 0.24 116.25 120.11 1ikw h VAL 35 Ca 0.47 -0.12 -0.08 0.00 0.82 0.00 0.00 66.70 67.79 1ikw h VAL 35 Cb 0.52 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 30.87 1ikw h VAL 35 CO -0.29 0.07 -0.22 -0.33 0.02 0.00 0.00 177.57 176.82 1ikw h GLU 36 N 0.36 0.40 0.08 1.57 5.08 -0.45 -2.67 114.58 118.94 1ikw h GLU 36 Ca 0.14 -0.13 -0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1ikw h GLU 36 Cb 0.05 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.27 1ikw h GLU 36 CO -0.10 0.60 -0.04 0.82 -1.00 0.00 0.00 179.01 179.30 1ikw h ILE 37 N 0.36 0.81 0.12 3.13 2.04 -0.75 -3.18 117.51 120.04 1ikw h ILE 37 Ca 0.06 -1.41 0.02 0.00 1.00 0.00 0.00 64.86 64.53 1ikw h ILE 37 Cb 0.58 1.46 -0.04 0.00 -0.74 0.00 0.00 36.82 38.08 1ikw h ILE 37 CO 0.04 0.25 -0.35 0.00 0.00 0.00 0.00 178.15 178.08 1ikw h THR 39 N -0.59 0.02 0.48 0.00 2.02 -1.64 0.69 112.91 113.90 1ikw h THR 39 Ca 0.03 -0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.19 1ikw h THR 39 Cb 0.62 0.01 -0.01 0.00 -1.74 0.00 0.00 68.15 67.03 1ikw h THR 39 CO -0.21 0.00 -0.32 -0.08 0.37 0.00 0.00 175.52 175.29 1ikw h GLU 40 N 0.01 -0.74 0.09 6.66 4.57 -0.88 -1.70 114.58 122.59 1ikw h GLU 40 Ca 0.62 0.05 0.02 0.00 -1.18 0.00 0.00 59.36 58.87 1ikw h GLU 40 Cb 1.31 0.17 -0.04 0.00 -0.16 0.00 0.00 28.75 30.03 1ikw h GLU 40 CO -0.91 -0.49 -0.29 0.52 -1.18 0.00 0.00 179.01 176.66 1ikw h MET 41 N -0.77 -0.47 -0.88 1.92 2.86 0.14 -2.59 114.93 115.15 1ikw h MET 41 Ca -0.05 0.03 0.23 0.00 -2.06 0.00 0.00 59.70 57.85 1ikw h MET 41 Cb 0.64 0.11 -0.16 0.00 0.06 0.00 0.00 31.60 32.25 1ikw h MET 41 CO 0.04 -0.31 0.06 1.49 1.06 0.00 0.00 176.91 179.25 1ikw h GLU 42 N -0.49 0.08 0.00 1.72 4.81 0.15 1.04 114.58 121.89 1ikw h GLU 42 Ca 0.04 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 1ikw h GLU 42 Cb 0.53 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.90 1ikw h GLU 42 CO -0.19 0.06 0.00 1.17 -0.73 0.00 0.00 179.01 179.31 1ikw n LYS 43 N -5.38 0.04 -0.01 1.92 4.81 -0.66 -2.09 118.16 116.79 1ikw n LYS 43 Ca 0.19 0.49 0.03 0.00 -0.87 0.00 0.00 58.31 58.15 1ikw n LYS 43 Cb 0.64 -1.61 0.03 0.00 0.02 0.00 0.00 35.03 34.11 1ikw n LYS 43 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 1ikw n GLU 44 N -1.69 0.13 0.00 1.64 1.02 0.36 -5.01 120.64 117.09 1ikw n GLU 44 Ca 0.00 -0.96 0.00 0.00 -0.02 0.00 0.00 57.16 56.18 1ikw n GLU 44 Cb 0.04 -1.13 0.00 0.00 -0.02 0.00 0.00 31.44 30.33 1ikw n GLU 44 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ikw n GLY 45 N 0.36 3.13 0.52 0.62 0.00 -0.89 -4.89 105.19 104.04 1ikw n GLY 45 Ca 0.04 0.00 0.35 0.00 0.00 0.00 0.00 46.02 46.41 1ikw n GLY 45 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ikw h LYS 46 N 1.17 0.05 -4.12 1.61 1.79 -1.83 -3.41 116.57 111.84 1ikw h LYS 46 Ca 0.00 -0.00 -0.15 0.00 -2.18 0.00 0.00 60.65 58.32 1ikw h LYS 46 Cb 0.00 -0.01 -0.13 0.00 -1.58 0.00 0.00 32.23 30.51 1ikw h LYS 46 CO 0.00 0.03 -0.39 0.96 -1.08 0.00 0.00 179.45 178.97 1ikw s ILE 47 N -5.02 0.02 0.03 1.86 -4.36 -1.26 -2.29 121.20 110.18 1ikw s ILE 47 Ca -0.06 -1.66 -0.12 0.00 -0.26 0.00 0.00 60.65 58.55 1ikw s ILE 47 Cb 0.24 -2.22 0.01 0.00 1.25 0.00 0.00 42.46 41.74 1ikw s ILE 47 CO 0.81 -0.10 0.26 -0.44 0.24 0.00 0.00 174.94 175.71 1ikw s SER 48 N -3.06 -0.09 0.42 4.36 0.01 -1.00 -4.36 113.70 109.99 1ikw s SER 48 Ca 0.28 -0.18 -0.23 0.00 1.31 0.00 0.00 55.95 57.13 1ikw s SER 48 Cb 0.04 0.32 -0.09 0.00 0.21 0.00 0.00 66.02 66.50 1ikw s SER 48 CO 0.08 -0.55 1.06 -0.54 0.41 0.00 0.00 173.24 173.70 1ikw s LYS 49 N -2.20 4.05 -0.01 12.44 1.02 -1.26 -1.98 119.74 131.79 1ikw s LYS 49 Ca -0.08 1.52 -0.12 0.00 0.02 0.00 0.00 55.97 57.32 1ikw s LYS 49 Cb -0.02 -2.44 0.01 0.00 -0.52 0.00 0.00 37.83 34.86 1ikw s LYS 49 CO -0.01 -0.24 0.24 0.96 -0.92 0.00 0.00 175.35 175.37 1ikw s ILE 50 N -1.70 0.07 0.06 2.17 -4.36 -1.11 -4.91 121.20 111.42 1ikw s ILE 50 Ca 0.60 -0.55 -0.01 0.00 -0.26 0.00 0.00 60.65 60.43 1ikw s ILE 50 Cb -0.22 -0.53 0.01 0.00 1.25 0.00 0.00 42.46 42.97 1ikw s ILE 50 CO 0.27 -0.30 0.08 0.61 0.24 0.00 0.00 174.94 175.84 1ikw n GLY 51 N 1.39 -0.68 0.65 6.27 0.00 -1.26 -4.39 105.19 107.17 1ikw n GLY 51 Ca -0.22 -1.74 0.00 0.00 0.00 0.00 0.00 46.02 44.06 1ikw n GLY 51 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1ikw n PRO 52 N -1.17 0.94 0.09 1.61 -0.02 -1.26 -3.61 135.00 131.57 1ikw n PRO 52 Ca 0.01 0.00 0.06 0.00 -2.02 0.00 0.00 63.50 61.55 1ikw n PRO 52 Cb 0.04 -1.34 -0.02 0.00 -0.02 0.00 0.00 33.50 32.16 1ikw n PRO 52 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1ikw h GLU 53 N 0.08 0.00 -6.09 -0.52 3.07 -2.02 -3.43 114.58 105.67 1ikw h GLU 53 Ca 0.00 0.00 -0.57 0.00 -0.50 0.00 0.00 59.36 58.29 1ikw h GLU 53 Cb 0.61 0.00 -0.10 0.00 -0.84 0.00 0.00 28.75 28.42 1ikw h GLU 53 CO 0.00 0.15 0.86 1.21 -1.40 0.00 0.00 179.01 179.83 1ikw s ASN 54 N -5.66 6.21 0.00 1.42 3.84 -1.24 -4.88 114.94 114.63 1ikw s ASN 54 Ca -0.01 -0.52 0.08 0.00 0.21 0.00 0.00 52.86 52.63 1ikw s ASN 54 Cb 0.09 -2.51 0.50 0.00 -0.55 0.00 0.00 41.25 38.77 1ikw s ASN 54 CO 0.79 -1.63 1.01 -2.65 -2.79 0.00 0.00 177.10 171.83 1ikw n PRO 55 N 8.63 0.61 -3.75 0.43 -0.02 -1.26 -4.72 135.00 134.93 1ikw n PRO 55 Ca 0.02 0.00 -0.37 0.00 -2.02 0.00 0.00 63.50 61.13 1ikw n PRO 55 Cb 0.48 -1.21 -0.11 0.00 -0.02 0.00 0.00 33.50 32.63 1ikw n PRO 55 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 1ikw s TYR 56 N -2.00 3.17 -0.03 6.00 2.02 -1.26 -4.70 117.35 120.54 1ikw s TYR 56 Ca 0.12 -0.13 0.00 0.00 -0.37 0.00 0.00 57.07 56.70 1ikw s TYR 56 Cb 0.06 -2.25 0.03 0.00 -0.40 0.00 0.00 41.96 39.39 1ikw s TYR 56 CO 0.10 -0.18 -0.00 1.21 -1.57 0.00 0.00 175.55 175.10 1ikw s ASN 57 N 1.40 0.51 -0.13 2.29 2.47 -0.23 -4.35 114.94 116.91 1ikw s ASN 57 Ca 0.06 -0.04 0.03 0.00 0.42 0.00 0.00 52.86 53.33 1ikw s ASN 57 Cb -0.15 -0.25 0.01 0.00 -1.45 0.00 0.00 41.25 39.41 1ikw s ASN 57 CO 0.05 -0.10 -0.21 -0.89 -3.72 0.00 0.00 177.10 172.24 1ikw s THR 58 N 1.02 1.92 0.46 -5.21 2.01 0.65 -0.72 115.64 115.78 1ikw s THR 58 Ca -0.10 -0.90 -0.20 0.00 0.31 0.00 0.00 61.69 60.80 1ikw s THR 58 Cb -0.14 -1.70 -0.13 0.00 0.01 0.00 0.00 72.50 70.54 1ikw s THR 58 CO -0.02 0.52 0.27 -2.65 -0.69 0.00 0.00 174.62 172.06 1ikw n PRO 59 N 4.01 0.28 -4.14 4.92 -0.02 -1.26 -4.34 135.00 134.45 1ikw n PRO 59 Ca -0.20 0.10 -0.16 0.00 -2.02 0.00 0.00 63.50 61.23 1ikw n PRO 59 Cb 0.52 -1.29 -0.12 0.00 -0.02 0.00 0.00 33.50 32.58 1ikw n PRO 59 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1ikw s VAL 60 N -1.69 0.84 0.30 -1.45 1.01 -1.26 -3.47 120.40 114.67 1ikw s VAL 60 Ca 0.62 -1.14 0.03 0.00 0.00 0.00 0.00 61.98 61.49 1ikw s VAL 60 Cb -0.56 -0.84 -0.03 0.00 0.00 0.00 0.00 36.38 34.96 1ikw s VAL 60 CO 0.60 -0.26 0.28 -0.36 0.00 0.00 0.00 175.10 175.36 1ikw s PHE 61 N -1.24 1.49 -0.21 5.22 0.08 0.47 -4.98 117.98 118.80 1ikw s PHE 61 Ca -0.05 -1.52 -0.16 0.00 0.12 0.00 0.00 56.93 55.32 1ikw s PHE 61 Cb -0.10 -0.56 0.06 0.00 -0.57 0.00 0.00 43.02 41.85 1ikw s PHE 61 CO 0.01 -0.87 0.54 0.00 -0.10 0.00 0.00 175.22 174.81 1ikw s ALA 62 N -3.55 -1.38 0.01 5.36 0.00 -1.26 -1.69 121.76 119.24 1ikw s ALA 62 Ca 0.38 1.73 -0.01 0.00 0.00 0.00 0.00 51.96 54.06 1ikw s ALA 62 Cb 0.03 -1.02 -0.01 0.00 0.00 0.00 0.00 23.12 22.11 1ikw s ALA 62 CO 0.23 -0.29 0.01 -1.50 0.00 0.00 0.00 175.76 174.21 1ikw s ILE 63 N 0.89 0.08 0.49 0.00 2.07 -0.95 -4.90 121.20 118.88 1ikw s ILE 63 Ca -0.05 -0.66 -0.23 0.00 -1.41 0.00 0.00 60.65 58.30 1ikw s ILE 63 Cb -0.05 -0.24 -0.07 0.00 0.13 0.00 0.00 42.46 42.23 1ikw s ILE 63 CO -0.08 -0.36 1.31 -0.54 -1.91 0.00 0.00 174.94 173.36 1ikw s LYS 64 N -1.10 3.51 0.00 3.50 1.02 -1.26 -0.65 119.74 124.76 1ikw s LYS 64 Ca -0.12 2.13 0.00 0.00 0.02 0.00 0.00 55.97 58.00 1ikw s LYS 64 Cb -0.07 -2.43 0.00 0.00 -0.52 0.00 0.00 37.83 34.81 1ikw s LYS 64 CO -0.00 -0.86 0.00 1.17 -0.92 0.00 0.00 175.35 174.74 1ikw n LYS 65 N -0.59 1.18 -1.69 1.68 3.00 0.25 -4.79 118.16 117.22 1ikw n LYS 65 Ca 0.08 0.00 -0.50 0.00 -0.00 0.00 0.00 58.31 57.88 1ikw n LYS 65 Cb 0.45 0.00 -0.05 0.00 0.00 0.00 0.00 35.03 35.43 1ikw n LYS 65 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 1ikw n LYS 66 N -0.18 1.94 -0.97 1.64 4.76 -1.26 -0.80 118.16 123.29 1ikw n LYS 66 Ca 0.00 0.71 0.00 0.00 -2.87 0.00 0.00 58.31 56.15 1ikw n LYS 66 Cb 0.00 -2.51 0.00 0.00 -1.84 0.00 0.00 35.03 30.68 1ikw n LYS 66 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 1ikw n ASP 67 N 6.11 -4.19 -1.12 4.39 4.64 -1.26 -2.97 116.55 122.14 1ikw n ASP 67 Ca 0.23 0.00 -0.10 0.00 -1.38 0.00 0.00 54.79 53.55 1ikw n ASP 67 Cb 0.26 -2.15 -0.00 0.00 -1.04 0.00 0.00 41.12 38.18 1ikw n ASP 67 CO 0.00 0.00 0.00 -1.20 -0.82 0.00 0.00 177.20 175.18 1ikw n SER 68 N -0.51 -3.27 0.10 1.67 7.64 0.02 -4.97 113.62 114.30 1ikw n SER 68 Ca 0.00 -0.02 -0.11 0.00 1.01 0.00 0.00 58.87 59.75 1ikw n SER 68 Cb 0.26 -2.50 -0.07 0.00 -1.01 0.00 0.00 64.21 60.88 1ikw n SER 68 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 1ikw h THR 69 N -0.07 0.61 -3.86 0.44 1.35 -1.70 -3.46 112.91 106.23 1ikw h THR 69 Ca -0.23 -0.92 -0.32 0.00 -0.55 0.00 0.00 66.41 64.40 1ikw h THR 69 Cb 1.17 1.00 -0.19 0.00 -1.73 0.00 0.00 68.15 68.40 1ikw h THR 69 CO 0.26 0.15 -0.74 -0.54 -0.25 0.00 0.00 175.52 174.40 1ikw s LYS 70 N -3.58 0.74 0.78 4.72 1.02 -1.26 -4.96 119.74 117.19 1ikw s LYS 70 Ca -0.12 -1.00 -0.11 0.00 0.02 0.00 0.00 55.97 54.76 1ikw s LYS 70 Cb 0.01 -0.50 0.07 0.00 -0.52 0.00 0.00 37.83 36.88 1ikw s LYS 70 CO 0.43 0.09 1.14 -1.58 -0.92 0.00 0.00 175.35 174.51 1ikw s TRP 71 N -1.93 3.02 0.05 3.18 0.52 -1.26 0.88 118.94 123.39 1ikw s TRP 71 Ca -0.01 0.77 0.03 0.00 0.02 0.00 0.00 56.10 56.91 1ikw s TRP 71 Cb -0.06 -3.38 -0.02 0.00 -1.15 0.00 0.00 33.47 28.86 1ikw s TRP 71 CO 0.00 -1.62 -0.09 0.50 0.02 0.00 0.00 176.95 175.76 1ikw s ARG 72 N -5.49 0.61 -0.40 4.98 3.52 0.18 -4.74 118.95 117.60 1ikw s ARG 72 Ca 0.61 -0.79 -0.13 0.00 -0.13 0.00 0.00 55.73 55.29 1ikw s ARG 72 Cb -0.11 -0.45 0.03 0.00 -1.56 0.00 0.00 34.95 32.87 1ikw s ARG 72 CO 0.49 0.09 0.28 0.21 -0.81 0.00 0.00 175.30 175.56 1ikw s LYS 73 N -1.55 2.90 -0.28 5.12 2.20 -1.26 -2.24 119.74 124.62 1ikw s LYS 73 Ca -0.07 -1.09 -0.14 0.00 -0.36 0.00 0.00 55.97 54.31 1ikw s LYS 73 Cb -0.10 -3.90 -0.04 0.00 -1.51 0.00 0.00 37.83 32.28 1ikw s LYS 73 CO 0.01 -0.77 0.31 -1.17 -0.36 0.00 0.00 175.35 173.37 1ikw s LEU 74 N 1.62 4.08 -0.66 5.43 2.96 -0.68 -4.96 118.68 126.46 1ikw s LEU 74 Ca 0.04 0.13 -0.02 0.00 -0.22 0.00 0.00 54.13 54.05 1ikw s LEU 74 Cb -0.20 -2.31 0.17 0.00 0.50 0.00 0.00 46.19 44.35 1ikw s LEU 74 CO 0.08 -0.16 0.48 -0.69 -1.32 0.00 0.00 176.35 174.75 1ikw s VAL 75 N 1.96 3.76 -0.76 1.68 1.01 -1.26 -0.40 120.40 126.39 1ikw s VAL 75 Ca 0.12 -3.12 -0.24 0.00 0.00 0.00 0.00 61.98 58.74 1ikw s VAL 75 Cb -0.16 -3.44 -0.16 0.00 0.00 0.00 0.00 36.38 32.62 1ikw s VAL 75 CO 0.10 -0.91 2.43 -0.67 0.00 0.00 0.00 175.10 176.05 1ikw n ASP 76 N 3.29 1.19 -0.28 3.32 2.03 -1.23 -4.75 116.55 120.11 1ikw n ASP 76 Ca 0.10 -0.71 0.14 0.00 0.52 0.00 0.00 54.79 54.84 1ikw n ASP 76 Cb 0.37 -1.32 0.54 0.00 -0.72 0.00 0.00 41.12 39.99 1ikw n ASP 76 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 1ikw n PHE 77 N 14.21 0.00 -0.21 -0.67 3.01 -1.26 -4.45 117.46 128.09 1ikw n PHE 77 Ca 0.50 0.00 0.19 0.00 1.01 0.00 0.00 57.45 59.15 1ikw n PHE 77 Cb 0.35 -0.08 0.32 0.00 -0.01 0.00 0.00 39.48 40.07 1ikw n PHE 77 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 1ikw n ARG 78 N -0.43 -0.02 0.04 -1.08 1.74 -1.26 -0.11 116.66 115.53 1ikw n ARG 78 Ca 0.16 0.66 -0.19 0.00 -0.77 0.00 0.00 57.85 57.71 1ikw n ARG 78 Cb 0.31 -1.25 -0.14 0.00 -1.02 0.00 0.00 32.46 30.36 1ikw n ARG 78 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 1ikw h GLU 79 N 0.00 0.30 -0.79 5.56 4.39 -1.99 -2.93 114.58 119.11 1ikw h GLU 79 Ca 0.44 -0.48 -0.04 0.00 0.34 0.00 0.00 59.36 59.61 1ikw h GLU 79 Cb 1.31 0.17 -0.04 0.00 -0.10 0.00 0.00 28.75 30.09 1ikw h GLU 79 CO -0.30 1.21 0.32 1.25 -1.16 0.00 0.00 179.01 180.33 1ikw h LEU 80 N -0.36 1.09 -0.21 1.33 5.85 -0.86 -2.94 115.31 119.21 1ikw h LEU 80 Ca -0.13 -0.17 0.01 0.00 0.84 0.00 0.00 57.88 58.43 1ikw h LEU 80 Cb 1.57 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 42.30 1ikw h LEU 80 CO 0.14 0.97 0.12 0.78 -0.34 0.00 0.00 178.44 180.11 1ikw h ASN 81 N 1.15 0.19 0.39 1.25 2.35 -1.37 0.40 115.58 119.94 1ikw h ASN 81 Ca 0.27 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.02 1ikw h ASN 81 Cb 0.21 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.54 1ikw h ASN 81 CO -0.02 0.14 0.00 0.11 -1.65 0.00 0.00 177.43 176.01 1ikw h LYS 82 N 0.25 0.00 0.00 0.81 1.57 -1.41 -1.43 116.57 116.35 1ikw h LYS 82 Ca 0.08 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 1ikw h LYS 82 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1ikw h LYS 82 CO -0.04 0.00 -0.84 0.54 -0.57 0.00 0.00 179.45 178.54 1ikw n ARG 83 N -2.38 1.25 -2.82 3.15 1.74 -0.47 -4.92 116.66 112.21 1ikw n ARG 83 Ca 0.00 -0.00 -0.35 0.00 -0.77 0.00 0.00 57.85 56.73 1ikw n ARG 83 Cb 0.14 -1.32 -0.07 0.00 -1.02 0.00 0.00 32.46 30.19 1ikw n ARG 83 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1ikw s THR 84 N -2.65 4.31 0.82 0.55 2.01 0.13 -0.50 115.64 120.31 1ikw s THR 84 Ca 0.06 1.65 -0.11 0.00 0.31 0.00 0.00 61.69 63.60 1ikw s THR 84 Cb 0.13 -3.84 0.09 0.00 0.01 0.00 0.00 72.50 68.89 1ikw s THR 84 CO 0.71 -0.03 1.13 0.00 -0.69 0.00 0.00 174.62 175.74 1ikw s GLN 85 N -2.49 1.72 0.44 4.92 -2.07 -0.99 -4.45 119.66 116.74 1ikw s GLN 85 Ca 0.54 1.41 -0.18 0.00 -1.82 0.00 0.00 55.36 55.31 1ikw s GLN 85 Cb -0.15 -1.82 -0.09 0.00 -1.09 0.00 0.00 33.01 29.86 1ikw s GLN 85 CO 0.19 -2.08 0.91 -0.51 -1.32 0.00 0.00 175.29 172.49 1ikw s ASP 86 N -2.90 6.79 0.28 12.60 1.01 -1.26 -4.90 116.67 128.29 1ikw s ASP 86 Ca 0.65 1.54 0.00 0.00 0.71 0.00 0.00 52.55 55.46 1ikw s ASP 86 Cb -0.21 -2.49 -0.00 0.00 1.01 0.00 0.00 42.92 41.23 1ikw s ASP 86 CO 0.55 -0.41 0.02 0.49 0.21 0.00 0.00 175.17 176.03 1ikw n PHE 87 N -0.93 0.56 -3.19 4.23 3.72 -1.26 -5.11 117.46 115.48 1ikw n PHE 87 Ca 0.06 -1.46 -0.39 0.00 -0.05 0.00 0.00 57.45 55.61 1ikw n PHE 87 Cb 0.54 -0.16 -0.05 0.00 -0.94 0.00 0.00 39.48 38.87 1ikw n PHE 87 CO 0.00 0.00 0.00 -0.46 -0.05 0.00 0.00 176.76 176.25 1ikw s TRP 88 N -2.13 3.65 0.16 1.38 -0.00 -1.26 -5.01 118.94 115.74 1ikw s TRP 88 Ca 0.02 1.18 -0.34 0.00 -0.00 0.00 0.00 56.10 56.97 1ikw s TRP 88 Cb 0.00 -2.63 -0.15 0.00 -0.00 0.00 0.00 33.47 30.69 1ikw s TRP 88 CO 0.02 0.30 1.38 0.39 -0.00 0.00 0.00 176.95 179.03 1ikw n GLU 89 N 2.97 1.64 0.17 5.86 -0.58 -1.26 -4.84 120.64 124.60 1ikw n GLU 89 Ca -0.06 0.59 -0.10 0.00 -0.42 0.00 0.00 57.16 57.17 1ikw n GLU 89 Cb 0.51 -2.24 -0.05 0.00 -0.57 0.00 0.00 31.44 29.09 1ikw n GLU 89 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 1ikw h VAL 90 N 3.18 0.00 -3.23 2.62 2.07 -1.94 -3.42 116.25 115.53 1ikw h VAL 90 Ca -0.45 0.00 -0.54 0.00 0.82 0.00 0.00 66.70 66.53 1ikw h VAL 90 Cb 1.30 0.00 -0.36 0.00 -1.52 0.00 0.00 31.29 30.71 1ikw h VAL 90 CO 0.78 0.00 -0.81 -1.10 0.02 0.00 0.00 177.57 176.46 1ikw s GLN 91 N -4.48 1.76 0.00 1.57 -0.21 -1.26 -4.98 119.66 112.06 1ikw s GLN 91 Ca -0.09 -0.37 0.19 0.00 0.02 0.00 0.00 55.36 55.11 1ikw s GLN 91 Cb 0.02 -1.66 0.52 0.00 1.00 0.00 0.00 33.01 32.89 1ikw s GLN 91 CO 0.31 -0.18 1.44 1.28 -2.12 0.00 0.00 175.29 176.02 1ikw n LEU 92 N 4.60 3.02 -3.61 2.90 4.32 -1.26 -4.94 117.00 122.02 1ikw n LEU 92 Ca -0.16 -1.45 -0.02 0.00 -0.02 0.00 0.00 56.01 54.36 1ikw n LEU 92 Cb 0.50 -0.33 -0.02 0.00 -1.62 0.00 0.00 43.42 41.96 1ikw n LEU 92 CO 0.20 0.72 1.06 -0.83 -1.22 0.00 0.00 177.39 177.32 1ikw s GLY 93 N -1.15 -0.32 -0.05 -0.72 0.00 -1.26 -5.16 107.32 98.66 1ikw s GLY 93 Ca 0.38 1.40 0.06 0.00 0.00 0.00 0.00 44.72 46.56 1ikw s GLY 93 CO 0.27 0.43 -0.24 -0.42 0.00 0.00 0.00 173.10 173.15 1ikw s ILE 94 N -2.34 1.92 0.48 0.90 -1.09 -1.26 -5.10 121.20 114.71 1ikw s ILE 94 Ca 0.11 -1.00 -0.24 0.00 -2.23 0.00 0.00 60.65 57.29 1ikw s ILE 94 Cb 0.01 -1.62 -0.08 0.00 -1.58 0.00 0.00 42.46 39.19 1ikw s ILE 94 CO -0.04 0.54 1.40 -2.65 -1.23 0.00 0.00 174.94 172.96 1ikw n PRO 95 N 2.88 2.08 -3.64 2.79 -0.02 -1.26 -4.95 135.00 132.88 1ikw n PRO 95 Ca -0.17 0.75 -0.37 0.00 -2.02 0.00 0.00 63.50 61.69 1ikw n PRO 95 Cb 0.52 -2.60 -0.07 0.00 -0.02 0.00 0.00 33.50 31.33 1ikw n PRO 95 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 1ikw s HIS 96 N -1.22 3.56 0.22 6.00 2.46 -1.26 -4.97 115.29 120.08 1ikw s HIS 96 Ca 0.64 0.66 -0.16 0.00 0.47 0.00 0.00 55.06 56.66 1ikw s HIS 96 Cb -0.44 -2.20 0.23 0.00 -0.13 0.00 0.00 32.58 30.04 1ikw s HIS 96 CO 0.55 0.49 1.58 -1.35 -2.47 0.00 0.00 174.74 173.54 1ikw h PRO 97 N 5.69 -0.06 0.00 2.88 0.11 -1.98 0.55 132.00 139.19 1ikw h PRO 97 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1ikw h PRO 97 Cb 1.20 0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1ikw h PRO 97 CO 0.67 -0.04 0.29 0.00 -0.21 0.00 0.00 178.00 178.70 1ikw h ALA 98 N 1.39 1.19 -0.01 -0.75 0.00 -1.86 0.35 119.26 119.57 1ikw h ALA 98 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.23 1ikw h ALA 98 Cb 0.58 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1ikw h ALA 98 CO -0.80 -0.19 -0.52 0.41 0.00 0.00 0.00 179.25 178.14 1ikw n GLY 99 N -1.27 -0.39 3.81 0.00 0.00 0.18 -3.71 105.19 103.81 1ikw n GLY 99 Ca -0.01 -0.56 -0.34 0.00 0.00 0.00 0.00 46.02 45.11 1ikw n GLY 99 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ikw s LEU 100 N -2.61 4.00 0.30 0.99 1.43 0.12 -4.75 118.68 118.16 1ikw s LEU 100 Ca 0.17 1.80 -0.13 0.00 -1.03 0.00 0.00 54.13 54.94 1ikw s LEU 100 Cb 0.18 -4.43 -0.08 0.00 0.03 0.00 0.00 46.19 41.89 1ikw s LEU 100 CO 0.62 -0.42 0.69 -0.54 0.23 0.00 0.00 176.35 176.93 1ikw s LYS 101 N -2.95 3.93 0.26 1.70 3.01 -1.26 -1.43 119.74 123.00 1ikw s LYS 101 Ca 0.61 0.55 -0.30 0.00 -1.01 0.00 0.00 55.97 55.82 1ikw s LYS 101 Cb -0.13 -2.48 -0.10 0.00 -1.01 0.00 0.00 37.83 34.10 1ikw s LYS 101 CO 0.18 0.18 1.39 0.21 0.51 0.00 0.00 175.35 177.82 1ikw s LYS 102 N -3.00 4.30 0.18 1.68 2.20 -1.26 -4.90 119.74 118.95 1ikw s LYS 102 Ca 0.52 2.25 0.10 0.00 -0.36 0.00 0.00 55.97 58.48 1ikw s LYS 102 Cb -0.10 -3.11 -0.04 0.00 -1.51 0.00 0.00 37.83 33.06 1ikw s LYS 102 CO 0.19 -0.34 -0.21 0.15 -0.36 0.00 0.00 175.35 174.78 1ikw s LYS 103 N -0.70 1.39 -0.16 4.03 -0.14 -1.16 -4.99 119.74 118.00 1ikw s LYS 103 Ca 0.56 -1.47 -0.26 0.00 -1.36 0.00 0.00 55.97 53.45 1ikw s LYS 103 Cb -0.41 -1.57 -0.23 0.00 -1.68 0.00 0.00 37.83 33.95 1ikw s LYS 103 CO 0.45 0.33 0.55 -0.22 -0.76 0.00 0.00 175.35 175.70 1ikw h LYS 104 N 3.21 0.00 -5.37 1.68 3.64 -1.64 -3.41 116.57 114.67 1ikw h LYS 104 Ca -0.44 0.00 -0.53 0.00 -1.27 0.00 0.00 60.65 58.41 1ikw h LYS 104 Cb 1.21 0.00 -0.30 0.00 -0.41 0.00 0.00 32.23 32.73 1ikw h LYS 104 CO 0.50 0.96 -0.83 -1.12 -2.27 0.00 0.00 179.45 176.69 1ikw s SER 105 N -6.41 1.96 -0.08 4.20 0.01 -0.78 -4.93 113.70 107.66 1ikw s SER 105 Ca -0.22 -0.31 -0.06 0.00 1.31 0.00 0.00 55.95 56.67 1ikw s SER 105 Cb 0.00 -0.37 0.03 0.00 0.21 0.00 0.00 66.02 65.89 1ikw s SER 105 CO 0.63 0.17 0.20 0.54 0.41 0.00 0.00 173.24 175.20 1ikw s VAL 106 N -0.17 -0.02 0.04 3.43 0.11 -1.26 -1.15 120.40 121.38 1ikw s VAL 106 Ca 0.02 0.06 0.01 0.00 -2.93 0.00 0.00 61.98 59.13 1ikw s VAL 106 Cb -0.09 -0.30 -0.03 0.00 -1.53 0.00 0.00 36.38 34.44 1ikw s VAL 106 CO 0.01 0.02 -0.05 0.42 -3.33 0.00 0.00 175.10 172.17 1ikw s THR 107 N 0.54 0.29 -0.15 5.04 -4.23 -0.45 -4.41 115.64 112.27 1ikw s THR 107 Ca -0.04 -1.17 0.00 0.00 -1.18 0.00 0.00 61.69 59.30 1ikw s THR 107 Cb -0.05 -0.66 -0.00 0.00 1.34 0.00 0.00 72.50 73.13 1ikw s THR 107 CO -0.03 -0.57 -0.15 0.54 -0.54 0.00 0.00 174.62 173.87 1ikw s VAL 108 N -1.98 2.75 -0.03 2.29 0.11 -1.23 -1.19 120.40 121.12 1ikw s VAL 108 Ca -0.09 -0.75 -0.00 0.00 -2.93 0.00 0.00 61.98 58.21 1ikw s VAL 108 Cb -0.06 -2.16 -0.04 0.00 -1.53 0.00 0.00 36.38 32.59 1ikw s VAL 108 CO -0.02 0.51 0.02 -0.76 -3.33 0.00 0.00 175.10 171.53 1ikw s LEU 109 N 0.73 3.65 -0.16 2.54 1.43 0.25 -4.21 118.68 122.91 1ikw s LEU 109 Ca -0.06 0.09 0.00 0.00 -1.03 0.00 0.00 54.13 53.13 1ikw s LEU 109 Cb -0.15 -2.02 0.03 0.00 0.03 0.00 0.00 46.19 44.08 1ikw s LEU 109 CO 0.01 0.31 -0.11 1.51 0.23 0.00 0.00 176.35 178.31 1ikw s ASP 110 N -1.38 2.88 -0.15 2.29 -4.77 -1.26 0.15 116.67 114.43 1ikw s ASP 110 Ca 0.18 -0.62 -0.29 0.00 -3.30 0.00 0.00 52.55 48.52 1ikw s ASP 110 Cb -0.12 -1.11 -0.06 0.00 -1.09 0.00 0.00 42.92 40.54 1ikw s ASP 110 CO 0.08 -0.11 2.11 -0.69 0.70 0.00 0.00 175.17 177.26 1ikw s VAL 111 N 1.51 3.05 0.13 2.11 1.01 -0.64 -4.38 120.40 123.20 1ikw s VAL 111 Ca 0.02 0.05 -0.30 0.00 0.00 0.00 0.00 61.98 61.76 1ikw s VAL 111 Cb -0.14 -3.06 -0.06 0.00 0.00 0.00 0.00 36.38 33.12 1ikw s VAL 111 CO -0.09 -0.03 0.96 -0.83 0.00 0.00 0.00 175.10 175.11 1ikw s GLY 112 N 6.96 3.02 -1.50 4.51 0.00 -0.93 -3.74 107.32 115.64 1ikw s GLY 112 Ca 0.95 0.59 -0.13 0.00 0.00 0.00 0.00 44.72 46.14 1ikw s GLY 112 CO 0.37 1.42 0.85 1.22 0.00 0.00 0.00 173.10 176.97 1ikw n ASP 113 N 2.57 -4.65 -0.08 1.64 8.00 -1.26 -4.54 116.55 118.23 1ikw n ASP 113 Ca 0.02 -0.68 -0.04 0.00 0.71 0.00 0.00 54.79 54.80 1ikw n ASP 113 Cb 0.49 -3.74 -0.03 0.00 -0.02 0.00 0.00 41.12 37.82 1ikw n ASP 113 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ikw h ALA 114 N 0.97 -0.32 -1.01 2.24 0.00 -1.96 -0.98 119.26 118.20 1ikw h ALA 114 Ca -0.55 0.02 0.24 0.00 0.00 0.00 0.00 54.91 54.61 1ikw h ALA 114 Cb 1.36 0.96 -0.10 0.00 0.00 0.00 0.00 17.79 20.01 1ikw h ALA 114 CO 0.65 -0.42 0.64 1.88 0.00 0.00 0.00 179.25 181.99 1ikw h TYR 115 N -0.07 0.80 -0.00 0.00 0.99 -1.91 0.30 116.97 117.08 1ikw h TYR 115 Ca 0.03 0.03 0.00 0.00 2.00 0.00 0.00 58.73 60.79 1ikw h TYR 115 Cb 0.15 -0.23 0.00 0.00 1.00 0.00 0.00 36.73 37.65 1ikw h TYR 115 CO -0.78 0.11 -0.07 1.19 -0.00 0.00 0.00 178.16 178.61 1ikw n PHE 116 N -4.69 0.00 0.54 4.88 0.99 -0.71 -1.57 117.46 116.90 1ikw n PHE 116 Ca 0.24 0.00 0.12 0.00 -0.00 0.00 0.00 57.45 57.81 1ikw n PHE 116 Cb 0.77 -0.25 0.23 0.00 -1.00 0.00 0.00 39.48 39.23 1ikw n PHE 116 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.76 177.19 1ikw n SER 117 N -1.16 3.12 -4.25 4.37 7.64 0.10 -4.78 113.62 118.67 1ikw n SER 117 Ca 0.14 -1.95 -0.32 0.00 1.01 0.00 0.00 58.87 57.75 1ikw n SER 117 Cb 0.26 -0.20 -0.17 0.00 -1.01 0.00 0.00 64.21 63.10 1ikw n SER 117 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1ikw s VAL 118 N -1.60 2.18 -0.47 0.44 1.01 -1.19 -1.52 120.40 119.25 1ikw s VAL 118 Ca 0.37 -0.99 -0.28 0.00 0.00 0.00 0.00 61.98 61.07 1ikw s VAL 118 Cb 0.22 -1.83 0.01 0.00 0.00 0.00 0.00 36.38 34.78 1ikw s VAL 118 CO 0.31 0.56 1.48 -2.16 0.00 0.00 0.00 175.10 175.29 1ikw s PRO 119 N 0.20 3.39 0.48 2.72 0.04 -1.26 -1.85 135.00 138.73 1ikw s PRO 119 Ca -0.14 0.81 -0.24 0.00 0.04 0.00 0.00 61.00 61.47 1ikw s PRO 119 Cb -0.17 -4.10 -0.07 0.00 0.04 0.00 0.00 34.50 30.20 1ikw s PRO 119 CO 0.07 -1.80 1.40 -1.17 0.04 0.00 0.00 177.00 175.54 1ikw s LEU 120 N 6.04 4.03 0.11 -3.56 2.96 -0.97 -4.68 118.68 122.61 1ikw s LEU 120 Ca 0.61 2.85 -0.32 0.00 -0.22 0.00 0.00 54.13 57.05 1ikw s LEU 120 Cb -0.14 -4.04 -0.12 0.00 0.50 0.00 0.00 46.19 42.40 1ikw s LEU 120 CO 0.30 -1.28 1.78 -0.67 -1.32 0.00 0.00 176.35 175.16 1ikw n ASP 121 N -0.44 3.78 -0.03 3.68 2.03 -1.26 -4.76 116.55 119.55 1ikw n ASP 121 Ca 0.07 1.01 -0.14 0.00 0.52 0.00 0.00 54.79 56.25 1ikw n ASP 121 Cb 0.43 -1.50 -0.09 0.00 -0.72 0.00 0.00 41.12 39.24 1ikw n ASP 121 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 1ikw h GLU 122 N 7.95 -0.49 0.00 -0.67 5.08 -1.94 -0.20 114.58 124.30 1ikw h GLU 122 Ca -0.46 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 57.93 1ikw h GLU 122 Cb 1.23 0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.59 1ikw h GLU 122 CO 0.94 -0.32 0.15 -0.25 -1.00 0.00 0.00 179.01 178.52 1ikw n ASP 123 N -5.16 0.00 -0.04 1.42 10.43 -1.26 -1.11 116.55 120.84 1ikw n ASP 123 Ca -0.05 0.17 -0.01 0.00 2.57 0.00 0.00 54.79 57.47 1ikw n ASP 123 Cb 0.34 -0.17 -0.10 0.00 1.84 0.00 0.00 41.12 43.03 1ikw n ASP 123 CO 0.00 0.00 0.00 0.33 -1.07 0.00 0.00 177.20 176.46 1ikw n PHE 124 N -1.08 0.00 -0.30 1.24 -0.00 -0.11 -4.66 117.46 112.55 1ikw n PHE 124 Ca 0.00 0.00 0.13 0.00 -0.00 0.00 0.00 57.45 57.58 1ikw n PHE 124 Cb 0.15 -0.47 0.29 0.00 -0.00 0.00 0.00 39.48 39.45 1ikw n PHE 124 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1ikw h ARG 125 N 0.00 0.17 -0.47 -4.13 3.08 -0.89 -0.67 114.38 111.46 1ikw h ARG 125 Ca -0.19 -0.01 0.14 0.00 0.07 0.00 0.00 59.98 59.99 1ikw h ARG 125 Cb 1.25 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 31.24 1ikw h ARG 125 CO 0.01 0.11 0.79 1.57 -1.07 0.00 0.00 179.97 181.38 1ikw h LYS 126 N 0.17 0.00 0.00 0.04 2.10 -1.83 0.10 116.57 117.16 1ikw h LYS 126 Ca 0.56 0.00 -0.15 0.00 -2.00 0.00 0.00 60.65 59.06 1ikw h LYS 126 Cb 1.14 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.45 1ikw h LYS 126 CO -0.69 0.00 -1.15 1.88 -2.00 0.00 0.00 179.45 177.49 1ikw h TYR 127 N 0.00 0.00 -0.40 0.07 0.05 -1.46 -3.35 116.97 111.87 1ikw h TYR 127 Ca 0.22 0.00 -0.27 0.00 0.05 0.00 0.00 58.73 58.73 1ikw h TYR 127 Cb 1.80 0.00 -0.12 0.00 1.01 0.00 0.00 36.73 39.43 1ikw h TYR 127 CO 0.00 0.55 0.35 0.25 -1.05 0.00 0.00 178.16 178.26 1ikw n THR 128 N -2.98 2.61 -3.45 -2.88 -2.24 0.36 -4.60 114.28 101.09 1ikw n THR 128 Ca -0.06 -1.43 -0.37 0.00 -2.27 0.00 0.00 64.05 59.91 1ikw n THR 128 Cb 0.81 -1.32 -0.06 0.00 -2.10 0.00 0.00 70.33 67.65 1ikw n THR 128 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ikw s ALA 129 N -1.53 3.57 0.01 6.98 0.00 -1.26 -3.53 121.76 126.01 1ikw s ALA 129 Ca 0.26 -0.31 0.00 0.00 0.00 0.00 0.00 51.96 51.91 1ikw s ALA 129 Cb 0.21 -2.48 -0.00 0.00 0.00 0.00 0.00 23.12 20.85 1ikw s ALA 129 CO -0.00 0.14 0.00 1.97 0.00 0.00 0.00 175.76 177.87 1ikw n PHE 130 N 3.25 0.00 -3.74 0.00 -1.74 -0.57 -0.25 117.46 114.41 1ikw n PHE 130 Ca -0.11 -0.06 -0.13 0.00 -0.56 0.00 0.00 57.45 56.60 1ikw n PHE 130 Cb 0.52 -0.00 -0.11 0.00 1.52 0.00 0.00 39.48 41.41 1ikw n PHE 130 CO 0.00 0.00 0.00 0.95 -0.56 0.00 0.00 176.76 177.15 1ikw s THR 131 N -1.54 -0.00 -0.51 1.97 -4.23 -1.26 -2.89 115.64 107.18 1ikw s THR 131 Ca 0.00 0.01 -0.17 0.00 -1.18 0.00 0.00 61.69 60.36 1ikw s THR 131 Cb 0.00 -0.52 0.08 0.00 1.34 0.00 0.00 72.50 73.40 1ikw s THR 131 CO 0.00 0.01 0.50 -0.63 -0.54 0.00 0.00 174.62 173.96 1ikw s ILE 132 N 0.34 5.10 1.03 2.99 1.01 0.18 -4.75 121.20 127.11 1ikw s ILE 132 Ca -0.01 -1.02 -0.16 0.00 0.00 0.00 0.00 60.65 59.46 1ikw s ILE 132 Cb -0.03 -4.25 0.06 0.00 0.01 0.00 0.00 42.46 38.25 1ikw s ILE 132 CO -0.01 -0.75 0.15 -2.65 0.00 0.00 0.00 174.94 171.68 1ikw n PRO 133 N 5.56 -0.90 -4.15 2.79 -0.02 -1.26 -1.03 135.00 135.98 1ikw n PRO 133 Ca -0.11 -0.24 -0.32 0.00 -2.02 0.00 0.00 63.50 60.81 1ikw n PRO 133 Cb 0.43 -1.74 -0.08 0.00 -0.02 0.00 0.00 33.50 32.09 1ikw n PRO 133 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1ikw s SER 134 N -1.89 5.41 -0.40 2.55 1.04 -1.26 -4.78 113.70 114.37 1ikw s SER 134 Ca 0.56 0.04 -0.44 0.00 0.48 0.00 0.00 55.95 56.59 1ikw s SER 134 Cb -0.16 -1.47 -0.18 0.00 0.10 0.00 0.00 66.02 64.31 1ikw s SER 134 CO 0.67 0.25 1.67 -0.38 0.98 0.00 0.00 173.24 176.43 1ikw n ILE 135 N 1.07 0.14 -3.78 -1.02 5.41 -1.26 -0.91 119.36 119.02 1ikw n ILE 135 Ca -0.12 -0.03 -0.31 0.00 1.00 0.00 0.00 62.75 63.29 1ikw n ILE 135 Cb 0.52 -0.83 0.03 0.00 -0.71 0.00 0.00 39.64 38.65 1ikw n ILE 135 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 1ikw n ASN 136 N 4.68 -3.99 -1.14 4.38 5.03 -1.26 -3.97 115.26 118.99 1ikw n ASN 136 Ca 0.29 -1.04 -0.03 0.00 0.87 0.00 0.00 54.58 54.67 1ikw n ASN 136 Cb 0.03 -3.17 0.00 0.00 -1.02 0.00 0.00 39.78 35.62 1ikw n ASN 136 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 1ikw n ASN 137 N -2.71 -0.78 0.01 6.41 3.02 -0.08 -4.91 115.26 116.21 1ikw n ASN 137 Ca -0.15 0.01 0.00 0.00 -0.03 0.00 0.00 54.58 54.41 1ikw n ASN 137 Cb 0.61 -0.21 0.00 0.00 -0.61 0.00 0.00 39.78 39.57 1ikw n ASN 137 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1ikw n GLU 138 N 0.24 0.00 -0.18 3.52 1.02 -1.25 -5.03 120.64 118.95 1ikw n GLU 138 Ca -0.01 0.00 -0.23 0.00 -0.02 0.00 0.00 57.16 56.90 1ikw n GLU 138 Cb 0.08 -0.01 0.22 0.00 -0.02 0.00 0.00 31.44 31.71 1ikw n GLU 138 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 1ikw n THR 139 N -2.56 0.00 0.10 2.62 -1.04 -1.26 -4.94 114.28 107.20 1ikw n THR 139 Ca 0.00 0.00 -0.16 0.00 -2.04 0.00 0.00 64.05 61.85 1ikw n THR 139 Cb 0.00 -0.74 -0.12 0.00 -1.82 0.00 0.00 70.33 67.65 1ikw n THR 139 CO 0.00 0.00 0.00 1.55 -0.64 0.00 0.00 175.07 175.98 1ikw h PRO 140 N 0.00 0.32 0.00 -2.82 0.13 -1.98 -3.43 132.00 124.21 1ikw h PRO 140 Ca -0.29 -0.50 0.00 0.00 -0.87 0.00 0.00 66.00 64.34 1ikw h PRO 140 Cb 0.99 0.18 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1ikw h PRO 140 CO 0.18 1.22 0.00 0.41 -0.23 0.00 0.00 178.00 179.58 1ikw n GLY 141 N 1.44 1.73 3.82 1.56 0.00 -1.26 -4.80 105.19 107.68 1ikw n GLY 141 Ca -0.09 -1.86 -0.38 0.00 0.00 0.00 0.00 46.02 43.70 1ikw n GLY 141 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ikw s ILE 142 N -2.96 4.81 -0.08 -0.61 -1.09 -0.20 -4.84 121.20 116.24 1ikw s ILE 142 Ca 0.00 1.05 0.03 0.00 -2.23 0.00 0.00 60.65 59.50 1ikw s ILE 142 Cb 0.00 -3.82 -0.02 0.00 -1.58 0.00 0.00 42.46 37.04 1ikw s ILE 142 CO 0.00 0.47 -0.18 -0.13 -1.23 0.00 0.00 174.94 173.87 1ikw s ARG 143 N -1.35 2.79 0.05 2.79 0.52 -1.26 0.49 118.95 122.97 1ikw s ARG 143 Ca 0.31 -0.77 0.00 0.00 -0.52 0.00 0.00 55.73 54.75 1ikw s ARG 143 Cb -0.18 -2.37 -0.03 0.00 0.52 0.00 0.00 34.95 32.89 1ikw s ARG 143 CO 0.18 0.41 -0.05 0.71 0.02 0.00 0.00 175.30 176.58 1ikw s TYR 144 N -0.20 0.54 0.22 -0.53 2.02 -1.14 -2.73 117.35 115.53 1ikw s TYR 144 Ca -0.01 -0.78 0.03 0.00 -0.37 0.00 0.00 57.07 55.94 1ikw s TYR 144 Cb -0.13 -0.36 -0.05 0.00 -0.40 0.00 0.00 41.96 41.02 1ikw s TYR 144 CO 0.03 -0.23 -0.01 1.14 -1.57 0.00 0.00 175.55 174.92 1ikw s GLN 145 N -2.77 1.29 0.12 -0.62 -2.07 -0.84 -1.52 119.66 113.25 1ikw s GLN 145 Ca -0.02 -1.64 -0.07 0.00 -1.82 0.00 0.00 55.36 51.81 1ikw s GLN 145 Cb -0.01 -0.56 -0.06 0.00 -1.09 0.00 0.00 33.01 31.30 1ikw s GLN 145 CO -0.05 -0.09 0.40 0.71 -1.32 0.00 0.00 175.29 174.94 1ikw s TYR 146 N -3.46 3.51 0.00 9.60 2.02 -1.23 -2.37 117.35 125.42 1ikw s TYR 146 Ca 0.27 0.67 0.00 0.00 -0.37 0.00 0.00 57.07 57.65 1ikw s TYR 146 Cb 0.06 -2.09 0.00 0.00 -0.40 0.00 0.00 41.96 39.53 1ikw s TYR 146 CO 0.08 0.45 0.47 0.09 -1.57 0.00 0.00 175.55 175.06 1ikw n ASN 147 N 0.39 0.86 -3.30 2.29 3.02 -0.97 -4.58 115.26 112.98 1ikw n ASN 147 Ca -0.04 -1.16 -0.20 0.00 -0.03 0.00 0.00 54.58 53.15 1ikw n ASN 147 Cb 0.52 0.00 -0.08 0.00 -0.61 0.00 0.00 39.78 39.61 1ikw n ASN 147 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 1ikw n VAL 148 N -0.08 0.00 -2.22 2.41 0.24 -1.25 -2.30 118.33 115.12 1ikw n VAL 148 Ca 0.00 -2.49 -0.43 0.00 -2.04 0.00 0.00 64.34 59.39 1ikw n VAL 148 Cb 0.13 1.23 -0.02 0.00 -1.47 0.00 0.00 33.84 33.71 1ikw n VAL 148 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1ikw s LEU 149 N 0.00 4.09 0.08 1.34 1.43 -0.61 -4.35 118.68 120.66 1ikw s LEU 149 Ca 0.40 1.74 -0.31 0.00 -1.03 0.00 0.00 54.13 54.94 1ikw s LEU 149 Cb 0.02 -3.54 -0.07 0.00 0.03 0.00 0.00 46.19 42.63 1ikw s LEU 149 CO 0.29 -1.00 1.43 -2.84 0.23 0.00 0.00 176.35 174.46 1ikw s PRO 150 N 4.09 4.29 0.00 1.29 0.02 -1.26 -4.08 135.00 139.34 1ikw s PRO 150 Ca 0.65 2.09 0.00 0.00 0.02 0.00 0.00 61.00 63.76 1ikw s PRO 150 Cb -0.25 -3.37 0.00 0.00 0.02 0.00 0.00 34.50 30.90 1ikw s PRO 150 CO 0.24 -0.52 0.52 0.00 -0.33 0.00 0.00 177.00 176.91 1ikw n GLN 151 N 4.54 0.00 0.00 5.54 -0.00 -1.26 -2.16 117.38 124.04 1ikw n GLN 151 Ca 0.13 0.04 0.00 0.00 -0.00 0.00 0.00 57.00 57.16 1ikw n GLN 151 Cb 0.42 -1.50 0.00 0.00 -0.00 0.00 0.00 30.24 29.16 1ikw n GLN 151 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1ikw n GLY 152 N -1.02 0.25 3.84 2.61 0.00 -1.26 -5.08 105.19 104.52 1ikw n GLY 152 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 1ikw n GLY 152 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1ikw s TRP 153 N -0.44 3.55 0.30 1.61 -0.00 -0.92 -4.79 118.94 118.26 1ikw s TRP 153 Ca 0.00 1.19 0.04 0.00 -0.00 0.00 0.00 56.10 57.34 1ikw s TRP 153 Cb 0.00 -2.49 0.80 0.00 -0.00 0.00 0.00 33.47 31.78 1ikw s TRP 153 CO 0.00 0.30 1.62 -0.22 -0.00 0.00 0.00 176.95 178.65 1ikw h LYS 154 N 3.08 0.13 -0.65 5.86 3.64 -1.93 -2.60 116.57 124.10 1ikw h LYS 154 Ca -0.48 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.89 1ikw h LYS 154 Cb 1.19 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.98 1ikw h LYS 154 CO 0.66 0.09 0.00 0.41 -2.27 0.00 0.00 179.45 178.34 1ikw n GLY 155 N -1.39 2.67 0.16 5.01 0.00 -1.26 -4.48 105.19 105.90 1ikw n GLY 155 Ca 0.24 -0.84 -0.16 0.00 0.00 0.00 0.00 46.02 45.26 1ikw n GLY 155 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1ikw h SER 156 N 4.01 0.59 0.00 1.61 0.02 -1.76 -2.21 113.55 115.82 1ikw h SER 156 Ca 0.00 -0.67 0.00 0.00 -0.84 0.00 0.00 61.79 60.28 1ikw h SER 156 Cb 1.49 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 63.84 1ikw h SER 156 CO 0.26 1.17 -0.03 -0.65 -1.14 0.00 0.00 176.83 176.44 1ikw h PRO 157 N 0.06 -0.05 0.79 3.45 0.11 -1.79 0.68 132.00 135.25 1ikw h PRO 157 Ca -0.04 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.03 1ikw h PRO 157 Cb 1.18 0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 1ikw h PRO 157 CO 0.11 -0.03 -0.48 0.00 -0.21 0.00 0.00 178.00 177.38 1ikw h ALA 158 N 0.94 -1.28 -0.74 -0.75 0.00 -1.83 -2.64 119.26 112.97 1ikw h ALA 158 Ca 0.01 -0.25 0.04 0.00 0.00 0.00 0.00 54.91 54.71 1ikw h ALA 158 Cb 0.06 0.60 -0.04 0.00 0.00 0.00 0.00 17.79 18.41 1ikw h ALA 158 CO -0.03 -1.23 0.49 0.82 0.00 0.00 0.00 179.25 179.31 1ikw h ILE 159 N -1.19 1.11 -0.11 0.00 2.04 -1.39 -1.66 117.51 116.31 1ikw h ILE 159 Ca -0.11 -0.31 -0.01 0.00 1.00 0.00 0.00 64.86 65.43 1ikw h ILE 159 Cb 0.95 0.13 -0.00 0.00 -0.74 0.00 0.00 36.82 37.16 1ikw h ILE 159 CO 0.11 0.16 0.01 0.15 0.00 0.00 0.00 178.15 178.59 1ikw h PHE 160 N 0.90 0.20 -0.28 1.37 3.57 -0.83 -1.91 116.94 119.96 1ikw h PHE 160 Ca 0.30 -0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.70 1ikw h PHE 160 Cb 0.07 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 38.74 1ikw h PHE 160 CO -0.00 0.40 -0.13 1.96 -2.23 0.00 0.00 178.31 178.32 1ikw h GLN 161 N -0.06 0.47 -0.54 1.11 1.08 -1.33 -0.67 115.11 115.17 1ikw h GLN 161 Ca 0.03 -0.13 -0.12 0.00 -1.45 0.00 0.00 58.65 56.98 1ikw h GLN 161 Cb 0.32 -0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 27.68 1ikw h GLN 161 CO 0.00 0.60 -0.12 1.03 -0.95 0.00 0.00 178.83 179.39 1ikw h SER 162 N 0.44 1.04 -0.19 1.46 0.87 -1.21 -2.53 113.55 113.43 1ikw h SER 162 Ca 0.08 -0.36 -0.05 0.00 -1.23 0.00 0.00 61.79 60.24 1ikw h SER 162 Cb 0.49 -0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 62.16 1ikw h SER 162 CO 0.03 1.16 -0.06 0.28 -0.53 0.00 0.00 176.83 177.70 1ikw h SER 163 N 0.91 0.38 -0.06 6.23 0.02 -0.91 -2.68 113.55 117.44 1ikw h SER 163 Ca 0.14 -0.39 0.02 0.00 -0.84 0.00 0.00 61.79 60.72 1ikw h SER 163 Cb 0.69 -0.10 -0.00 0.00 0.14 0.00 0.00 62.40 63.13 1ikw h SER 163 CO 0.05 0.68 0.06 -0.03 -1.14 0.00 0.00 176.83 176.45 1ikw h MET 164 N 0.07 0.00 -0.10 3.45 -1.53 -1.11 0.11 114.93 115.82 1ikw h MET 164 Ca 0.04 0.00 -0.15 0.00 -3.44 0.00 0.00 59.70 56.15 1ikw h MET 164 Cb 0.53 0.00 0.01 0.00 -0.55 0.00 0.00 31.60 31.58 1ikw h MET 164 CO 0.02 0.00 -0.54 1.15 0.14 0.00 0.00 176.91 177.68 1ikw h THR 165 N 0.00 1.36 -0.27 -0.77 2.02 -1.13 -2.46 112.91 111.65 1ikw h THR 165 Ca 0.03 -1.86 -0.10 0.00 0.77 0.00 0.00 66.41 65.25 1ikw h THR 165 Cb 0.14 2.19 -0.01 0.00 -1.74 0.00 0.00 68.15 68.73 1ikw h THR 165 CO -0.00 0.56 -0.25 0.11 0.37 0.00 0.00 175.52 176.31 1ikw h LYS 166 N 0.16 0.52 0.00 6.66 1.57 -0.92 -1.73 116.57 122.83 1ikw h LYS 166 Ca -0.04 -0.20 -0.04 0.00 -1.87 0.00 0.00 60.65 58.50 1ikw h LYS 166 Cb 1.19 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.46 1ikw h LYS 166 CO 0.11 0.73 -0.21 0.82 -0.57 0.00 0.00 179.45 180.33 1ikw h ILE 167 N 0.46 0.64 0.04 1.86 2.04 -1.02 -3.21 117.51 118.31 1ikw h ILE 167 Ca 0.07 -0.95 -0.32 0.00 1.00 0.00 0.00 64.86 64.65 1ikw h ILE 167 Cb 0.68 1.62 -0.04 0.00 -0.74 0.00 0.00 36.82 38.34 1ikw h ILE 167 CO 0.05 0.21 -1.84 0.18 0.00 0.00 0.00 178.15 176.75 1ikw n LEU 168 N -3.54 1.41 -0.29 1.44 4.77 -0.93 -4.48 117.00 115.37 1ikw n LEU 168 Ca -0.01 0.33 0.08 0.00 -0.03 0.00 0.00 56.01 56.38 1ikw n LEU 168 Cb 0.36 -0.22 0.16 0.00 -2.33 0.00 0.00 43.42 41.39 1ikw n LEU 168 CO 0.33 0.54 0.59 1.21 -1.33 0.00 0.00 177.39 178.73 1ikw n GLU 169 N -3.17 -0.07 0.15 3.23 2.13 -0.69 -0.50 120.64 121.72 1ikw n GLU 169 Ca -0.23 1.27 -0.14 0.00 0.66 0.00 0.00 57.16 58.72 1ikw n GLU 169 Cb 1.05 -1.94 -0.08 0.00 0.27 0.00 0.00 31.44 30.75 1ikw n GLU 169 CO 0.00 0.00 0.00 -1.35 -0.41 0.00 0.00 177.13 175.37 1ikw h PRO 170 N 0.00 -0.30 -0.22 5.31 0.11 -1.78 -2.06 132.00 133.06 1ikw h PRO 170 Ca 0.44 0.02 0.03 0.00 0.11 0.00 0.00 66.00 66.59 1ikw h PRO 170 Cb 0.76 0.07 -0.03 0.00 0.11 0.00 0.00 31.00 31.92 1ikw h PRO 170 CO -0.82 -0.15 0.05 0.35 -0.21 0.00 0.00 178.00 177.22 1ikw h PHE 171 N -0.38 0.09 -0.69 0.65 3.04 -1.05 -1.04 116.94 117.57 1ikw h PHE 171 Ca -0.03 0.01 0.07 0.00 3.98 0.00 0.00 57.97 62.00 1ikw h PHE 171 Cb 0.29 -0.01 -0.06 0.00 2.56 0.00 0.00 35.95 38.73 1ikw h PHE 171 CO -0.04 0.03 0.38 0.87 -2.02 0.00 0.00 178.31 177.53 1ikw h LYS 172 N 0.14 0.66 -0.90 1.11 1.57 -1.18 -0.35 116.57 117.62 1ikw h LYS 172 Ca 0.10 -0.04 0.02 0.00 -1.87 0.00 0.00 60.65 58.86 1ikw h LYS 172 Cb 0.09 -0.15 -0.05 0.00 0.08 0.00 0.00 32.23 32.20 1ikw h LYS 172 CO -0.12 0.44 0.59 -0.22 -0.57 0.00 0.00 179.45 179.57 1ikw h LYS 173 N 0.68 1.14 0.00 3.15 3.11 -0.79 -0.89 116.57 122.96 1ikw h LYS 173 Ca 0.32 -0.07 -0.09 0.00 -2.81 0.00 0.00 60.65 58.00 1ikw h LYS 173 Cb 0.23 -0.26 -0.01 0.00 -1.00 0.00 0.00 32.23 31.19 1ikw h LYS 173 CO -0.20 0.75 -0.44 1.96 -2.81 0.00 0.00 179.45 178.70 1ikw h GLN 174 N 1.17 0.00 -2.32 1.90 7.50 -0.08 -3.35 115.11 119.92 1ikw h GLN 174 Ca 0.35 0.00 -0.59 0.00 0.50 0.00 0.00 58.65 58.91 1ikw h GLN 174 Cb -0.05 0.00 -0.40 0.00 0.05 0.00 0.00 27.48 27.08 1ikw h GLN 174 CO -0.09 0.44 -0.87 0.09 -1.50 0.00 0.00 178.83 176.90 1ikw n ASN 175 N -3.44 1.29 0.08 1.46 3.02 -0.25 -4.93 115.26 112.49 1ikw n ASN 175 Ca 0.00 -2.86 0.08 0.00 -0.03 0.00 0.00 54.58 51.77 1ikw n ASN 175 Cb 0.59 -0.64 0.37 0.00 -0.61 0.00 0.00 39.78 39.49 1ikw n ASN 175 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1ikw n PRO 176 N 1.75 0.10 0.22 3.52 -0.04 -0.44 -1.52 135.00 138.59 1ikw n PRO 176 Ca 0.25 0.46 0.12 0.00 -0.04 0.00 0.00 63.50 64.29 1ikw n PRO 176 Cb 0.46 -1.74 0.19 0.00 -0.04 0.00 0.00 33.50 32.37 1ikw n PRO 176 CO 0.00 0.00 0.00 0.22 -0.04 0.00 0.00 175.50 175.68 1ikw h ASP 177 N 0.00 0.00 -3.60 3.54 1.82 -1.92 -3.44 116.42 112.83 1ikw h ASP 177 Ca 0.00 0.00 -0.62 0.00 -0.39 0.00 0.00 57.03 56.02 1ikw h ASP 177 Cb 0.16 0.00 -0.13 0.00 0.68 0.00 0.00 39.33 40.04 1ikw h ASP 177 CO 0.00 0.01 -0.02 -0.63 -1.61 0.00 0.00 179.24 176.99 1ikw s ILE 178 N -3.23 5.05 -0.08 2.25 -1.09 -0.57 -4.57 121.20 118.95 1ikw s ILE 178 Ca 0.07 0.74 -0.14 0.00 -2.23 0.00 0.00 60.65 59.08 1ikw s ILE 178 Cb 0.05 -3.87 -0.05 0.00 -1.58 0.00 0.00 42.46 37.02 1ikw s ILE 178 CO 0.67 -0.00 0.36 0.68 -1.23 0.00 0.00 174.94 175.41 1ikw s VAL 179 N 2.35 5.19 -0.17 2.92 -7.23 -0.26 -4.96 120.40 118.24 1ikw s VAL 179 Ca 0.21 0.71 -0.01 0.00 -1.81 0.00 0.00 61.98 61.07 1ikw s VAL 179 Cb -0.15 -3.68 0.05 0.00 0.56 0.00 0.00 36.38 33.16 1ikw s VAL 179 CO 0.10 0.48 -0.02 -0.63 -0.31 0.00 0.00 175.10 174.72 1ikw s ILE 180 N -0.26 0.86 -0.20 -0.62 1.01 -1.26 -1.03 121.20 119.70 1ikw s ILE 180 Ca 0.21 -0.55 -0.07 0.00 0.00 0.00 0.00 60.65 60.24 1ikw s ILE 180 Cb -0.15 -1.14 -0.04 0.00 0.01 0.00 0.00 42.46 41.14 1ikw s ILE 180 CO 0.09 0.02 0.07 -0.47 0.00 0.00 0.00 174.94 174.65 1ikw s TYR 181 N 1.73 3.21 -0.31 3.97 5.04 0.31 -4.93 117.35 126.37 1ikw s TYR 181 Ca 0.00 -0.02 -0.09 0.00 -2.44 0.00 0.00 57.07 54.52 1ikw s TYR 181 Cb -0.16 -2.12 0.00 0.00 0.35 0.00 0.00 41.96 40.04 1ikw s TYR 181 CO -0.07 0.04 0.13 1.14 -1.34 0.00 0.00 175.55 175.45 1ikw s GLN 182 N 0.67 3.16 -0.29 4.97 -2.07 -1.26 -0.27 119.66 124.56 1ikw s GLN 182 Ca 0.03 -0.83 0.03 0.00 -1.82 0.00 0.00 55.36 52.78 1ikw s GLN 182 Cb -0.13 -3.52 0.08 0.00 -1.09 0.00 0.00 33.01 28.35 1ikw s GLN 182 CO 0.02 -0.47 -0.05 -0.47 -1.32 0.00 0.00 175.29 173.00 1ikw s TYR 183 N 1.56 3.41 0.00 9.60 5.04 -0.83 -5.00 117.35 131.13 1ikw s TYR 183 Ca 0.03 -2.56 0.00 0.00 -2.44 0.00 0.00 57.07 52.11 1ikw s TYR 183 Cb -0.17 -2.29 0.00 0.00 0.35 0.00 0.00 41.96 39.85 1ikw s TYR 183 CO 0.05 -0.90 0.00 -1.33 -1.34 0.00 0.00 175.55 172.03 1ikw n MET 184 N 4.38 0.00 -0.31 4.97 2.81 -1.26 -1.26 117.12 126.45 1ikw n MET 184 Ca -0.07 0.00 -0.06 0.00 -1.81 0.00 0.00 57.70 55.76 1ikw n MET 184 Cb 0.42 0.00 0.05 0.00 -0.71 0.00 0.00 33.22 32.98 1ikw n MET 184 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 1ikw n ASP 185 N 0.79 3.13 -4.43 7.83 3.85 -1.26 -4.81 116.55 121.65 1ikw n ASP 185 Ca 0.00 -2.40 -0.28 0.00 -0.71 0.00 0.00 54.79 51.40 1ikw n ASP 185 Cb 0.00 -0.58 -0.12 0.00 -1.35 0.00 0.00 41.12 39.06 1ikw n ASP 185 CO 0.00 0.00 0.00 -1.81 -1.01 0.00 0.00 177.20 174.38 1ikw s ASP 186 N 0.37 3.50 -0.14 -1.12 -0.00 -0.39 -1.62 116.67 117.27 1ikw s ASP 186 Ca 0.15 -0.76 -0.01 0.00 -0.00 0.00 0.00 52.55 51.93 1ikw s ASP 186 Cb 0.12 -0.31 0.03 0.00 -0.00 0.00 0.00 42.92 42.77 1ikw s ASP 186 CO 0.03 0.15 -0.06 -0.76 -0.00 0.00 0.00 175.17 174.54 1ikw s LEU 187 N -2.36 1.32 -0.33 1.23 1.02 0.12 -1.97 118.68 117.72 1ikw s LEU 187 Ca 0.18 -0.46 -0.14 0.00 0.02 0.00 0.00 54.13 53.73 1ikw s LEU 187 Cb -0.09 -0.83 -0.02 0.00 0.02 0.00 0.00 46.19 45.27 1ikw s LEU 187 CO 0.09 -0.16 0.28 -0.31 0.02 0.00 0.00 176.35 176.27 1ikw s TYR 188 N 1.70 3.22 -0.19 0.29 1.51 0.62 -0.59 117.35 123.92 1ikw s TYR 188 Ca 0.03 -0.11 -0.02 0.00 -1.01 0.00 0.00 57.07 55.96 1ikw s TYR 188 Cb -0.14 -2.54 -0.00 0.00 -0.11 0.00 0.00 41.96 39.17 1ikw s TYR 188 CO -0.08 -0.37 -0.11 0.08 -1.11 0.00 0.00 175.55 173.97 1ikw s VAL 189 N 1.83 2.93 0.07 0.71 1.01 -0.34 -0.53 120.40 126.08 1ikw s VAL 189 Ca 0.08 -0.66 0.05 0.00 0.00 0.00 0.00 61.98 61.46 1ikw s VAL 189 Cb -0.17 -2.28 -0.03 0.00 0.00 0.00 0.00 36.38 33.90 1ikw s VAL 189 CO 0.11 0.48 -0.15 -0.83 0.00 0.00 0.00 175.10 174.71 1ikw s GLY 190 N 1.17 0.90 0.23 4.51 0.00 -0.20 -1.34 107.32 112.60 1ikw s GLY 190 Ca 0.02 -0.99 -0.08 0.00 0.00 0.00 0.00 44.72 43.67 1ikw s GLY 190 CO -0.04 -1.00 0.34 -1.35 0.00 0.00 0.00 173.10 171.05 1ikw s SER 191 N -1.61 0.04 -0.10 1.64 1.04 -0.30 -1.11 113.70 113.31 1ikw s SER 191 Ca 0.00 -1.13 0.16 0.00 0.48 0.00 0.00 55.95 55.46 1ikw s SER 191 Cb -0.09 0.51 0.60 0.00 0.10 0.00 0.00 66.02 67.13 1ikw s SER 191 CO 0.02 -1.03 1.51 0.47 0.98 0.00 0.00 173.24 175.20 1ikw n ASP 192 N -0.38 4.22 -3.08 7.02 8.00 -1.26 -1.77 116.55 129.30 1ikw n ASP 192 Ca -0.00 -2.46 -0.17 0.00 0.71 0.00 0.00 54.79 52.88 1ikw n ASP 192 Cb 0.63 -0.50 0.12 0.00 -0.02 0.00 0.00 41.12 41.36 1ikw n ASP 192 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1ikw n LEU 193 N 0.70 0.00 -4.85 0.64 4.77 -1.26 -4.79 117.00 112.20 1ikw n LEU 193 Ca 0.22 -0.79 -0.37 0.00 -0.03 0.00 0.00 56.01 55.04 1ikw n LEU 193 Cb 0.79 -0.57 -0.06 0.00 -2.33 0.00 0.00 43.42 41.25 1ikw n LEU 193 CO 0.19 -1.16 0.04 -1.61 -1.33 0.00 0.00 177.39 173.51 1ikw s GLU 194 N -4.59 3.77 0.55 3.23 0.41 -1.26 -4.35 118.70 116.46 1ikw s GLU 194 Ca 0.42 0.22 0.49 0.00 -0.41 0.00 0.00 54.97 55.69 1ikw s GLU 194 Cb -0.02 -3.16 1.67 0.00 -1.78 0.00 0.00 34.13 30.84 1ikw s GLU 194 CO 0.30 0.68 1.52 1.51 -0.49 0.00 0.00 175.26 178.78 1ikw n ILE 195 N 1.60 0.00 0.14 -1.63 3.06 -1.26 0.12 119.36 121.39 1ikw n ILE 195 Ca -0.14 1.45 -0.07 0.00 -2.50 0.00 0.00 62.75 61.50 1ikw n ILE 195 Cb 0.53 -2.43 -0.03 0.00 0.54 0.00 0.00 39.64 38.25 1ikw n ILE 195 CO 0.00 0.00 0.00 1.23 -2.50 0.00 0.00 176.55 175.28 1ikw h GLY 196 N 0.00 -0.44 2.00 4.50 0.00 -2.00 -2.70 103.07 104.43 1ikw h GLY 196 Ca 0.90 0.16 0.00 0.00 0.00 0.00 0.00 47.33 48.40 1ikw h GLY 196 CO -0.01 -0.16 0.00 -1.06 0.00 0.00 0.00 176.54 175.31 1ikw n GLN 197 N -4.83 0.15 0.11 4.80 6.02 0.14 -2.40 117.38 121.37 1ikw n GLN 197 Ca -0.05 0.44 -0.05 0.00 -0.01 0.00 0.00 57.00 57.32 1ikw n GLN 197 Cb 0.17 -1.83 -0.03 0.00 1.02 0.00 0.00 30.24 29.58 1ikw n GLN 197 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 1ikw h HIS 198 N 0.00 -0.33 -0.22 1.08 2.76 0.93 -2.77 115.15 116.60 1ikw h HIS 198 Ca 0.00 -0.01 0.06 0.00 -2.20 0.00 0.00 60.37 58.22 1ikw h HIS 198 Cb 0.27 0.11 -0.01 0.00 1.55 0.00 0.00 27.41 29.33 1ikw h HIS 198 CO 0.00 -0.21 0.21 0.00 -1.30 0.00 0.00 177.93 176.63 1ikw h ARG 199 N -0.96 0.00 0.32 5.26 3.08 -1.38 0.23 114.38 120.93 1ikw h ARG 199 Ca -0.04 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.00 1ikw h ARG 199 Cb 0.27 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.33 1ikw h ARG 199 CO 0.06 0.00 -0.15 1.15 -1.07 0.00 0.00 179.97 179.96 1ikw h THR 200 N 0.00 0.70 -1.00 2.04 2.02 -1.54 -1.61 112.91 113.52 1ikw h THR 200 Ca 0.10 -0.46 0.03 0.00 0.77 0.00 0.00 66.41 66.85 1ikw h THR 200 Cb 0.52 0.94 -0.05 0.00 -1.74 0.00 0.00 68.15 67.82 1ikw h THR 200 CO -0.00 0.09 0.66 0.50 0.37 0.00 0.00 175.52 177.14 1ikw h LYS 201 N -0.68 1.26 0.06 6.66 1.63 -0.60 -1.97 116.57 122.93 1ikw h LYS 201 Ca -0.04 -0.08 0.02 0.00 -0.85 0.00 0.00 60.65 59.71 1ikw h LYS 201 Cb 0.47 -0.28 -0.04 0.00 -0.60 0.00 0.00 32.23 31.78 1ikw h LYS 201 CO 0.07 0.83 -0.26 0.82 -3.45 0.00 0.00 179.45 177.46 1ikw h ILE 202 N 1.30 0.42 -0.83 2.00 1.08 -0.46 -0.23 117.51 120.78 1ikw h ILE 202 Ca 0.39 0.00 0.07 0.00 -0.39 0.00 0.00 64.86 64.93 1ikw h ILE 202 Cb -0.06 0.42 -0.06 0.00 -3.07 0.00 0.00 36.82 34.05 1ikw h ILE 202 CO -0.11 0.00 0.50 -0.33 -0.69 0.00 0.00 178.15 177.52 1ikw h GLU 203 N -0.43 0.87 -0.99 2.37 4.39 -0.88 0.20 114.58 120.10 1ikw h GLU 203 Ca 0.05 -0.05 0.14 0.00 0.34 0.00 0.00 59.36 59.83 1ikw h GLU 203 Cb 0.49 -0.20 -0.09 0.00 -0.10 0.00 0.00 28.75 28.85 1ikw h GLU 203 CO -0.19 0.58 0.62 1.49 -1.16 0.00 0.00 179.01 180.35 1ikw h GLU 204 N 0.90 0.89 0.06 2.33 4.81 -0.61 0.15 114.58 123.11 1ikw h GLU 204 Ca 0.37 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.55 1ikw h GLU 204 Cb 0.22 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.40 1ikw h GLU 204 CO -0.19 0.59 -0.03 1.25 -0.73 0.00 0.00 179.01 179.90 1ikw h LEU 205 N 0.91 -0.07 -1.57 1.64 5.85 0.10 -1.20 115.31 120.98 1ikw h LEU 205 Ca 0.51 -0.39 0.16 0.00 0.84 0.00 0.00 57.88 58.99 1ikw h LEU 205 Cb 0.60 0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.59 1ikw h LEU 205 CO -0.28 0.37 0.52 0.03 -0.34 0.00 0.00 178.44 178.75 1ikw h ARG 206 N -0.53 0.40 0.30 1.25 3.08 -0.05 0.13 114.38 118.96 1ikw h ARG 206 Ca -0.01 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.00 1ikw h ARG 206 Cb 0.46 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.42 1ikw h ARG 206 CO 0.01 0.26 -0.14 1.96 -1.07 0.00 0.00 179.97 180.99 1ikw h GLN 207 N 0.41 -0.39 -0.97 0.04 1.08 -0.57 0.19 115.11 114.90 1ikw h GLN 207 Ca 0.39 0.03 0.19 0.00 -1.45 0.00 0.00 58.65 57.81 1ikw h GLN 207 Cb 0.91 0.09 -0.11 0.00 -0.05 0.00 0.00 27.48 28.32 1ikw h GLN 207 CO -0.13 -0.05 0.57 1.25 -0.95 0.00 0.00 178.83 179.52 1ikw h HIS 208 N -0.81 0.99 -0.51 2.96 2.76 0.05 0.84 115.15 121.43 1ikw h HIS 208 Ca -0.04 0.04 -0.08 0.00 -2.20 0.00 0.00 60.37 58.08 1ikw h HIS 208 Cb 0.51 -0.29 -0.02 0.00 1.55 0.00 0.00 27.41 29.17 1ikw h HIS 208 CO 0.03 0.18 0.01 -0.07 -1.30 0.00 0.00 177.93 176.78 1ikw h LEU 209 N 0.69 0.88 -0.32 0.26 3.38 -0.61 -3.00 115.31 116.58 1ikw h LEU 209 Ca 0.57 -0.30 0.02 0.00 0.09 0.00 0.00 57.88 58.26 1ikw h LEU 209 Cb 0.93 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.42 1ikw h LEU 209 CO -0.41 0.97 0.18 0.25 0.09 0.00 0.00 178.44 179.52 1ikw h LEU 210 N 0.77 0.28 0.00 1.67 6.46 0.12 0.19 115.31 124.80 1ikw h LEU 210 Ca 0.15 0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.91 1ikw h LEU 210 Cb 0.51 -0.05 0.00 0.00 -0.73 0.00 0.00 40.66 40.39 1ikw h LEU 210 CO 0.02 0.21 0.12 0.54 -0.62 0.00 0.00 178.44 178.72 1ikw n ARG 211 N -4.92 0.00 -0.04 1.25 1.74 -0.31 -0.81 116.66 113.57 1ikw n ARG 211 Ca -0.01 0.32 0.05 0.00 -0.77 0.00 0.00 57.85 57.45 1ikw n ARG 211 Cb 0.06 -1.62 0.08 0.00 -1.02 0.00 0.00 32.46 29.95 1ikw n ARG 211 CO 0.00 0.00 0.00 0.91 -1.52 0.00 0.00 177.63 177.02 1ikw n TRP 212 N -1.30 0.00 -0.75 -1.55 7.02 0.61 -4.87 117.44 116.59 1ikw n TRP 212 Ca 0.00 -0.76 0.00 0.00 -1.02 0.00 0.00 57.50 55.72 1ikw n TRP 212 Cb 0.12 -0.10 0.00 0.00 -2.42 0.00 0.00 31.31 28.91 1ikw n TRP 212 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1ikw n GLY 213 N -1.00 0.71 3.33 6.99 0.00 0.01 -3.89 105.19 111.33 1ikw n GLY 213 Ca 0.09 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.74 1ikw n GLY 213 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ikw s LEU 214 N 0.00 3.76 0.14 0.99 1.43 -0.85 -4.16 118.68 119.99 1ikw s LEU 214 Ca 0.00 -0.72 -0.24 0.00 -1.03 0.00 0.00 54.13 52.14 1ikw s LEU 214 Cb 0.00 -1.86 -0.07 0.00 0.03 0.00 0.00 46.19 44.29 1ikw s LEU 214 CO 0.00 -0.18 0.75 0.28 0.23 0.00 0.00 176.35 177.43 1ikw s THR 215 N 1.48 4.47 0.04 5.49 -1.32 -1.26 -3.29 115.64 121.25 1ikw s THR 215 Ca 0.02 1.63 0.02 0.00 -1.21 0.00 0.00 61.69 62.16 1ikw s THR 215 Cb -0.17 -4.11 -0.02 0.00 -1.51 0.00 0.00 72.50 66.69 1ikw s THR 215 CO 0.02 0.50 -0.07 0.28 -2.21 0.00 0.00 174.62 173.14 1ikw s THR 216 N -0.98 0.49 1.02 5.08 -1.32 -1.26 -2.18 115.64 116.49 1ikw s THR 216 Ca 0.35 -1.10 -0.21 0.00 -1.21 0.00 0.00 61.69 59.52 1ikw s THR 216 Cb -0.22 -0.62 -0.09 0.00 -1.51 0.00 0.00 72.50 70.06 1ikw s THR 216 CO 0.25 -0.42 -0.79 -2.65 -2.21 0.00 0.00 174.62 168.80 1ikw n PRO 217 N 1.41 -0.39 -0.02 7.08 -0.02 -1.26 -5.02 135.00 136.77 1ikw n PRO 217 Ca -0.22 -0.11 -0.06 0.00 -2.02 0.00 0.00 63.50 61.09 1ikw n PRO 217 Cb 0.55 -1.26 -0.02 0.00 -0.02 0.00 0.00 33.50 32.75 1ikw n PRO 217 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1ikw n ASP 218 N 1.76 1.04 0.00 2.55 -0.08 -1.26 -4.86 116.55 115.71 1ikw n ASP 218 Ca -0.00 0.16 0.00 0.00 -1.51 0.00 0.00 54.79 53.44 1ikw n ASP 218 Cb 0.65 -0.38 0.00 0.00 2.34 0.00 0.00 41.12 43.73 1ikw n ASP 218 CO 0.00 0.00 0.00 2.29 0.12 0.00 0.00 177.20 179.61 1ikw n LYS 219 N -3.63 0.68 -0.77 -0.67 0.00 -1.26 -4.69 118.16 107.82 1ikw n LYS 219 Ca -0.11 -0.15 -0.13 0.00 -0.00 0.00 0.00 58.31 57.92 1ikw n LYS 219 Cb 0.39 -0.55 0.14 0.00 -0.00 0.00 0.00 35.03 35.00 1ikw n LYS 219 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 1ikw n LYS 220 N -0.14 2.04 0.24 -1.58 4.76 -1.26 -4.59 118.16 117.63 1ikw n LYS 220 Ca 0.00 -1.97 0.11 0.00 -2.87 0.00 0.00 58.31 53.58 1ikw n LYS 220 Cb 0.10 -1.80 0.60 0.00 -1.84 0.00 0.00 35.03 32.09 1ikw n LYS 220 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1ikw h HIS 221 N 0.90 0.00 0.00 2.13 3.86 -1.84 -3.44 115.15 116.76 1ikw h HIS 221 Ca 0.36 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.57 1ikw h HIS 221 Cb 2.12 0.00 0.00 0.00 1.06 0.00 0.00 27.41 30.59 1ikw h HIS 221 CO 1.00 0.00 0.00 0.94 0.86 0.00 0.00 177.93 180.73 1ikw n GLN 222 N -2.46 0.00 0.00 2.45 7.27 -1.26 -3.48 117.38 119.90 1ikw n GLN 222 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.06 1ikw n GLN 222 Cb 0.31 -3.83 0.00 0.00 2.41 0.00 0.00 30.24 29.14 1ikw n GLN 222 CO 0.00 0.00 0.00 0.36 0.07 0.00 0.00 177.06 177.49 1ikw n LYS 223 N -1.86 0.00 -1.35 3.69 2.85 -1.26 -4.67 118.16 115.56 1ikw n LYS 223 Ca 0.00 0.05 0.00 0.00 -1.05 0.00 0.00 58.31 57.31 1ikw n LYS 223 Cb 0.00 -0.36 0.00 0.00 -0.65 0.00 0.00 35.03 34.02 1ikw n LYS 223 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 177.40 175.44 1ikw n GLU 224 N -0.13 0.00 -1.70 -1.58 2.13 -1.26 -4.65 120.64 113.44 1ikw n GLU 224 Ca 0.00 0.00 -0.39 0.00 0.66 0.00 0.00 57.16 57.43 1ikw n GLU 224 Cb 0.00 0.00 0.04 0.00 0.27 0.00 0.00 31.44 31.75 1ikw n GLU 224 CO 0.00 0.00 0.00 -2.30 -0.41 0.00 0.00 177.13 174.42 1ikw n PRO 225 N -0.23 1.45 -0.67 5.31 -0.02 -1.26 -4.64 135.00 134.93 1ikw n PRO 225 Ca 0.00 0.54 -0.26 0.00 -2.02 0.00 0.00 63.50 61.76 1ikw n PRO 225 Cb 0.00 -2.44 0.02 0.00 -0.02 0.00 0.00 33.50 31.06 1ikw n PRO 225 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1ikw n PRO 226 N -0.99 0.00 -3.21 0.52 -0.02 -1.26 -4.98 135.00 125.07 1ikw n PRO 226 Ca 0.11 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.60 1ikw n PRO 226 Cb 0.45 -0.67 -0.03 0.00 -0.02 0.00 0.00 33.50 33.23 1ikw n PRO 226 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 1ikw s PHE 227 N -1.34 -1.40 -0.36 6.00 0.08 -0.94 -4.91 117.98 115.11 1ikw s PHE 227 Ca 0.25 1.42 -0.22 0.00 0.12 0.00 0.00 56.93 58.50 1ikw s PHE 227 Cb 0.04 0.40 0.01 0.00 -0.57 0.00 0.00 43.02 42.90 1ikw s PHE 227 CO 0.46 -0.85 0.74 -0.51 -0.10 0.00 0.00 175.22 174.96 1ikw s LEU 228 N 2.77 4.17 -0.05 -0.37 1.43 -1.26 -0.76 118.68 124.61 1ikw s LEU 228 Ca 0.18 0.30 -0.02 0.00 -1.03 0.00 0.00 54.13 53.56 1ikw s LEU 228 Cb -0.15 -2.95 0.03 0.00 0.03 0.00 0.00 46.19 43.15 1ikw s LEU 228 CO -0.20 -0.68 0.11 0.86 0.23 0.00 0.00 176.35 176.66 1ikw s TRP 229 N 2.97 -0.11 -0.42 0.29 -0.00 0.54 -4.90 118.94 117.31 1ikw s TRP 229 Ca 0.29 0.36 -0.00 0.00 -0.00 0.00 0.00 56.10 56.75 1ikw s TRP 229 Cb -0.14 -0.11 0.00 0.00 -0.00 0.00 0.00 33.47 33.23 1ikw s TRP 229 CO 0.16 -0.13 0.01 -1.33 -0.00 0.00 0.00 176.95 175.65 1ikw n MET 230 N 4.03 -2.69 -0.31 5.86 2.81 -1.26 0.96 117.12 126.51 1ikw n MET 230 Ca -0.25 0.24 0.00 0.00 -1.81 0.00 0.00 57.70 55.88 1ikw n MET 230 Cb 0.52 -4.78 0.00 0.00 -0.71 0.00 0.00 33.22 28.26 1ikw n MET 230 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1ikw n GLY 231 N -0.62 0.72 3.73 3.03 0.00 -1.26 -5.05 105.19 105.73 1ikw n GLY 231 Ca -0.06 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.74 1ikw n GLY 231 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ikw s TYR 232 N -2.41 2.74 -0.27 1.61 2.02 0.27 -0.16 117.35 121.15 1ikw s TYR 232 Ca 0.00 -0.34 0.01 0.00 -0.37 0.00 0.00 57.07 56.37 1ikw s TYR 232 Cb 0.00 -1.57 0.07 0.00 -0.40 0.00 0.00 41.96 40.06 1ikw s TYR 232 CO 0.00 0.38 -0.00 -2.00 -1.57 0.00 0.00 175.55 172.35 1ikw s GLU 233 N -3.83 1.40 -0.12 -0.62 2.12 -0.23 -0.34 118.70 117.08 1ikw s GLU 233 Ca 0.37 -1.14 -0.12 0.00 0.36 0.00 0.00 54.97 54.44 1ikw s GLU 233 Cb -0.04 -2.57 -0.05 0.00 0.26 0.00 0.00 34.13 31.73 1ikw s GLU 233 CO 0.23 -0.73 0.25 -0.51 -0.54 0.00 0.00 175.26 173.96 1ikw s LEU 234 N 1.36 4.33 0.14 2.70 1.02 0.07 -2.26 118.68 126.04 1ikw s LEU 234 Ca 0.00 0.56 0.08 0.00 0.02 0.00 0.00 54.13 54.80 1ikw s LEU 234 Cb -0.19 -2.30 -0.04 0.00 0.02 0.00 0.00 46.19 43.69 1ikw s LEU 234 CO -0.10 0.25 -0.19 -1.00 0.02 0.00 0.00 176.35 175.32 1ikw s HIS 235 N -0.32 1.82 0.59 0.29 3.76 -0.84 -2.21 115.29 118.39 1ikw s HIS 235 Ca 0.17 -0.45 0.33 0.00 -0.15 0.00 0.00 55.06 54.96 1ikw s HIS 235 Cb -0.13 -0.94 1.92 0.00 1.11 0.00 0.00 32.58 34.54 1ikw s HIS 235 CO 0.05 0.28 2.27 -1.00 -0.85 0.00 0.00 174.74 175.49 1ikw h PRO 236 N 3.58 0.00 0.00 8.40 0.13 -1.92 -3.13 132.00 139.07 1ikw h PRO 236 Ca -0.44 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.61 1ikw h PRO 236 Cb 1.20 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.31 1ikw h PRO 236 CO 0.46 0.01 -0.56 0.22 -0.23 0.00 0.00 178.00 177.90 1ikw h ASP 237 N 0.00 0.00 -0.07 1.44 -0.00 -1.95 -3.08 116.42 112.77 1ikw h ASP 237 Ca -0.00 -0.45 0.00 0.00 -0.00 0.00 0.00 57.03 56.58 1ikw h ASP 237 Cb 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.36 1ikw h ASP 237 CO 0.00 1.05 0.00 2.29 -0.00 0.00 0.00 179.24 182.58 1ikw n LYS 238 N -4.58 0.52 -3.53 0.28 2.85 -1.18 -4.28 118.16 108.25 1ikw n LYS 238 Ca -0.16 0.00 -0.07 0.00 -1.05 0.00 0.00 58.31 57.03 1ikw n LYS 238 Cb 0.43 0.00 -0.02 0.00 -0.65 0.00 0.00 35.03 34.79 1ikw n LYS 238 CO 0.00 0.00 0.00 1.67 -0.05 0.00 0.00 177.40 179.02 1ikw s TRP 239 N 0.13 -0.30 0.21 5.58 1.48 -0.64 -1.98 118.94 123.42 1ikw s TRP 239 Ca 0.00 0.16 -0.13 0.00 -1.06 0.00 0.00 56.10 55.08 1ikw s TRP 239 Cb 0.00 0.54 0.05 0.00 -1.16 0.00 0.00 33.47 32.90 1ikw s TRP 239 CO 0.00 -0.52 0.64 -2.37 -4.06 0.00 0.00 176.95 170.64 1ikw n THR 240 N -0.25 0.00 -3.28 0.66 5.66 -0.96 0.29 114.28 116.40 1ikw n THR 240 Ca -0.07 -0.56 -0.27 0.00 -3.05 0.00 0.00 64.05 60.10 1ikw n THR 240 Cb 0.61 0.63 -0.02 0.00 -1.55 0.00 0.00 70.33 70.00 1ikw n THR 240 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 175.07 172.70 1ikw s VAL 241 N -2.29 5.04 0.52 1.08 -7.23 -1.26 -1.07 120.40 115.19 1ikw s VAL 241 Ca 0.14 -0.11 -0.20 0.00 -1.81 0.00 0.00 61.98 60.00 1ikw s VAL 241 Cb -0.03 -3.79 -0.10 0.00 0.56 0.00 0.00 36.38 33.02 1ikw s VAL 241 CO 0.06 -0.45 0.60 0.00 -0.31 0.00 0.00 175.10 175.00 1ikw n GLN 242 N -1.35 0.63 -1.68 4.82 1.13 0.77 -4.60 117.38 117.11 1ikw n GLN 242 Ca -0.03 0.24 -0.45 0.00 -1.94 0.00 0.00 57.00 54.82 1ikw n GLN 242 Cb 0.55 -1.71 -0.04 0.00 0.11 0.00 0.00 30.24 29.15 1ikw n GLN 242 CO 0.00 0.00 0.00 -2.30 -1.44 0.00 0.00 177.06 173.32 1ikw n PRO 243 N 0.10 2.37 -3.69 -1.09 -0.02 -1.26 -4.98 135.00 126.43 1ikw n PRO 243 Ca 0.11 0.86 -0.35 0.00 -2.02 0.00 0.00 63.50 62.10 1ikw n PRO 243 Cb 0.45 -2.68 -0.05 0.00 -0.02 0.00 0.00 33.50 31.19 1ikw n PRO 243 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1ikw s ILE 244 N 1.87 5.23 -0.12 4.25 -1.09 -1.26 -5.08 121.20 125.00 1ikw s ILE 244 Ca 0.81 0.31 -0.04 0.00 -2.23 0.00 0.00 60.65 59.51 1ikw s ILE 244 Cb -0.62 -3.59 0.05 0.00 -1.58 0.00 0.00 42.46 36.72 1ikw s ILE 244 CO 0.39 0.37 0.10 0.54 -1.23 0.00 0.00 174.94 175.12 1ikw s VAL 245 N -1.30 -0.14 -0.56 2.92 0.11 -1.26 -5.09 120.40 115.09 1ikw s VAL 245 Ca 0.28 0.12 -0.26 0.00 -2.93 0.00 0.00 61.98 59.19 1ikw s VAL 245 Cb -0.14 -0.40 0.04 0.00 -1.53 0.00 0.00 36.38 34.35 1ikw s VAL 245 CO 0.16 -0.06 1.05 -0.76 -3.33 0.00 0.00 175.10 172.16 1ikw s LEU 246 N 2.19 3.81 0.01 2.54 1.43 -1.26 -4.95 118.68 122.45 1ikw s LEU 246 Ca 0.04 -0.14 -0.02 0.00 -1.03 0.00 0.00 54.13 52.98 1ikw s LEU 246 Cb -0.14 -2.99 0.00 0.00 0.03 0.00 0.00 46.19 43.09 1ikw s LEU 246 CO -0.07 -1.33 0.09 -2.65 0.23 0.00 0.00 176.35 172.62 1ikw n PRO 247 N 7.88 -0.02 -2.27 1.29 -0.02 -1.26 -4.88 135.00 135.72 1ikw n PRO 247 Ca 0.05 0.09 -0.02 0.00 -2.02 0.00 0.00 63.50 61.60 1ikw n PRO 247 Cb 0.48 -0.13 0.00 0.00 -0.02 0.00 0.00 33.50 33.83 1ikw n PRO 247 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1ikw n GLU 248 N -4.08 -1.94 -4.12 -0.52 2.13 -1.26 -5.08 120.64 105.77 1ikw n GLU 248 Ca 0.00 1.79 -0.09 0.00 0.66 0.00 0.00 57.16 59.52 1ikw n GLU 248 Cb 0.02 -3.82 -0.10 0.00 0.27 0.00 0.00 31.44 27.81 1ikw n GLU 248 CO 0.00 0.00 0.00 -1.59 -0.41 0.00 0.00 177.13 175.13 1ikw s LYS 249 N -1.31 0.80 0.01 5.31 -2.85 -1.26 -5.09 119.74 115.35 1ikw s LYS 249 Ca 0.05 -1.34 -0.11 0.00 -1.00 0.00 0.00 55.97 53.56 1ikw s LYS 249 Cb -0.01 0.23 -0.06 0.00 -2.06 0.00 0.00 37.83 35.93 1ikw s LYS 249 CO 0.48 -0.20 0.94 -0.44 0.10 0.00 0.00 175.35 176.23 1ikw h ASP 250 N 2.97 -0.34 -3.55 0.03 3.32 -2.05 -3.45 116.42 113.36 1ikw h ASP 250 Ca -0.35 0.01 -0.68 0.00 0.02 0.00 0.00 57.03 56.04 1ikw h ASP 250 Cb 1.18 0.09 -0.17 0.00 0.22 0.00 0.00 39.33 40.65 1ikw h ASP 250 CO 0.62 -0.20 -0.68 -0.94 -1.72 0.00 0.00 179.24 176.32 1ikw s SER 251 N -3.03 4.80 -0.16 6.45 1.04 -1.26 -5.03 113.70 116.51 1ikw s SER 251 Ca -0.06 -0.04 -0.03 0.00 0.48 0.00 0.00 55.95 56.30 1ikw s SER 251 Cb 0.01 -1.21 -0.02 0.00 0.10 0.00 0.00 66.02 64.90 1ikw s SER 251 CO 0.18 0.32 -0.07 0.26 0.98 0.00 0.00 173.24 174.91 1ikw s TRP 252 N -0.94 2.94 0.35 5.02 0.52 -1.26 -5.03 118.94 120.54 1ikw s TRP 252 Ca 0.15 -0.52 -0.03 0.00 0.02 0.00 0.00 56.10 55.73 1ikw s TRP 252 Cb -0.11 -1.95 -0.04 0.00 -1.15 0.00 0.00 33.47 30.22 1ikw s TRP 252 CO 0.05 -0.18 0.60 0.95 0.02 0.00 0.00 176.95 178.39 1ikw s THR 253 N 0.56 5.03 0.26 2.01 -4.23 -1.26 -0.16 115.64 117.86 1ikw s THR 253 Ca -0.05 -0.12 -0.03 0.00 -1.18 0.00 0.00 61.69 60.32 1ikw s THR 253 Cb -0.15 -3.81 0.29 0.00 1.34 0.00 0.00 72.50 70.17 1ikw s THR 253 CO 0.03 -0.51 1.65 0.58 -0.54 0.00 0.00 174.62 175.82 1ikw h VAL 254 N 0.91 0.35 -0.98 2.29 2.07 -0.73 0.37 116.25 120.53 1ikw h VAL 254 Ca -0.48 -0.06 0.04 0.00 0.82 0.00 0.00 66.70 67.02 1ikw h VAL 254 Cb 1.20 0.16 -0.06 0.00 -1.52 0.00 0.00 31.29 31.08 1ikw h VAL 254 CO 0.63 0.03 0.63 -1.13 0.02 0.00 0.00 177.57 177.76 1ikw h ASN 255 N 0.17 1.05 -0.26 0.57 -1.24 -1.57 -1.31 115.58 112.98 1ikw h ASN 255 Ca 0.47 -0.00 -0.03 0.00 0.71 0.00 0.00 56.30 57.45 1ikw h ASN 255 Cb 0.89 -0.23 -0.01 0.00 0.73 0.00 0.00 38.32 39.70 1ikw h ASN 255 CO -0.64 0.70 0.04 0.44 -1.29 0.00 0.00 177.43 176.68 1ikw h ASP 256 N 1.21 0.42 -0.28 1.15 3.45 -0.61 -2.76 116.42 118.99 1ikw h ASP 256 Ca 0.40 -0.26 0.03 0.00 0.43 0.00 0.00 57.03 57.63 1ikw h ASP 256 Cb 0.05 -0.11 -0.03 0.00 -0.56 0.00 0.00 39.33 38.67 1ikw h ASP 256 CO -0.14 0.57 0.10 0.40 -1.57 0.00 0.00 179.24 178.60 1ikw h ILE 257 N 0.25 0.93 -0.28 0.35 1.08 -0.63 -1.60 117.51 117.61 1ikw h ILE 257 Ca 0.08 -0.08 0.05 0.00 -0.39 0.00 0.00 64.86 64.53 1ikw h ILE 257 Cb 0.33 0.68 -0.05 0.00 -3.07 0.00 0.00 36.82 34.71 1ikw h ILE 257 CO 0.01 0.04 -0.05 1.56 -0.69 0.00 0.00 178.15 179.02 1ikw h GLN 258 N 0.22 0.03 -0.55 2.37 4.20 -1.22 0.16 115.11 120.33 1ikw h GLN 258 Ca 0.12 -0.00 0.06 0.00 0.06 0.00 0.00 58.65 58.89 1ikw h GLN 258 Cb 0.09 -0.01 -0.05 0.00 0.30 0.00 0.00 27.48 27.81 1ikw h GLN 258 CO -0.13 0.02 0.25 0.87 -0.67 0.00 0.00 178.83 179.17 1ikw h LYS 259 N 0.03 0.47 0.41 1.46 6.56 -1.18 0.10 116.57 124.42 1ikw h LYS 259 Ca 0.14 -0.03 -0.01 0.00 -1.06 0.00 0.00 60.65 59.69 1ikw h LYS 259 Cb 0.20 -0.11 -0.01 0.00 -0.57 0.00 0.00 32.23 31.74 1ikw h LYS 259 CO -0.27 0.31 -0.32 1.25 -2.06 0.00 0.00 179.45 178.36 1ikw h LEU 260 N 0.48 -0.83 -1.22 2.94 6.46 -0.41 -1.20 115.31 121.53 1ikw h LEU 260 Ca 0.25 0.06 0.13 0.00 -0.12 0.00 0.00 57.88 58.21 1ikw h LEU 260 Cb 0.21 0.26 -0.07 0.00 -0.73 0.00 0.00 40.66 40.33 1ikw h LEU 260 CO -0.20 -0.47 0.58 0.58 -0.62 0.00 0.00 178.44 178.31 1ikw h VAL 261 N -0.73 0.87 -0.66 1.05 2.07 -0.30 -1.01 116.25 117.54 1ikw h VAL 261 Ca -0.04 -0.27 -0.09 0.00 0.82 0.00 0.00 66.70 67.13 1ikw h VAL 261 Cb 0.62 0.02 -0.03 0.00 -1.52 0.00 0.00 31.29 30.39 1ikw h VAL 261 CO -0.00 0.14 0.08 1.23 0.02 0.00 0.00 177.57 179.04 1ikw h GLY 262 N 0.78 1.19 0.82 2.17 0.00 -0.20 -1.92 103.07 105.90 1ikw h GLY 262 Ca 0.45 -0.82 -0.09 0.00 0.00 0.00 0.00 47.33 46.88 1ikw h GLY 262 CO -0.21 0.76 -0.23 0.50 0.00 0.00 0.00 176.54 177.35 1ikw h LYS 263 N 1.03 0.47 -0.60 4.80 1.79 -0.03 -2.62 116.57 121.40 1ikw h LYS 263 Ca 0.20 -0.27 -0.03 0.00 -2.18 0.00 0.00 60.65 58.37 1ikw h LYS 263 Cb 0.48 0.02 -0.03 0.00 -1.58 0.00 0.00 32.23 31.12 1ikw h LYS 263 CO 0.02 0.85 0.26 -0.07 -1.08 0.00 0.00 179.45 179.43 1ikw h LEU 264 N 0.12 0.79 -1.36 2.94 3.38 -1.22 0.19 115.31 120.14 1ikw h LEU 264 Ca 0.02 -0.09 -0.05 0.00 0.09 0.00 0.00 57.88 57.85 1ikw h LEU 264 Cb 0.79 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 1ikw h LEU 264 CO 0.05 0.70 -0.23 0.78 0.09 0.00 0.00 178.44 179.83 1ikw h ASN 265 N 0.86 0.00 1.06 -0.43 2.35 -1.33 -0.44 115.58 117.65 1ikw h ASN 265 Ca 0.21 0.00 -0.19 0.00 -0.55 0.00 0.00 56.30 55.76 1ikw h ASN 265 Cb 0.14 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.48 1ikw h ASN 265 CO -0.02 0.23 -0.95 -0.25 -1.65 0.00 0.00 177.43 174.79 1ikw h TRP 266 N 0.00 0.00 -0.02 1.19 2.91 -0.65 -3.27 115.95 116.11 1ikw h TRP 266 Ca -0.00 0.00 -0.19 0.00 1.13 0.00 0.00 58.89 59.83 1ikw h TRP 266 Cb 0.63 0.00 -0.01 0.00 -0.51 0.00 0.00 29.16 29.27 1ikw h TRP 266 CO 0.00 0.90 -0.82 0.00 -1.03 0.00 0.00 178.44 177.49 1ikw h ALA 267 N 1.10 0.56 0.00 2.65 0.00 0.13 -3.28 119.26 120.42 1ikw h ALA 267 Ca -0.03 -0.67 0.00 0.00 0.00 0.00 0.00 54.91 54.21 1ikw h ALA 267 Cb 1.71 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.43 1ikw h ALA 267 CO 0.11 0.85 0.08 -1.13 0.00 0.00 0.00 179.25 179.15 1ikw n SER 268 N -3.73 0.00 0.23 0.00 3.41 -0.25 -1.64 113.62 111.63 1ikw n SER 268 Ca -0.04 0.31 0.11 0.00 -0.26 0.00 0.00 58.87 58.98 1ikw n SER 268 Cb 0.76 -0.31 0.48 0.00 -0.26 0.00 0.00 64.21 64.89 1ikw n SER 268 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 1ikw h GLN 269 N 0.00 0.00 0.00 4.33 4.20 -1.77 -2.90 115.11 118.97 1ikw h GLN 269 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1ikw h GLN 269 Cb 0.15 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.93 1ikw h GLN 269 CO 0.00 0.21 -0.23 1.51 -0.67 0.00 0.00 178.83 179.64 1ikw n ILE 270 N -3.37 0.00 -3.12 2.54 0.13 -0.89 0.17 119.36 114.83 1ikw n ILE 270 Ca 0.00 0.00 -0.44 0.00 -1.10 0.00 0.00 62.75 61.21 1ikw n ILE 270 Cb 0.42 0.09 -0.06 0.00 -0.84 0.00 0.00 39.64 39.25 1ikw n ILE 270 CO 0.00 0.00 0.00 -0.31 2.80 0.00 0.00 176.55 179.04 1ikw s TYR 271 N -0.52 3.01 0.27 9.51 2.02 -0.65 -4.78 117.35 126.20 1ikw s TYR 271 Ca 0.00 -0.59 -0.29 0.00 -0.37 0.00 0.00 57.07 55.81 1ikw s TYR 271 Cb 0.00 -3.70 -0.09 0.00 -0.40 0.00 0.00 41.96 37.77 1ikw s TYR 271 CO 0.00 -1.13 1.25 -1.25 -1.57 0.00 0.00 175.55 172.85 1ikw s PRO 272 N 2.78 4.45 0.00 -1.71 0.04 -1.26 -3.56 135.00 135.74 1ikw s PRO 272 Ca 0.16 2.04 0.00 0.00 0.04 0.00 0.00 61.00 63.24 1ikw s PRO 272 Cb -0.20 -3.15 0.00 0.00 0.04 0.00 0.00 34.50 31.19 1ikw s PRO 272 CO 0.11 -0.10 0.00 0.41 0.04 0.00 0.00 177.00 177.46 1ikw n GLY 273 N 1.49 0.50 3.66 0.56 0.00 -1.26 -5.04 105.19 105.10 1ikw n GLY 273 Ca 0.02 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.59 1ikw n GLY 273 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1ikw n ILE 274 N -2.00 1.03 -4.67 -0.61 2.08 -1.23 -4.94 119.36 109.02 1ikw n ILE 274 Ca 0.00 -0.26 -0.23 0.00 0.56 0.00 0.00 62.75 62.83 1ikw n ILE 274 Cb 0.00 -1.42 -0.15 0.00 -0.75 0.00 0.00 39.64 37.32 1ikw n ILE 274 CO 0.00 0.00 0.00 -0.75 0.56 0.00 0.00 176.55 176.36 1ikw s LYS 275 N -0.52 1.18 -0.00 0.38 2.20 -1.26 -5.02 119.74 116.70 1ikw s LYS 275 Ca 0.68 -0.53 0.00 0.00 -0.36 0.00 0.00 55.97 55.76 1ikw s LYS 275 Cb -0.66 -1.14 0.00 0.00 -1.51 0.00 0.00 37.83 34.52 1ikw s LYS 275 CO 0.51 0.31 0.55 1.33 -0.36 0.00 0.00 175.35 177.69 1ikw n VAL 276 N 2.70 0.04 0.21 4.02 0.24 -1.26 -4.90 118.33 119.38 1ikw n VAL 276 Ca -0.14 -0.04 -0.15 0.00 -2.04 0.00 0.00 64.34 61.97 1ikw n VAL 276 Cb 0.55 0.95 -0.08 0.00 -1.47 0.00 0.00 33.84 33.79 1ikw n VAL 276 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 1ikw h ARG 277 N 0.00 -0.47 -0.75 7.34 2.43 -1.98 0.08 114.38 121.03 1ikw h ARG 277 Ca 0.00 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 1ikw h ARG 277 Cb 1.01 0.11 -0.04 0.00 -0.42 0.00 0.00 29.97 30.63 1ikw h ARG 277 CO 0.00 -0.29 0.49 1.96 -1.51 0.00 0.00 179.97 180.62 1ikw h GLN 278 N -0.53 1.00 -0.25 0.20 1.08 -1.93 -1.31 115.11 113.38 1ikw h GLN 278 Ca -0.05 -0.07 -0.12 0.00 -1.45 0.00 0.00 58.65 56.96 1ikw h GLN 278 Cb 0.40 -0.22 -0.01 0.00 -0.05 0.00 0.00 27.48 27.60 1ikw h GLN 278 CO 0.08 0.67 -0.36 -0.07 -0.95 0.00 0.00 178.83 178.20 1ikw h LEU 279 N 1.02 0.58 -0.62 1.46 3.38 -1.88 -2.98 115.31 116.26 1ikw h LEU 279 Ca 0.27 -0.24 -0.15 0.00 0.09 0.00 0.00 57.88 57.85 1ikw h LEU 279 Cb -0.09 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.48 1ikw h LEU 279 CO -0.06 0.89 -0.59 0.00 0.09 0.00 0.00 178.44 178.77 1ikw h LYS 281 N 0.23 0.61 0.00 0.00 1.57 -1.09 -1.54 116.57 116.34 1ikw h LYS 281 Ca -0.00 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1ikw h LYS 281 Cb 1.10 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 33.28 1ikw h LYS 281 CO 0.10 0.40 0.00 -0.07 -0.57 0.00 0.00 179.45 179.31 1ikw h LEU 282 N 0.62 0.00 -1.99 2.94 3.38 -1.49 -2.86 115.31 115.91 1ikw h LEU 282 Ca 0.23 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.20 1ikw h LEU 282 Cb 0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 1ikw h LEU 282 CO -0.06 0.00 0.00 0.18 0.09 0.00 0.00 178.44 178.65 1ikw n LEU 283 N -2.39 2.95 -4.68 1.67 4.77 -0.58 -4.91 117.00 113.83 1ikw n LEU 283 Ca 0.01 -1.33 -0.42 0.00 -0.03 0.00 0.00 56.01 54.23 1ikw n LEU 283 Cb 0.17 -0.26 -0.03 0.00 -2.33 0.00 0.00 43.42 40.98 1ikw n LEU 283 CO 0.18 0.66 0.94 -0.13 -1.33 0.00 0.00 177.39 177.71 1ikw s ARG 284 N -1.49 4.35 0.00 3.23 0.52 -1.08 -4.83 118.95 119.65 1ikw s ARG 284 Ca 0.37 1.62 0.00 0.00 -0.52 0.00 0.00 55.73 57.20 1ikw s ARG 284 Cb 0.21 -3.58 0.00 0.00 0.52 0.00 0.00 34.95 32.10 1ikw s ARG 284 CO 0.29 -0.46 0.00 0.41 0.02 0.00 0.00 175.30 175.56 1ikw n GLY 285 N 3.35 3.23 3.56 -3.53 0.00 -1.26 -4.94 105.19 105.59 1ikw n GLY 285 Ca 0.11 -1.56 -0.28 0.00 0.00 0.00 0.00 46.02 44.29 1ikw n GLY 285 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ikw s THR 286 N -1.10 3.31 0.02 2.61 2.01 -1.26 -4.93 115.64 116.29 1ikw s THR 286 Ca 0.00 -0.13 0.07 0.00 0.31 0.00 0.00 61.69 61.94 1ikw s THR 286 Cb 0.00 -3.73 -0.03 0.00 0.01 0.00 0.00 72.50 68.76 1ikw s THR 286 CO 0.00 -0.69 -0.21 -0.54 -0.69 0.00 0.00 174.62 172.49 1ikw s LYS 287 N 7.46 2.08 0.33 4.92 1.02 -1.26 -5.09 119.74 129.20 1ikw s LYS 287 Ca 0.76 -0.96 -0.27 0.00 0.02 0.00 0.00 55.97 55.52 1ikw s LYS 287 Cb -0.10 -2.14 -0.13 0.00 -0.52 0.00 0.00 37.83 34.94 1ikw s LYS 287 CO 0.08 0.55 1.03 0.00 -0.92 0.00 0.00 175.35 176.09 1ikw n ALA 288 N 1.91 0.01 0.29 5.17 0.00 -1.26 -4.84 120.51 121.79 1ikw n ALA 288 Ca -0.16 0.34 0.18 0.00 0.00 0.00 0.00 53.44 53.80 1ikw n ALA 288 Cb 0.52 -2.05 0.86 0.00 0.00 0.00 0.00 19.45 18.77 1ikw n ALA 288 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1ikw h LEU 289 N 1.92 0.00 -2.27 0.00 5.85 -1.98 -1.75 115.31 117.08 1ikw h LEU 289 Ca -0.41 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.31 1ikw h LEU 289 Cb 1.33 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.36 1ikw h LEU 289 CO 0.60 0.04 0.00 0.35 -0.34 0.00 0.00 178.44 179.09 1ikw n THR 290 N -3.25 0.47 -2.64 1.05 -2.24 -1.26 -1.55 114.28 104.86 1ikw n THR 290 Ca -0.01 -0.73 -0.41 0.00 -2.27 0.00 0.00 64.05 60.62 1ikw n THR 290 Cb 0.22 1.00 -0.04 0.00 -2.10 0.00 0.00 70.33 69.41 1ikw n THR 290 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1ikw s GLU 291 N -1.41 4.62 0.16 -0.78 2.12 -0.66 -4.78 118.70 117.97 1ikw s GLU 291 Ca 0.34 1.55 -0.30 0.00 0.36 0.00 0.00 54.97 56.92 1ikw s GLU 291 Cb 0.20 -3.36 -0.07 0.00 0.26 0.00 0.00 34.13 31.16 1ikw s GLU 291 CO 0.28 0.07 0.94 0.08 -0.54 0.00 0.00 175.26 176.10 1ikw s VAL 292 N 0.26 4.34 -0.10 3.70 1.01 -1.26 -0.28 120.40 128.06 1ikw s VAL 292 Ca 0.50 2.06 0.03 0.00 0.00 0.00 0.00 61.98 64.57 1ikw s VAL 292 Cb -0.25 -4.32 0.01 0.00 0.00 0.00 0.00 36.38 31.82 1ikw s VAL 292 CO 0.31 0.39 -0.18 -0.63 0.00 0.00 0.00 175.10 174.99 1ikw s ILE 293 N -0.49 1.62 0.26 2.22 1.01 0.78 -4.92 121.20 121.69 1ikw s ILE 293 Ca 0.44 -0.75 -0.30 0.00 0.00 0.00 0.00 60.65 60.05 1ikw s ILE 293 Cb -0.24 -1.45 -0.09 0.00 0.01 0.00 0.00 42.46 40.69 1ikw s ILE 293 CO 0.30 0.46 1.04 -2.84 0.00 0.00 0.00 174.94 173.90 1ikw s PRO 294 N 0.68 4.73 -0.24 2.79 0.02 -1.26 -4.20 135.00 137.51 1ikw s PRO 294 Ca -0.13 1.68 -0.27 0.00 0.02 0.00 0.00 61.00 62.30 1ikw s PRO 294 Cb -0.16 -3.23 0.00 0.00 0.02 0.00 0.00 34.50 31.14 1ikw s PRO 294 CO 0.03 0.33 0.94 -0.51 -0.33 0.00 0.00 177.00 177.47 1ikw s LEU 295 N -1.33 4.08 1.10 -5.54 1.02 -1.26 -5.03 118.68 111.72 1ikw s LEU 295 Ca 0.43 1.19 -0.12 0.00 0.02 0.00 0.00 54.13 55.65 1ikw s LEU 295 Cb -0.30 -3.37 0.25 0.00 0.02 0.00 0.00 46.19 42.79 1ikw s LEU 295 CO 0.37 -0.61 1.05 0.42 0.02 0.00 0.00 176.35 177.61 1ikw s THR 296 N 3.06 2.08 0.10 5.49 -4.23 -1.26 -4.66 115.64 116.22 1ikw s THR 296 Ca 0.40 0.03 -0.30 0.00 -1.18 0.00 0.00 61.69 60.63 1ikw s THR 296 Cb -0.15 -2.17 -0.11 0.00 1.34 0.00 0.00 72.50 71.41 1ikw s THR 296 CO 0.07 -0.03 1.61 -0.33 -0.54 0.00 0.00 174.62 175.40 1ikw h GLU 297 N -2.37 -0.62 -0.35 3.99 4.39 -2.00 -0.87 114.58 116.75 1ikw h GLU 297 Ca -0.58 0.04 0.07 0.00 0.34 0.00 0.00 59.36 59.23 1ikw h GLU 297 Cb 1.32 0.14 -0.09 0.00 -0.10 0.00 0.00 28.75 30.03 1ikw h GLU 297 CO 0.51 -0.41 -0.40 0.93 -1.16 0.00 0.00 179.01 178.47 1ikw h GLU 298 N -0.65 -0.33 -0.21 2.33 3.07 -1.99 -2.25 114.58 114.55 1ikw h GLU 298 Ca 0.00 0.02 0.05 0.00 -0.50 0.00 0.00 59.36 58.93 1ikw h GLU 298 Cb 0.62 0.07 -0.05 0.00 -0.84 0.00 0.00 28.75 28.56 1ikw h GLU 298 CO -0.12 -0.22 -0.09 0.00 -1.40 0.00 0.00 179.01 177.17 1ikw h ALA 299 N 0.44 0.09 -0.96 3.43 0.00 -1.80 -0.83 119.26 119.62 1ikw h ALA 299 Ca 0.13 0.08 0.24 0.00 0.00 0.00 0.00 54.91 55.37 1ikw h ALA 299 Cb 0.58 0.23 -0.13 0.00 0.00 0.00 0.00 17.79 18.48 1ikw h ALA 299 CO -0.53 -0.51 0.52 0.93 0.00 0.00 0.00 179.25 179.65 1ikw h GLU 300 N -0.06 0.49 -0.01 0.00 4.39 -0.58 0.14 114.58 118.94 1ikw h GLU 300 Ca 0.11 -0.03 -0.12 0.00 0.34 0.00 0.00 59.36 59.66 1ikw h GLU 300 Cb 0.23 -0.11 0.01 0.00 -0.10 0.00 0.00 28.75 28.78 1ikw h GLU 300 CO -0.26 0.32 -0.46 -0.07 -1.16 0.00 0.00 179.01 177.39 1ikw h LEU 301 N 0.50 0.43 -0.77 1.33 4.07 -1.00 -3.06 115.31 116.80 1ikw h LEU 301 Ca 0.62 -0.75 0.11 0.00 0.08 0.00 0.00 57.88 57.95 1ikw h LEU 301 Cb 1.19 -0.13 -0.08 0.00 1.08 0.00 0.00 40.66 42.72 1ikw h LEU 301 CO -0.50 1.11 0.39 -0.08 -1.08 0.00 0.00 178.44 178.28 1ikw h GLU 302 N -0.22 0.60 0.00 1.13 4.81 0.19 0.76 114.58 121.85 1ikw h GLU 302 Ca -0.05 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.12 1ikw h GLU 302 Cb 1.17 -0.14 -0.00 0.00 0.63 0.00 0.00 28.75 30.41 1ikw h GLU 302 CO 0.09 0.40 -0.11 1.25 -0.73 0.00 0.00 179.01 179.91 1ikw h LEU 303 N 0.62 0.00 0.36 1.64 5.85 -1.08 -1.69 115.31 121.00 1ikw h LEU 303 Ca 0.40 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 59.10 1ikw h LEU 303 Cb 0.48 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.51 1ikw h LEU 303 CO -0.31 0.11 -0.17 0.00 -0.34 0.00 0.00 178.44 177.73 1ikw h ALA 304 N 1.89 -0.48 -0.60 1.25 0.00 0.59 0.19 119.26 122.09 1ikw h ALA 304 Ca -0.00 -0.19 0.10 0.00 0.00 0.00 0.00 54.91 54.82 1ikw h ALA 304 Cb 0.23 0.19 -0.08 0.00 0.00 0.00 0.00 17.79 18.13 1ikw h ALA 304 CO 0.01 -0.55 0.19 0.93 0.00 0.00 0.00 179.25 179.84 1ikw h GLU 305 N -0.94 0.34 -0.12 0.00 5.08 -0.95 0.39 114.58 118.39 1ikw h GLU 305 Ca -0.05 -0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.30 1ikw h GLU 305 Cb 0.53 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 1ikw h GLU 305 CO 0.08 0.22 0.04 -0.91 -1.00 0.00 0.00 179.01 177.44 1ikw h ASN 306 N 0.35 0.04 -0.89 1.42 2.35 -1.30 0.27 115.58 117.82 1ikw h ASN 306 Ca 0.31 0.01 0.19 0.00 -0.55 0.00 0.00 56.30 56.26 1ikw h ASN 306 Cb 0.41 0.01 -0.11 0.00 0.05 0.00 0.00 38.32 38.68 1ikw h ASN 306 CO -0.34 0.04 0.44 0.03 -1.65 0.00 0.00 177.43 175.95 1ikw h ARG 307 N 0.09 0.52 0.65 0.81 2.47 0.15 -1.62 114.38 117.46 1ikw h ARG 307 Ca 0.05 -0.03 -0.03 0.00 -1.26 0.00 0.00 59.98 58.71 1ikw h ARG 307 Cb 0.03 -0.12 0.01 0.00 -1.65 0.00 0.00 29.97 28.24 1ikw h ARG 307 CO -0.05 0.34 -0.31 1.49 0.56 0.00 0.00 179.97 182.00 1ikw h GLU 308 N 0.53 -0.84 -0.84 0.04 4.57 0.86 -3.11 114.58 115.79 1ikw h GLU 308 Ca 0.52 0.06 0.18 0.00 -1.18 0.00 0.00 59.36 58.94 1ikw h GLU 308 Cb 0.88 0.19 -0.06 0.00 -0.16 0.00 0.00 28.75 29.60 1ikw h GLU 308 CO -0.44 -0.52 0.56 0.82 -1.18 0.00 0.00 179.01 178.25 1ikw h ILE 309 N -1.02 0.73 0.00 2.32 2.04 -0.29 -2.59 117.51 118.71 1ikw h ILE 309 Ca -0.09 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 65.62 1ikw h ILE 309 Cb 0.70 0.27 0.00 0.00 -0.74 0.00 0.00 36.82 37.05 1ikw h ILE 309 CO 0.15 0.08 -0.16 -0.07 0.00 0.00 0.00 178.15 178.14 1ikw h LEU 310 N 0.43 0.00 -0.48 1.44 3.38 -1.30 -3.37 115.31 115.42 1ikw h LEU 310 Ca 0.43 -0.03 0.03 0.00 0.09 0.00 0.00 57.88 58.40 1ikw h LEU 310 Cb 1.01 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.73 1ikw h LEU 310 CO -0.16 0.01 0.26 0.07 0.09 0.00 0.00 178.44 178.72 1ikw h LYS 311 N 0.00 0.50 -5.45 1.13 2.10 -1.39 -3.40 116.57 110.06 1ikw h LYS 311 Ca 0.00 -0.03 -0.60 0.00 -2.00 0.00 0.00 60.65 58.02 1ikw h LYS 311 Cb 0.84 -0.11 -0.11 0.00 -0.90 0.00 0.00 32.23 31.95 1ikw h LYS 311 CO 0.00 0.33 -0.27 -1.83 -2.00 0.00 0.00 179.45 175.68 1ikw s GLU 312 N -6.14 4.22 0.43 0.07 -1.05 -1.26 -5.04 118.70 109.92 1ikw s GLU 312 Ca -0.13 0.14 -0.26 0.00 -0.15 0.00 0.00 54.97 54.57 1ikw s GLU 312 Cb 0.13 -3.48 -0.09 0.00 -0.44 0.00 0.00 34.13 30.24 1ikw s GLU 312 CO 0.73 0.10 1.35 -2.30 0.95 0.00 0.00 175.26 176.09 1ikw n PRO 313 N 4.00 2.10 -4.56 -4.83 -0.02 -1.26 -5.01 135.00 125.42 1ikw n PRO 313 Ca -0.10 0.75 -0.23 0.00 -2.02 0.00 0.00 63.50 61.89 1ikw n PRO 313 Cb 0.52 -2.49 -0.16 0.00 -0.02 0.00 0.00 33.50 31.34 1ikw n PRO 313 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1ikw s VAL 314 N -1.19 1.05 0.22 -1.45 1.01 -1.26 -5.15 120.40 113.62 1ikw s VAL 314 Ca 0.61 -0.49 0.11 0.00 0.00 0.00 0.00 61.98 62.20 1ikw s VAL 314 Cb -0.48 -0.92 -0.05 0.00 0.00 0.00 0.00 36.38 34.93 1ikw s VAL 314 CO 0.58 0.32 -0.21 -1.00 0.00 0.00 0.00 175.10 174.78 1ikw s HIS 315 N 0.24 2.20 0.13 5.22 3.76 -1.26 -4.77 115.29 120.80 1ikw s HIS 315 Ca -0.05 -0.37 0.04 0.00 -0.15 0.00 0.00 55.06 54.53 1ikw s HIS 315 Cb -0.11 -1.04 -0.04 0.00 1.11 0.00 0.00 32.58 32.50 1ikw s HIS 315 CO 0.02 0.54 0.10 0.20 -0.85 0.00 0.00 174.74 174.74 1ikw s GLY 316 N -2.97 1.85 0.38 -2.22 0.00 0.14 -4.83 107.32 99.67 1ikw s GLY 316 Ca 0.23 -1.14 0.07 0.00 0.00 0.00 0.00 44.72 43.89 1ikw s GLY 316 CO 0.11 -1.13 0.49 0.54 0.00 0.00 0.00 173.10 173.11 1ikw s VAL 317 N -1.57 3.49 0.55 1.40 0.11 -0.57 -1.62 120.40 122.18 1ikw s VAL 317 Ca 0.30 -1.05 -0.04 0.00 -2.93 0.00 0.00 61.98 58.26 1ikw s VAL 317 Cb -0.11 -3.19 0.01 0.00 -1.53 0.00 0.00 36.38 31.56 1ikw s VAL 317 CO 0.22 -0.08 0.83 -0.31 -3.33 0.00 0.00 175.10 172.43 1ikw s TYR 318 N -2.28 3.21 0.12 1.54 4.12 -1.26 -4.56 117.35 118.24 1ikw s TYR 318 Ca 0.49 0.48 -0.30 0.00 0.02 0.00 0.00 57.07 57.76 1ikw s TYR 318 Cb -0.09 -2.63 -0.06 0.00 -1.52 0.00 0.00 41.96 37.66 1ikw s TYR 318 CO 0.31 -0.71 1.06 -0.47 0.02 0.00 0.00 175.55 175.76 1ikw s TYR 319 N -2.86 3.64 -0.35 2.71 5.04 -0.52 -4.84 117.35 120.18 1ikw s TYR 319 Ca 0.53 1.63 -0.00 0.00 -2.44 0.00 0.00 57.07 56.78 1ikw s TYR 319 Cb -0.10 -3.21 0.09 0.00 0.35 0.00 0.00 41.96 39.08 1ikw s TYR 319 CO 0.43 -0.40 0.09 0.34 -1.34 0.00 0.00 175.55 174.66 1ikw s ASP 320 N 0.20 4.97 0.58 4.32 3.68 -1.26 -4.23 116.67 124.93 1ikw s ASP 320 Ca 0.50 -1.83 0.29 0.00 2.13 0.00 0.00 52.55 53.64 1ikw s ASP 320 Cb -0.27 -1.72 1.48 0.00 -1.45 0.00 0.00 42.92 40.95 1ikw s ASP 320 CO 0.32 -0.40 1.91 -0.65 0.13 0.00 0.00 175.17 176.48 1ikw h PRO 321 N 7.89 0.00 0.00 4.34 0.11 -1.98 -1.58 132.00 140.78 1ikw h PRO 321 Ca -0.13 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.95 1ikw h PRO 321 Cb 1.04 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.15 1ikw h PRO 321 CO 0.59 0.00 -0.14 0.66 -0.21 0.00 0.00 178.00 178.90 1ikw h SER 322 N 0.00 0.00 -1.88 -2.05 4.64 -2.04 -3.45 113.55 108.76 1ikw h SER 322 Ca 0.24 0.00 -0.44 0.00 -0.47 0.00 0.00 61.79 61.12 1ikw h SER 322 Cb 1.21 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.31 1ikw h SER 322 CO -0.00 0.14 -0.32 -0.54 -0.87 0.00 0.00 176.83 175.24 1ikw s LYS 323 N -3.35 3.12 0.99 4.77 1.02 -0.60 -5.11 119.74 120.58 1ikw s LYS 323 Ca 0.04 -0.96 -0.17 0.00 0.02 0.00 0.00 55.97 54.90 1ikw s LYS 323 Cb 0.07 -2.80 0.23 0.00 -0.52 0.00 0.00 37.83 34.81 1ikw s LYS 323 CO 0.65 0.05 1.20 -0.25 -0.92 0.00 0.00 175.35 176.08 1ikw n ASP 324 N -1.67 -0.45 -4.11 2.83 10.43 -1.26 -4.94 116.55 117.38 1ikw n ASP 324 Ca -0.00 -1.37 -0.29 0.00 2.57 0.00 0.00 54.79 55.70 1ikw n ASP 324 Cb 0.58 -0.96 -0.17 0.00 1.84 0.00 0.00 41.12 42.41 1ikw n ASP 324 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 1ikw s LEU 325 N 0.00 1.86 -0.05 0.64 1.02 -1.26 -4.51 118.68 116.38 1ikw s LEU 325 Ca 0.70 -0.45 0.05 0.00 0.02 0.00 0.00 54.13 54.45 1ikw s LEU 325 Cb -0.03 -1.15 -0.02 0.00 0.02 0.00 0.00 46.19 45.01 1ikw s LEU 325 CO 0.50 0.08 -0.18 -0.63 0.02 0.00 0.00 176.35 176.14 1ikw s ILE 326 N 0.66 2.69 -0.10 -0.59 -1.09 0.58 -0.75 121.20 122.60 1ikw s ILE 326 Ca -0.13 -0.85 0.01 0.00 -2.23 0.00 0.00 60.65 57.44 1ikw s ILE 326 Cb -0.16 -2.03 0.02 0.00 -1.58 0.00 0.00 42.46 38.71 1ikw s ILE 326 CO 0.04 0.58 -0.10 0.00 -1.23 0.00 0.00 174.94 174.23 1ikw s ALA 327 N -0.51 1.32 -0.07 9.38 0.00 -0.08 -1.01 121.76 130.79 1ikw s ALA 327 Ca 0.07 -0.51 0.02 0.00 0.00 0.00 0.00 51.96 51.54 1ikw s ALA 327 Cb -0.11 -0.78 -0.02 0.00 0.00 0.00 0.00 23.12 22.20 1ikw s ALA 327 CO 0.01 -0.21 -0.13 -1.21 0.00 0.00 0.00 175.76 174.21 1ikw s GLU 328 N 1.30 2.78 -0.13 0.00 2.02 -0.37 -1.06 118.70 123.25 1ikw s GLU 328 Ca -0.02 -0.68 0.01 0.00 0.02 0.00 0.00 54.97 54.30 1ikw s GLU 328 Cb -0.14 -2.47 -0.00 0.00 0.10 0.00 0.00 34.13 31.62 1ikw s GLU 328 CO -0.04 0.51 -0.18 0.42 0.02 0.00 0.00 175.26 175.99 1ikw s ILE 329 N -0.42 2.56 0.19 -1.63 1.01 -1.15 -1.52 121.20 120.25 1ikw s ILE 329 Ca 0.05 -0.82 0.08 0.00 0.00 0.00 0.00 60.65 59.96 1ikw s ILE 329 Cb -0.12 -2.05 -0.04 0.00 0.01 0.00 0.00 42.46 40.26 1ikw s ILE 329 CO 0.02 0.53 -0.06 -1.10 0.00 0.00 0.00 174.94 174.34 1ikw s GLN 330 N 0.54 2.20 -0.35 2.79 1.11 -0.06 -4.15 119.66 121.73 1ikw s GLN 330 Ca -0.11 -1.23 -0.13 0.00 0.01 0.00 0.00 55.36 53.90 1ikw s GLN 330 Cb -0.16 -2.23 -0.01 0.00 -1.01 0.00 0.00 33.01 29.60 1ikw s GLN 330 CO 0.04 0.44 0.25 0.21 0.01 0.00 0.00 175.29 176.24 1ikw s LYS 331 N -2.94 3.38 0.00 2.91 2.20 -1.26 -1.92 119.74 122.11 1ikw s LYS 331 Ca 0.26 -0.73 0.00 0.00 -0.36 0.00 0.00 55.97 55.15 1ikw s LYS 331 Cb -0.09 -3.84 0.00 0.00 -1.51 0.00 0.00 37.83 32.40 1ikw s LYS 331 CO 0.17 -0.51 0.02 1.04 -0.36 0.00 0.00 175.35 175.71 1ikw n GLN 332 N 5.11 0.00 0.00 4.03 6.02 -0.81 -4.51 117.38 127.23 1ikw n GLN 332 Ca -0.12 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.87 1ikw n GLN 332 Cb 0.49 -0.38 0.00 0.00 1.02 0.00 0.00 30.24 31.37 1ikw n GLN 332 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1ikw n GLY 333 N 2.46 4.87 3.71 1.08 0.00 -1.25 -4.98 105.19 111.09 1ikw n GLY 333 Ca 0.00 -1.88 -0.42 0.00 0.00 0.00 0.00 46.02 43.72 1ikw n GLY 333 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1ikw s GLN 334 N 2.21 4.56 0.00 1.61 2.00 -1.26 -3.29 119.66 125.48 1ikw s GLN 334 Ca 0.00 1.35 0.00 0.00 -2.00 0.00 0.00 55.36 54.71 1ikw s GLN 334 Cb 0.00 -3.45 0.00 0.00 0.80 0.00 0.00 33.01 30.36 1ikw s GLN 334 CO 0.00 -0.00 0.00 0.41 -0.50 0.00 0.00 175.29 175.20 1ikw n GLY 335 N 2.84 0.38 3.51 2.59 0.00 -1.26 -4.98 105.19 108.28 1ikw n GLY 335 Ca 0.05 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.73 1ikw n GLY 335 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ikw s GLN 336 N -0.72 3.11 -0.01 1.61 -0.21 -1.21 -4.19 119.66 118.04 1ikw s GLN 336 Ca 0.00 -0.58 0.01 0.00 0.02 0.00 0.00 55.36 54.81 1ikw s GLN 336 Cb 0.00 -2.68 0.01 0.00 1.00 0.00 0.00 33.01 31.34 1ikw s GLN 336 CO 0.00 0.46 -0.02 -1.58 -2.12 0.00 0.00 175.29 172.03 1ikw s TRP 337 N -0.26 0.28 0.28 0.91 0.52 0.36 -1.92 118.94 119.11 1ikw s TRP 337 Ca 0.03 -0.03 0.12 0.00 0.02 0.00 0.00 56.10 56.24 1ikw s TRP 337 Cb -0.13 -0.26 -0.05 0.00 -1.15 0.00 0.00 33.47 31.88 1ikw s TRP 337 CO 0.03 -0.06 -0.17 -0.08 0.02 0.00 0.00 176.95 176.69 1ikw s THR 338 N 0.38 2.63 0.14 2.01 -1.32 -0.81 0.18 115.64 118.84 1ikw s THR 338 Ca -0.04 -2.33 -0.17 0.00 -1.21 0.00 0.00 61.69 57.94 1ikw s THR 338 Cb -0.06 -2.39 0.04 0.00 -1.51 0.00 0.00 72.50 68.58 1ikw s THR 338 CO -0.01 -0.40 0.45 -0.72 -2.21 0.00 0.00 174.62 171.73 1ikw s TYR 339 N -2.48 -0.25 0.04 9.09 1.13 -0.58 -0.88 117.35 123.41 1ikw s TYR 339 Ca 0.30 -0.05 0.03 0.00 -1.41 0.00 0.00 57.07 55.94 1ikw s TYR 339 Cb -0.05 0.32 -0.02 0.00 -1.10 0.00 0.00 41.96 41.11 1ikw s TYR 339 CO 0.16 -0.75 -0.08 -0.65 -2.51 0.00 0.00 175.55 171.72 1ikw s GLN 340 N -3.80 0.56 -0.11 -3.49 1.11 -0.57 -2.57 119.66 110.80 1ikw s GLN 340 Ca 0.03 -0.68 0.01 0.00 0.01 0.00 0.00 55.36 54.74 1ikw s GLN 340 Cb 0.01 -0.40 0.02 0.00 -1.01 0.00 0.00 33.01 31.62 1ikw s GLN 340 CO -0.11 0.08 -0.14 0.42 0.01 0.00 0.00 175.29 175.55 1ikw s ILE 341 N -1.12 1.42 0.28 1.08 1.01 -0.78 -1.24 121.20 121.85 1ikw s ILE 341 Ca -0.06 -0.59 -0.03 0.00 0.00 0.00 0.00 60.65 59.97 1ikw s ILE 341 Cb -0.09 -1.31 -0.02 0.00 0.01 0.00 0.00 42.46 41.05 1ikw s ILE 341 CO 0.01 0.43 0.34 -0.72 0.00 0.00 0.00 174.94 175.00 1ikw s TYR 342 N 1.05 1.05 -0.03 3.97 -0.85 -0.18 0.36 117.35 122.73 1ikw s TYR 342 Ca -0.06 -1.26 0.00 0.00 -0.52 0.00 0.00 57.07 55.24 1ikw s TYR 342 Cb -0.15 -0.27 -0.02 0.00 0.38 0.00 0.00 41.96 41.91 1ikw s TYR 342 CO -0.02 -0.92 -0.02 1.04 -1.52 0.00 0.00 175.55 174.11 1ikw n GLN 343 N -0.45 0.06 -4.01 -3.49 6.02 -1.26 -0.30 117.38 113.95 1ikw n GLN 343 Ca 0.02 0.02 -0.35 0.00 -0.01 0.00 0.00 57.00 56.68 1ikw n GLN 343 Cb 0.63 -1.02 -0.14 0.00 1.02 0.00 0.00 30.24 30.73 1ikw n GLN 343 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 1ikw s GLU 344 N -2.05 3.35 -0.13 -1.09 2.12 -1.26 -4.85 118.70 114.79 1ikw s GLU 344 Ca -0.04 -0.65 -0.07 0.00 0.36 0.00 0.00 54.97 54.58 1ikw s GLU 344 Cb 0.01 -2.93 -0.04 0.00 0.26 0.00 0.00 34.13 31.43 1ikw s GLU 344 CO 0.06 -0.15 0.43 -2.30 -0.54 0.00 0.00 175.26 172.75 1ikw n PRO 345 N 4.64 0.00 -0.98 4.30 -0.02 -1.26 -0.73 135.00 140.96 1ikw n PRO 345 Ca -0.18 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.30 1ikw n PRO 345 Cb 0.51 -0.27 0.00 0.00 -0.02 0.00 0.00 33.50 33.72 1ikw n PRO 345 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1ikw n PHE 346 N 1.58 0.00 -3.40 6.00 0.99 -1.26 -4.96 117.46 116.41 1ikw n PHE 346 Ca 0.11 0.00 -0.44 0.00 -0.00 0.00 0.00 57.45 57.12 1ikw n PHE 346 Cb -0.00 -0.40 -0.02 0.00 -1.00 0.00 0.00 39.48 38.05 1ikw n PHE 346 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 176.76 176.91 1ikw s LYS 347 N -0.38 3.70 0.37 -1.08 1.02 0.09 -5.03 119.74 118.44 1ikw s LYS 347 Ca 0.00 -2.84 -0.27 0.00 0.02 0.00 0.00 55.97 52.88 1ikw s LYS 347 Cb 0.00 -4.36 -0.12 0.00 -0.52 0.00 0.00 37.83 32.83 1ikw s LYS 347 CO 0.00 -1.26 1.26 0.09 -0.92 0.00 0.00 175.35 174.52 1ikw n ASN 348 N 3.27 2.56 -0.09 2.83 3.02 -1.26 -4.20 115.26 121.40 1ikw n ASN 348 Ca 0.18 1.17 -0.23 0.00 -0.03 0.00 0.00 54.58 55.67 1ikw n ASN 348 Cb 0.42 -1.47 -0.12 0.00 -0.61 0.00 0.00 39.78 38.00 1ikw n ASN 348 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1ikw n LEU 349 N 0.61 2.24 -3.78 3.41 4.77 0.16 -1.51 117.00 122.89 1ikw n LEU 349 Ca 0.06 0.27 -0.10 0.00 -0.03 0.00 0.00 56.01 56.21 1ikw n LEU 349 Cb 0.37 -0.97 -0.05 0.00 -2.33 0.00 0.00 43.42 40.44 1ikw n LEU 349 CO 0.61 0.59 0.12 -0.75 -1.33 0.00 0.00 177.39 176.62 1ikw s LYS 350 N -2.47 1.17 0.41 3.23 2.20 -1.17 -4.42 119.74 118.69 1ikw s LYS 350 Ca -0.30 -0.92 0.04 0.00 -0.36 0.00 0.00 55.97 54.43 1ikw s LYS 350 Cb 0.09 0.45 -0.02 0.00 -1.51 0.00 0.00 37.83 36.83 1ikw s LYS 350 CO 0.62 -0.46 0.16 0.99 -0.36 0.00 0.00 175.35 176.30 1ikw s THR 351 N -3.88 0.47 0.00 3.43 2.01 0.46 -1.87 115.64 116.26 1ikw s THR 351 Ca 0.09 -2.00 0.00 0.00 0.31 0.00 0.00 61.69 60.09 1ikw s THR 351 Cb 0.02 -2.33 0.00 0.00 0.01 0.00 0.00 72.50 70.19 1ikw s THR 351 CO -0.06 0.00 0.00 0.61 -0.69 0.00 0.00 174.62 174.48 1ikw n GLY 352 N -0.90 0.29 3.17 4.40 0.00 -1.06 -4.47 105.19 106.62 1ikw n GLY 352 Ca -0.04 -1.03 -0.11 0.00 0.00 0.00 0.00 46.02 44.83 1ikw n GLY 352 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ikw s LYS 353 N -2.00 0.61 -0.04 1.61 -2.85 -1.26 -1.52 119.74 114.28 1ikw s LYS 353 Ca 0.00 -0.43 0.03 0.00 -1.00 0.00 0.00 55.97 54.57 1ikw s LYS 353 Cb 0.00 0.26 0.00 0.00 -2.06 0.00 0.00 37.83 36.03 1ikw s LYS 353 CO 0.00 -0.16 -0.13 -0.47 0.10 0.00 0.00 175.35 174.69 1ikw s TYR 354 N -1.80 1.37 0.00 1.78 5.04 0.46 -4.97 117.35 119.24 1ikw s TYR 354 Ca -0.11 -0.41 0.00 0.00 -2.44 0.00 0.00 57.07 54.11 1ikw s TYR 354 Cb -0.05 -0.96 0.00 0.00 0.35 0.00 0.00 41.96 41.30 1ikw s TYR 354 CO 0.00 -0.17 0.00 0.00 -1.34 0.00 0.00 175.55 174.04 1ikw n ALA 355 N 3.40 0.00 -0.98 3.97 0.00 -1.26 0.14 120.51 125.78 1ikw n ALA 355 Ca -0.20 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 52.88 1ikw n ALA 355 Cb 0.53 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.94 1ikw n ALA 355 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1ikw n ARG 356 N 0.00 0.00 0.03 0.00 0.63 -1.26 -4.74 116.66 111.32 1ikw n ARG 356 Ca 0.00 0.00 -0.02 0.00 -0.92 0.00 0.00 57.85 56.91 1ikw n ARG 356 Cb 0.00 -0.85 -0.01 0.00 0.45 0.00 0.00 32.46 32.05 1ikw n ARG 356 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1ikw h MET 357 N 1.37 -0.14 -2.85 -0.14 -0.00 -1.99 -3.50 114.93 107.69 1ikw h MET 357 Ca -0.27 0.01 0.00 0.00 -0.00 0.00 0.00 59.70 59.44 1ikw h MET 357 Cb 0.96 0.03 0.00 0.00 -0.00 0.00 0.00 31.60 32.60 1ikw h MET 357 CO 0.41 -0.09 0.00 -2.13 -0.00 0.00 0.00 176.91 175.10 1ikw n ARG 358 N -3.89 0.00 0.00 -0.10 3.00 -1.26 -4.96 116.66 109.44 1ikw n ARG 358 Ca -0.02 0.01 0.00 0.00 -0.00 0.00 0.00 57.85 57.84 1ikw n ARG 358 Cb 0.06 -1.42 0.00 0.00 0.00 0.00 0.00 32.46 31.09 1ikw n ARG 358 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1ikw n GLY 359 N -1.42 -1.04 3.90 5.14 0.00 -1.26 -4.95 105.19 105.56 1ikw n GLY 359 Ca 0.00 -1.64 -0.30 0.00 0.00 0.00 0.00 46.02 44.08 1ikw n GLY 359 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ikw s ALA 360 N -1.64 3.65 -0.16 4.61 0.00 -1.26 -4.77 121.76 122.19 1ikw s ALA 360 Ca 0.00 -0.50 -0.05 0.00 0.00 0.00 0.00 51.96 51.41 1ikw s ALA 360 Cb 0.00 -2.29 0.02 0.00 0.00 0.00 0.00 23.12 20.85 1ikw s ALA 360 CO 0.00 0.40 0.11 0.72 0.00 0.00 0.00 175.76 176.99 1ikw n HIS 361 N -0.53 -2.97 -3.74 0.00 8.25 -1.25 -4.92 115.22 110.06 1ikw n HIS 361 Ca -0.01 1.59 -0.10 0.00 -0.26 0.00 0.00 57.72 58.94 1ikw n HIS 361 Cb 0.53 -3.20 -0.06 0.00 1.12 0.00 0.00 29.99 28.39 1ikw n HIS 361 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 1ikw s THR 362 N -0.71 0.10 0.12 1.59 -1.32 -0.88 -4.95 115.64 109.58 1ikw s THR 362 Ca -0.13 -0.86 0.06 0.00 -1.21 0.00 0.00 61.69 59.55 1ikw s THR 362 Cb 0.01 -1.27 -0.04 0.00 -1.51 0.00 0.00 72.50 69.69 1ikw s THR 362 CO 0.55 -0.45 -0.14 0.54 -2.21 0.00 0.00 174.62 172.91 1ikw s ASN 363 N -2.83 1.92 0.33 8.08 2.20 -1.26 -2.92 114.94 120.45 1ikw s ASN 363 Ca 0.04 -0.80 0.10 0.00 -0.94 0.00 0.00 52.86 51.27 1ikw s ASN 363 Cb 0.03 -0.06 0.98 0.00 -2.00 0.00 0.00 41.25 40.20 1ikw s ASN 363 CO -0.11 -0.15 1.62 0.44 -2.94 0.00 0.00 177.10 175.96 1ikw h ASP 364 N 3.57 0.15 -0.46 3.54 5.19 -1.93 0.39 116.42 126.87 1ikw h ASP 364 Ca -0.40 0.22 -0.01 0.00 -0.62 0.00 0.00 57.03 56.22 1ikw h ASP 364 Cb 1.19 0.27 -0.02 0.00 0.18 0.00 0.00 39.33 40.95 1ikw h ASP 364 CO 0.50 -0.25 0.25 0.58 -3.12 0.00 0.00 179.24 177.20 1ikw h VAL 365 N 0.16 1.16 -0.21 -1.35 2.07 -1.96 0.78 116.25 116.91 1ikw h VAL 365 Ca 0.69 -0.45 -0.20 0.00 0.82 0.00 0.00 66.70 67.56 1ikw h VAL 365 Cb 1.57 0.52 0.00 0.00 -1.52 0.00 0.00 31.29 31.87 1ikw h VAL 365 CO -0.71 0.19 -0.65 0.50 0.02 0.00 0.00 177.57 176.91 1ikw h LYS 366 N 0.69 0.76 -0.22 1.57 3.64 -0.68 -2.49 116.57 119.84 1ikw h LYS 366 Ca 0.17 -0.54 -0.13 0.00 -1.27 0.00 0.00 60.65 58.88 1ikw h LYS 366 Cb 0.06 0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 31.97 1ikw h LYS 366 CO -0.03 1.16 -0.36 1.96 -2.27 0.00 0.00 179.45 179.92 1ikw h GLN 367 N 0.56 0.64 -0.87 1.90 4.20 -0.85 -2.12 115.11 118.57 1ikw h GLN 367 Ca -0.02 -0.39 0.07 0.00 0.06 0.00 0.00 58.65 58.38 1ikw h GLN 367 Cb 1.26 0.04 -0.06 0.00 0.30 0.00 0.00 27.48 29.01 1ikw h GLN 367 CO 0.13 1.00 0.53 1.25 -0.67 0.00 0.00 178.83 181.08 1ikw h LEU 368 N 0.33 0.83 -0.64 1.46 5.85 -0.88 0.79 115.31 123.04 1ikw h LEU 368 Ca 0.02 0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.79 1ikw h LEU 368 Cb 0.95 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 41.79 1ikw h LEU 368 CO 0.08 0.52 0.40 0.74 -0.34 0.00 0.00 178.44 179.84 1ikw h THR 369 N 0.95 1.10 -0.53 1.05 2.02 -1.25 -0.85 112.91 115.40 1ikw h THR 369 Ca 0.39 -0.27 -0.03 0.00 0.77 0.00 0.00 66.41 67.26 1ikw h THR 369 Cb 0.21 0.23 -0.02 0.00 -1.74 0.00 0.00 68.15 66.83 1ikw h THR 369 CO -0.19 0.15 0.21 -0.33 0.37 0.00 0.00 175.52 175.72 1ikw h GLU 370 N 0.80 0.79 -0.72 6.66 5.08 -0.40 -1.47 114.58 125.31 1ikw h GLU 370 Ca 0.25 -0.15 -0.02 0.00 -1.00 0.00 0.00 59.36 58.45 1ikw h GLU 370 Cb -0.00 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.09 1ikw h GLU 370 CO -0.10 0.70 0.36 0.00 -1.00 0.00 0.00 179.01 178.98 1ikw h ALA 371 N 1.05 0.93 -0.95 3.43 0.00 -0.54 -0.92 119.26 122.26 1ikw h ALA 371 Ca 0.18 -0.14 0.04 0.00 0.00 0.00 0.00 54.91 54.98 1ikw h ALA 371 Cb 0.21 -0.29 -0.06 0.00 0.00 0.00 0.00 17.79 17.65 1ikw h ALA 371 CO -0.01 0.48 0.62 0.28 0.00 0.00 0.00 179.25 180.61 1ikw h VAL 372 N 1.01 1.16 0.08 0.00 2.07 -0.78 0.41 116.25 120.20 1ikw h VAL 372 Ca 0.25 -0.41 -0.00 0.00 0.82 0.00 0.00 66.70 67.35 1ikw h VAL 372 Cb 0.09 -0.14 0.00 0.00 -1.52 0.00 0.00 31.29 29.72 1ikw h VAL 372 CO -0.03 0.22 -0.04 1.56 0.02 0.00 0.00 177.57 179.29 1ikw h GLN 373 N 1.20 -0.11 0.41 1.57 1.08 -0.47 -0.51 115.11 118.28 1ikw h GLN 373 Ca 0.38 0.01 -0.01 0.00 -1.45 0.00 0.00 58.65 57.58 1ikw h GLN 373 Cb 0.00 0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 27.44 1ikw h GLN 373 CO -0.12 0.08 -0.33 -0.22 -0.95 0.00 0.00 178.83 177.28 1ikw h LYS 374 N -0.28 -0.71 -0.87 1.46 3.64 -0.93 -0.25 116.57 118.63 1ikw h LYS 374 Ca -0.01 0.05 0.14 0.00 -1.27 0.00 0.00 60.65 59.56 1ikw h LYS 374 Cb 0.24 0.16 -0.07 0.00 -0.41 0.00 0.00 32.23 32.15 1ikw h LYS 374 CO 0.02 -0.47 0.56 0.82 -2.27 0.00 0.00 179.45 178.11 1ikw h ILE 375 N -0.74 0.84 0.10 2.00 2.04 -0.91 -0.23 117.51 120.60 1ikw h ILE 375 Ca -0.04 -0.23 -0.00 0.00 1.00 0.00 0.00 64.86 65.59 1ikw h ILE 375 Cb 0.64 0.11 0.00 0.00 -0.74 0.00 0.00 36.82 36.84 1ikw h ILE 375 CO -0.02 0.12 -0.05 0.74 0.00 0.00 0.00 178.15 178.95 1ikw h THR 376 N 0.66 1.04 -0.27 -0.27 2.02 -0.42 0.11 112.91 115.78 1ikw h THR 376 Ca 0.43 -0.50 0.03 0.00 0.77 0.00 0.00 66.41 67.14 1ikw h THR 376 Cb 0.72 1.36 -0.03 0.00 -1.74 0.00 0.00 68.15 68.46 1ikw h THR 376 CO -0.19 0.12 0.08 0.74 0.37 0.00 0.00 175.52 176.64 1ikw h THR 377 N -0.36 0.91 -0.91 3.16 2.02 -0.27 -1.57 112.91 115.90 1ikw h THR 377 Ca -0.01 -0.07 0.01 0.00 0.77 0.00 0.00 66.41 67.11 1ikw h THR 377 Cb 0.30 0.70 -0.04 0.00 -1.74 0.00 0.00 68.15 67.37 1ikw h THR 377 CO 0.02 0.04 0.60 -0.08 0.37 0.00 0.00 175.52 176.46 1ikw h GLU 378 N 0.19 1.20 -0.26 6.66 4.81 -1.01 -1.92 114.58 124.26 1ikw h GLU 378 Ca 0.12 -0.08 -0.04 0.00 -0.13 0.00 0.00 59.36 59.23 1ikw h GLU 378 Cb 0.10 -0.27 -0.01 0.00 0.63 0.00 0.00 28.75 29.20 1ikw h GLU 378 CO -0.13 0.80 -0.03 1.03 -0.73 0.00 0.00 179.01 179.95 1ikw h SER 379 N 1.24 0.37 -0.07 1.04 0.87 -0.20 -2.38 113.55 114.42 1ikw h SER 379 Ca 0.33 -0.06 -0.05 0.00 -1.23 0.00 0.00 61.79 60.78 1ikw h SER 379 Cb -0.13 -0.10 0.00 0.00 -0.44 0.00 0.00 62.40 61.73 1ikw h SER 379 CO -0.07 0.46 -0.14 0.40 -0.53 0.00 0.00 176.83 176.95 1ikw h ILE 380 N 0.38 1.42 -0.38 2.23 2.04 -0.52 -0.95 117.51 121.72 1ikw h ILE 380 Ca 0.08 -1.45 0.06 0.00 1.00 0.00 0.00 64.86 64.55 1ikw h ILE 380 Cb 0.31 2.21 -0.05 0.00 -0.74 0.00 0.00 36.82 38.55 1ikw h ILE 380 CO 0.01 0.41 0.08 0.58 0.00 0.00 0.00 178.15 179.22 1ikw h VAL 381 N -0.28 0.81 0.01 1.67 2.07 -1.33 0.45 116.25 119.65 1ikw h VAL 381 Ca 0.00 -0.07 -0.00 0.00 0.82 0.00 0.00 66.70 67.45 1ikw h VAL 381 Cb 0.72 0.59 0.00 0.00 -1.52 0.00 0.00 31.29 31.08 1ikw h VAL 381 CO 0.03 0.04 -0.00 0.40 0.02 0.00 0.00 177.57 178.05 1ikw h ILE 382 N 0.20 1.57 0.00 4.57 2.04 -1.47 -3.41 117.51 121.02 1ikw h ILE 382 Ca 0.18 -1.76 0.00 0.00 1.00 0.00 0.00 64.86 64.28 1ikw h ILE 382 Cb 0.21 2.75 0.00 0.00 -0.74 0.00 0.00 36.82 39.05 1ikw h ILE 382 CO -0.24 0.45 -0.63 0.79 0.00 0.00 0.00 178.15 178.52 1ikw n TRP 383 N -4.73 0.00 -0.87 1.37 8.01 -0.37 -4.70 117.44 116.15 1ikw n TRP 383 Ca -0.09 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.10 1ikw n TRP 383 Cb 0.37 -0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.66 1ikw n TRP 383 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1ikw n GLY 384 N 1.31 0.81 3.32 6.99 0.00 0.15 -5.00 105.19 112.76 1ikw n GLY 384 Ca 0.02 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.92 1ikw n GLY 384 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ikw s LYS 385 N -0.13 0.94 0.26 1.61 -2.85 -1.26 -4.96 119.74 113.37 1ikw s LYS 385 Ca 0.00 -0.44 -0.20 0.00 -1.00 0.00 0.00 55.97 54.32 1ikw s LYS 385 Cb 0.00 0.42 -0.09 0.00 -2.06 0.00 0.00 37.83 36.10 1ikw s LYS 385 CO 0.00 -0.33 0.78 0.95 0.10 0.00 0.00 175.35 176.84 1ikw s THR 386 N -2.76 4.51 0.71 3.79 -4.23 -1.26 -4.12 115.64 112.28 1ikw s THR 386 Ca -0.03 1.34 -0.03 0.00 -1.18 0.00 0.00 61.69 61.79 1ikw s THR 386 Cb -0.00 -3.84 0.11 0.00 1.34 0.00 0.00 72.50 70.11 1ikw s THR 386 CO -0.04 0.11 0.99 -2.16 -0.54 0.00 0.00 174.62 172.98 1ikw s PRO 387 N -2.20 1.80 -0.02 3.99 0.04 -1.26 -4.86 135.00 132.49 1ikw s PRO 387 Ca 0.47 -0.84 -0.14 0.00 0.04 0.00 0.00 61.00 60.52 1ikw s PRO 387 Cb -0.16 -2.28 -0.05 0.00 0.04 0.00 0.00 34.50 32.05 1ikw s PRO 387 CO 0.21 -1.39 0.39 0.15 0.04 0.00 0.00 177.00 176.40 1ikw s LYS 388 N -5.17 3.92 -0.00 4.56 1.02 0.07 -4.74 119.74 119.40 1ikw s LYS 388 Ca 0.65 0.37 -0.00 0.00 0.02 0.00 0.00 55.97 57.00 1ikw s LYS 388 Cb -0.07 -3.24 -0.04 0.00 -0.52 0.00 0.00 37.83 33.97 1ikw s LYS 388 CO 0.44 0.65 0.08 -0.06 -0.92 0.00 0.00 175.35 175.55 1ikw s PHE 389 N -0.94 3.29 -0.35 3.18 0.08 -0.61 -0.90 117.98 121.74 1ikw s PHE 389 Ca 0.23 0.21 0.04 0.00 0.12 0.00 0.00 56.93 57.53 1ikw s PHE 389 Cb -0.16 -1.74 0.10 0.00 -0.57 0.00 0.00 43.02 40.65 1ikw s PHE 389 CO 0.12 0.55 0.06 0.15 -0.10 0.00 0.00 175.22 176.01 1ikw s LYS 390 N -1.73 1.45 0.07 0.44 1.02 -0.22 -0.30 119.74 120.46 1ikw s LYS 390 Ca 0.23 -1.86 0.02 0.00 0.02 0.00 0.00 55.97 54.38 1ikw s LYS 390 Cb -0.12 -3.13 -0.04 0.00 -0.52 0.00 0.00 37.83 34.02 1ikw s LYS 390 CO 0.14 -0.95 0.13 -0.51 -0.92 0.00 0.00 175.35 173.24 1ikw s LEU 391 N 0.90 4.03 -0.65 3.17 1.43 0.45 -2.93 118.68 125.07 1ikw s LEU 391 Ca 0.11 0.11 -0.04 0.00 -1.03 0.00 0.00 54.13 53.28 1ikw s LEU 391 Cb -0.19 -2.65 0.06 0.00 0.03 0.00 0.00 46.19 43.43 1ikw s LEU 391 CO -0.09 0.18 2.72 -0.81 0.23 0.00 0.00 176.35 178.58 1ikw n PRO 392 N 0.44 2.93 -4.05 1.29 -0.04 -1.26 -1.41 135.00 132.90 1ikw n PRO 392 Ca -0.07 -2.55 -0.13 0.00 -0.04 0.00 0.00 63.50 60.70 1ikw n PRO 392 Cb 0.51 -2.26 -0.13 0.00 -0.04 0.00 0.00 33.50 31.58 1ikw n PRO 392 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 1ikw s ILE 393 N -1.79 0.31 0.28 0.52 2.07 -1.26 -0.64 121.20 120.68 1ikw s ILE 393 Ca 0.58 -0.48 -0.29 0.00 -1.41 0.00 0.00 60.65 59.04 1ikw s ILE 393 Cb 0.33 -0.33 -0.10 0.00 0.13 0.00 0.00 42.46 42.50 1ikw s ILE 393 CO -0.18 -0.12 1.10 -1.10 -1.91 0.00 0.00 174.94 172.73 1ikw s GLN 394 N -0.65 4.65 0.59 3.50 -1.52 -1.26 -4.52 119.66 120.45 1ikw s GLN 394 Ca -0.04 1.80 0.29 0.00 -1.95 0.00 0.00 55.36 55.46 1ikw s GLN 394 Cb -0.05 -3.19 1.69 0.00 -0.22 0.00 0.00 33.01 31.25 1ikw s GLN 394 CO -0.00 0.22 2.13 0.87 -0.25 0.00 0.00 175.29 178.26 1ikw h LYS 395 N 3.82 0.00 0.29 2.91 1.79 -1.98 -1.47 116.57 121.93 1ikw h LYS 395 Ca -0.47 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 57.99 1ikw h LYS 395 Cb 1.21 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.86 1ikw h LYS 395 CO 0.67 0.00 -0.14 0.93 -1.08 0.00 0.00 179.45 179.83 1ikw h GLU 396 N 0.00 -0.37 -0.89 3.15 3.07 -1.99 -1.99 114.58 115.56 1ikw h GLU 396 Ca 0.07 0.03 0.24 0.00 -0.50 0.00 0.00 59.36 59.19 1ikw h GLU 396 Cb 0.39 0.08 -0.14 0.00 -0.84 0.00 0.00 28.75 28.24 1ikw h GLU 396 CO -0.00 -0.25 0.26 1.15 -1.40 0.00 0.00 179.01 178.77 1ikw h THR 397 N -0.60 0.32 0.20 1.13 2.02 -1.73 -1.63 112.91 112.62 1ikw h THR 397 Ca -0.04 -0.08 -0.01 0.00 0.77 0.00 0.00 66.41 67.05 1ikw h THR 397 Cb 0.30 0.08 0.00 0.00 -1.74 0.00 0.00 68.15 66.79 1ikw h THR 397 CO 0.07 0.04 -0.10 -0.25 0.37 0.00 0.00 175.52 175.65 1ikw h TRP 398 N 0.23 -0.25 -0.59 3.16 2.91 -1.37 -2.35 115.95 117.68 1ikw h TRP 398 Ca 0.56 -0.01 0.08 0.00 1.13 0.00 0.00 58.89 60.66 1ikw h TRP 398 Cb 1.14 0.08 -0.07 0.00 -0.51 0.00 0.00 29.16 29.81 1ikw h TRP 398 CO -0.24 0.04 0.24 1.49 -1.03 0.00 0.00 178.44 178.94 1ikw h GLU 399 N -0.53 0.43 -0.03 2.65 4.81 -0.54 -0.34 114.58 121.03 1ikw h GLU 399 Ca -0.03 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.17 1ikw h GLU 399 Cb 0.40 -0.10 -0.00 0.00 0.63 0.00 0.00 28.75 29.68 1ikw h GLU 399 CO 0.05 0.28 0.01 0.00 -0.73 0.00 0.00 179.01 178.62 1ikw h THR 400 N 0.44 1.19 -0.06 0.32 1.03 -1.35 -2.63 112.91 111.85 1ikw h THR 400 Ca 0.29 -0.58 -0.00 0.00 -0.01 0.00 0.00 66.41 66.11 1ikw h THR 400 Cb 0.32 1.53 -0.00 0.00 -1.07 0.00 0.00 68.15 68.93 1ikw h THR 400 CO -0.27 0.16 0.03 -0.25 -0.01 0.00 0.00 175.52 175.18 1ikw h TRP 401 N -0.18 0.08 -0.15 0.00 2.91 -1.11 -3.18 115.95 114.32 1ikw h TRP 401 Ca 0.01 -0.00 0.03 0.00 1.13 0.00 0.00 58.89 60.06 1ikw h TRP 401 Cb 0.24 -0.03 -0.03 0.00 -0.51 0.00 0.00 29.16 28.84 1ikw h TRP 401 CO 0.01 0.13 -0.05 2.35 -1.03 0.00 0.00 178.44 179.85 1ikw h TRP 402 N 0.00 -0.11 -0.01 2.65 7.01 -1.10 -2.22 115.95 122.17 1ikw h TRP 402 Ca 0.02 0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.02 1ikw h TRP 402 Cb 0.08 0.07 -0.00 0.00 -2.10 0.00 0.00 29.16 27.21 1ikw h TRP 402 CO -0.05 -0.08 -0.05 1.79 -2.79 0.00 0.00 178.44 177.26 1ikw h THR 403 N -0.02 1.05 0.00 2.65 1.35 -1.50 -3.07 112.91 113.37 1ikw h THR 403 Ca 0.08 -0.21 -0.23 0.00 -0.55 0.00 0.00 66.41 65.50 1ikw h THR 403 Cb 0.14 1.10 -0.04 0.00 -1.73 0.00 0.00 68.15 67.62 1ikw h THR 403 CO -0.17 0.06 -1.61 -0.62 -0.25 0.00 0.00 175.52 172.93 1ikw n GLU 404 N -4.47 0.63 -1.60 4.72 1.02 -1.13 -4.97 120.64 114.84 1ikw n GLU 404 Ca -0.03 0.23 -0.39 0.00 -0.02 0.00 0.00 57.16 56.96 1ikw n GLU 404 Cb 0.14 -1.78 0.04 0.00 -0.02 0.00 0.00 31.44 29.83 1ikw n GLU 404 CO 0.00 0.00 0.00 0.98 1.18 0.00 0.00 177.13 179.29 1ikw n TYR 405 N -2.93 0.75 -0.07 -0.32 9.36 -0.85 -4.93 117.16 118.18 1ikw n TYR 405 Ca -0.14 0.46 -0.15 0.00 3.32 0.00 0.00 57.90 61.39 1ikw n TYR 405 Cb 0.94 -2.14 -0.05 0.00 -0.63 0.00 0.00 39.34 37.46 1ikw n TYR 405 CO 0.00 0.00 0.00 0.11 0.22 0.00 0.00 176.86 177.19 1ikw h TRP 406 N 0.72 1.08 -3.84 2.98 5.08 -1.92 -3.45 115.95 116.60 1ikw h TRP 406 Ca -0.47 -0.40 -0.49 0.00 1.08 0.00 0.00 58.89 58.61 1ikw h TRP 406 Cb 1.36 -0.20 -0.00 0.00 -3.00 0.00 0.00 29.16 27.32 1ikw h TRP 406 CO 0.38 1.23 0.40 -1.14 -1.28 0.00 0.00 178.44 178.03 1ikw s GLN 407 N -4.08 4.60 0.13 0.12 0.74 -1.26 -5.01 119.66 114.89 1ikw s GLN 407 Ca -0.11 1.56 -0.30 0.00 0.05 0.00 0.00 55.36 56.56 1ikw s GLN 407 Cb 0.10 -3.01 -0.07 0.00 1.10 0.00 0.00 33.01 31.13 1ikw s GLN 407 CO 0.89 0.24 1.16 0.00 -0.55 0.00 0.00 175.29 177.03 1ikw s ALA 408 N -1.36 3.39 0.01 1.58 0.00 -1.26 -5.03 121.76 119.10 1ikw s ALA 408 Ca 0.47 0.86 0.01 0.00 0.00 0.00 0.00 51.96 53.30 1ikw s ALA 408 Cb -0.26 -3.41 -0.01 0.00 0.00 0.00 0.00 23.12 19.45 1ikw s ALA 408 CO 0.32 -0.34 -0.05 0.99 0.00 0.00 0.00 175.76 176.68 1ikw s THR 409 N 0.36 0.35 0.45 0.00 2.01 -1.26 -5.15 115.64 112.39 1ikw s THR 409 Ca 0.54 -0.56 0.03 0.00 0.31 0.00 0.00 61.69 62.02 1ikw s THR 409 Cb -0.30 -0.37 -0.01 0.00 0.01 0.00 0.00 72.50 71.83 1ikw s THR 409 CO 0.33 -0.15 0.12 0.86 -0.69 0.00 0.00 174.62 175.10 1ikw s TRP 410 N -0.69 1.77 0.00 4.92 -0.00 -1.26 -5.09 118.94 118.59 1ikw s TRP 410 Ca -0.05 -1.30 0.00 0.00 -0.00 0.00 0.00 56.10 54.76 1ikw s TRP 410 Cb -0.05 -1.22 0.00 0.00 -0.00 0.00 0.00 33.47 32.20 1ikw s TRP 410 CO -0.00 -0.27 0.00 1.51 -0.00 0.00 0.00 176.95 178.19 1ikw n ILE 411 N -1.03 0.00 -0.76 5.86 3.06 -1.26 -5.05 119.36 120.18 1ikw n ILE 411 Ca -0.09 0.00 -0.33 0.00 -2.50 0.00 0.00 62.75 59.83 1ikw n ILE 411 Cb 0.65 0.00 0.13 0.00 0.54 0.00 0.00 39.64 40.96 1ikw n ILE 411 CO 0.00 0.00 0.00 -2.65 -2.50 0.00 0.00 176.55 171.40 1ikw n PRO 412 N 0.00 -0.88 -1.63 9.51 -0.02 -1.26 -4.75 135.00 135.97 1ikw n PRO 412 Ca 0.00 -0.23 -0.63 0.00 -2.02 0.00 0.00 63.50 60.61 1ikw n PRO 412 Cb 0.00 -1.66 -0.09 0.00 -0.02 0.00 0.00 33.50 31.72 1ikw n PRO 412 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1ikw n GLU 413 N -1.31 0.00 -4.29 -0.52 2.13 -1.26 -4.77 120.64 110.62 1ikw n GLU 413 Ca 0.03 0.00 -0.17 0.00 0.66 0.00 0.00 57.16 57.68 1ikw n GLU 413 Cb 0.59 -1.41 -0.09 0.00 0.27 0.00 0.00 31.44 30.80 1ikw n GLU 413 CO 0.00 0.00 0.00 1.67 -0.41 0.00 0.00 177.13 178.39 1ikw s TRP 414 N 2.60 1.50 0.00 4.31 1.48 -1.26 -1.57 118.94 125.99 1ikw s TRP 414 Ca 0.98 -1.41 -0.07 0.00 -1.06 0.00 0.00 56.10 54.54 1ikw s TRP 414 Cb -1.40 -0.75 0.00 0.00 -1.16 0.00 0.00 33.47 30.16 1ikw s TRP 414 CO 0.75 -0.60 0.14 -1.21 -4.06 0.00 0.00 176.95 171.98 1ikw s GLU 415 N -3.87 0.49 0.58 3.25 2.02 0.59 -4.92 118.70 116.82 1ikw s GLU 415 Ca 0.38 -0.40 -0.16 0.00 0.02 0.00 0.00 54.97 54.81 1ikw s GLU 415 Cb 0.05 0.20 -0.05 0.00 0.10 0.00 0.00 34.13 34.44 1ikw s GLU 415 CO 0.17 -0.12 1.04 0.12 0.02 0.00 0.00 175.26 176.50 1ikw s PHE 416 N -1.38 3.11 -0.23 1.61 5.36 -1.26 -0.41 117.98 124.78 1ikw s PHE 416 Ca -0.15 1.49 -0.06 0.00 -0.96 0.00 0.00 56.93 57.26 1ikw s PHE 416 Cb -0.08 -2.95 0.11 0.00 -0.34 0.00 0.00 43.02 39.77 1ikw s PHE 416 CO 0.02 -0.93 0.45 0.54 -1.46 0.00 0.00 175.22 173.84 1ikw s VAL 417 N -2.52 -0.71 -1.01 3.12 0.11 -0.50 -4.74 120.40 114.15 1ikw s VAL 417 Ca 0.62 0.08 -0.23 0.00 -2.93 0.00 0.00 61.98 59.52 1ikw s VAL 417 Cb -0.14 -0.77 -0.01 0.00 -1.53 0.00 0.00 36.38 33.93 1ikw s VAL 417 CO 0.36 0.01 1.76 0.21 -3.33 0.00 0.00 175.10 174.11 1ikw s ASN 418 N 2.65 5.73 -0.50 3.54 3.84 -1.26 -4.18 114.94 124.77 1ikw s ASN 418 Ca 0.03 -1.19 0.03 0.00 0.21 0.00 0.00 52.86 51.94 1ikw s ASN 418 Cb -0.13 -2.57 0.15 0.00 -0.55 0.00 0.00 41.25 38.15 1ikw s ASN 418 CO -0.15 -2.23 0.33 0.42 -2.79 0.00 0.00 177.10 172.68 1ikw s THR 419 N 7.97 1.48 0.55 -5.21 -4.23 -1.26 -5.12 115.64 109.82 1ikw s THR 419 Ca 0.60 -3.02 -0.19 0.00 -1.18 0.00 0.00 61.69 57.91 1ikw s THR 419 Cb -0.03 -2.01 -0.09 0.00 1.34 0.00 0.00 72.50 71.71 1ikw s THR 419 CO -0.02 -1.02 0.55 -2.65 -0.54 0.00 0.00 174.62 170.94 1ikw n PRO 420 N 2.95 0.55 -2.14 3.99 -0.02 -1.26 -4.45 135.00 134.62 1ikw n PRO 420 Ca 0.17 0.21 -0.42 0.00 -2.02 0.00 0.00 63.50 61.45 1ikw n PRO 420 Cb 0.38 -1.70 -0.03 0.00 -0.02 0.00 0.00 33.50 32.14 1ikw n PRO 420 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 1ikw s PRO 421 N -2.04 4.33 0.40 0.52 0.02 -1.26 -4.90 135.00 132.06 1ikw s PRO 421 Ca 0.68 2.14 -0.20 0.00 0.02 0.00 0.00 61.00 63.64 1ikw s PRO 421 Cb -0.46 -3.19 -0.10 0.00 0.02 0.00 0.00 34.50 30.76 1ikw s PRO 421 CO 0.55 -0.37 0.90 -0.51 -0.33 0.00 0.00 177.00 177.23 1ikw s LEU 422 N 0.31 3.99 -0.01 -5.54 1.02 -1.26 -4.68 118.68 112.51 1ikw s LEU 422 Ca 0.61 1.60 -0.23 0.00 0.02 0.00 0.00 54.13 56.13 1ikw s LEU 422 Cb -0.38 -4.41 -0.05 0.00 0.02 0.00 0.00 46.19 41.37 1ikw s LEU 422 CO 0.36 -0.31 0.69 -0.69 0.02 0.00 0.00 176.35 176.42 1ikw s VAL 423 N -2.11 4.89 0.09 -1.59 1.01 0.19 -5.03 120.40 117.86 1ikw s VAL 423 Ca 0.60 1.44 -0.16 0.00 0.00 0.00 0.00 61.98 63.85 1ikw s VAL 423 Cb -0.10 -4.03 0.03 0.00 0.00 0.00 0.00 36.38 32.29 1ikw s VAL 423 CO 0.14 0.34 0.39 -1.59 0.00 0.00 0.00 175.10 174.39 1ikw s LYS 424 N 0.18 1.00 -0.17 2.72 -2.85 -1.26 -4.48 119.74 114.87 1ikw s LYS 424 Ca 0.36 -0.59 -0.27 0.00 -1.00 0.00 0.00 55.97 54.46 1ikw s LYS 424 Cb -0.19 0.44 -0.01 0.00 -2.06 0.00 0.00 37.83 36.02 1ikw s LYS 424 CO 0.19 -0.37 0.94 -0.51 0.10 0.00 0.00 175.35 175.70 1ikw s LEU 425 N -2.50 4.17 0.00 2.77 1.43 -1.26 -4.81 118.68 118.48 1ikw s LEU 425 Ca -0.00 1.33 0.04 0.00 -1.03 0.00 0.00 54.13 54.47 1ikw s LEU 425 Cb 0.01 -3.41 0.21 0.00 0.03 0.00 0.00 46.19 43.03 1ikw s LEU 425 CO -0.08 -0.50 1.14 0.79 0.23 0.00 0.00 176.35 177.93 1ikw n TRP 426 N 5.52 0.06 0.00 0.29 7.02 -1.26 -4.88 117.44 124.18 1ikw n TRP 426 Ca 0.08 -0.03 0.00 0.00 -1.02 0.00 0.00 57.50 56.53 1ikw n TRP 426 Cb 0.48 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.37 1ikw n TRP 426 CO 0.00 0.00 0.00 2.48 -2.02 0.00 0.00 177.69 178.15 1ikw n TYR 427 N -0.40 0.00 -4.29 -5.99 0.18 -1.26 -4.63 117.16 100.77 1ikw n TYR 427 Ca 0.04 0.00 -0.21 0.00 1.88 0.00 0.00 57.90 59.61 1ikw n TYR 427 Cb 0.05 0.00 -0.12 0.00 -0.38 0.00 0.00 39.34 38.90 1ikw n TYR 427 CO 0.00 0.00 0.00 -0.65 -2.08 0.00 0.00 176.86 174.13 1ikw s GLN 428 N -2.00 1.14 -0.17 -3.48 -1.52 -1.26 -4.95 119.66 107.42 1ikw s GLN 428 Ca 0.00 -1.28 -0.06 0.00 -1.95 0.00 0.00 55.36 52.07 1ikw s GLN 428 Cb 0.00 -1.20 -0.04 0.00 -0.22 0.00 0.00 33.01 31.55 1ikw s GLN 428 CO 0.00 0.25 0.05 -0.51 -0.25 0.00 0.00 175.29 174.83 1ikw s LEU 429 N -2.37 3.76 0.86 2.90 1.43 -1.26 -4.62 118.68 119.38 1ikw s LEU 429 Ca 0.11 0.08 -0.12 0.00 -1.03 0.00 0.00 54.13 53.17 1ikw s LEU 429 Cb -0.07 -1.93 0.10 0.00 0.03 0.00 0.00 46.19 44.32 1ikw s LEU 429 CO 0.05 0.21 1.10 -0.62 0.23 0.00 0.00 176.35 177.31 1ikw n GLU 430 N 3.31 -0.11 -0.12 1.70 -0.58 0.01 -4.95 120.64 119.90 1ikw n GLU 430 Ca -0.17 0.04 -0.15 0.00 -0.42 0.00 0.00 57.16 56.46 1ikw n GLU 430 Cb 0.52 -2.35 -0.13 0.00 -0.57 0.00 0.00 31.44 28.91 1ikw n GLU 430 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1ikw n LYS 431 N -3.47 0.68 -4.55 3.49 5.02 -1.26 -4.64 118.16 113.42 1ikw n LYS 431 Ca 0.12 0.09 -0.34 0.00 -2.02 0.00 0.00 58.31 56.17 1ikw n LYS 431 Cb 0.51 -1.51 -0.11 0.00 -0.02 0.00 0.00 35.03 33.91 1ikw n LYS 431 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1ikw s GLU 432 N -2.50 2.90 0.66 1.97 8.01 -1.26 -5.05 118.70 123.43 1ikw s GLU 432 Ca -0.26 -0.52 -0.17 0.00 0.01 0.00 0.00 54.97 54.03 1ikw s GLU 432 Cb 0.08 -2.67 -0.09 0.00 -4.31 0.00 0.00 34.13 27.14 1ikw s GLU 432 CO 0.66 0.62 0.20 -2.30 0.01 0.00 0.00 175.26 174.45 1ikw n PRO 433 N 2.36 0.23 -3.01 0.39 -0.02 -1.26 -4.90 135.00 128.78 1ikw n PRO 433 Ca -0.18 0.10 -0.44 0.00 -2.02 0.00 0.00 63.50 60.96 1ikw n PRO 433 Cb 0.53 -1.48 -0.05 0.00 -0.02 0.00 0.00 33.50 32.48 1ikw n PRO 433 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1ikw s ILE 434 N -1.91 4.64 0.33 4.25 1.01 -1.26 -5.03 121.20 123.23 1ikw s ILE 434 Ca 0.61 -0.40 -0.29 0.00 0.00 0.00 0.00 60.65 60.57 1ikw s ILE 434 Cb -0.39 -4.47 -0.11 0.00 0.01 0.00 0.00 42.46 37.49 1ikw s ILE 434 CO 0.62 -1.08 1.52 -0.69 0.00 0.00 0.00 174.94 175.31 1ikw s VAL 435 N 3.24 2.12 -0.93 2.92 1.01 -1.26 -2.98 120.40 124.52 1ikw s VAL 435 Ca 0.19 0.11 -0.03 0.00 0.00 0.00 0.00 61.98 62.25 1ikw s VAL 435 Cb -0.18 -3.07 -0.03 0.00 0.00 0.00 0.00 36.38 33.09 1ikw s VAL 435 CO 0.12 0.02 0.79 0.61 0.00 0.00 0.00 175.10 176.65 1ikw n GLY 436 N 1.26 -0.56 3.32 4.51 0.00 -1.26 -5.03 105.19 107.43 1ikw n GLY 436 Ca 0.04 0.25 -0.10 0.00 0.00 0.00 0.00 46.02 46.21 1ikw n GLY 436 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ikw s ALA 437 N -3.31 -1.16 0.47 4.61 0.00 -1.16 -5.08 121.76 116.13 1ikw s ALA 437 Ca 0.21 1.64 -0.22 0.00 0.00 0.00 0.00 51.96 53.59 1ikw s ALA 437 Cb -0.03 -1.02 -0.10 0.00 0.00 0.00 0.00 23.12 21.97 1ikw s ALA 437 CO 0.61 -0.31 0.77 -1.91 0.00 0.00 0.00 175.76 174.92 1ikw n GLU 438 N 4.35 0.89 -3.88 0.00 2.13 -1.26 -4.54 120.64 118.33 1ikw n GLU 438 Ca -0.22 0.33 -0.34 0.00 0.66 0.00 0.00 57.16 57.59 1ikw n GLU 438 Cb 0.55 -1.83 -0.13 0.00 0.27 0.00 0.00 31.44 30.30 1ikw n GLU 438 CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 1ikw s THR 439 N -1.45 2.86 -0.22 6.31 2.01 -1.26 -1.11 115.64 122.78 1ikw s THR 439 Ca 0.66 -2.30 -0.27 0.00 0.31 0.00 0.00 61.69 60.10 1ikw s THR 439 Cb -0.53 -3.01 -0.00 0.00 0.01 0.00 0.00 72.50 68.97 1ikw s THR 439 CO 0.55 -0.67 0.93 -0.36 -0.69 0.00 0.00 174.62 174.38 1ikw s PHE 440 N 0.90 3.35 -0.75 4.92 0.40 0.50 -3.56 117.98 123.73 1ikw s PHE 440 Ca 0.10 1.32 -0.17 0.00 -0.60 0.00 0.00 56.93 57.58 1ikw s PHE 440 Cb -0.21 -3.15 0.16 0.00 0.51 0.00 0.00 43.02 40.33 1ikw s PHE 440 CO -0.06 -0.40 0.80 0.71 0.70 0.00 0.00 175.22 176.97 1ikw s TYR 441 N 2.86 3.35 0.63 0.36 1.51 0.17 -1.10 117.35 125.12 1ikw s TYR 441 Ca 0.40 -1.49 -0.07 0.00 -1.01 0.00 0.00 57.07 54.90 1ikw s TYR 441 Cb -0.15 -3.98 0.02 0.00 -0.11 0.00 0.00 41.96 37.73 1ikw s TYR 441 CO 0.08 -1.19 0.96 0.14 -1.11 0.00 0.00 175.55 174.42 1ikw s VAL 442 N 1.60 3.46 0.14 0.71 -7.23 -1.13 -2.30 120.40 115.65 1ikw s VAL 442 Ca 0.18 0.08 -0.25 0.00 -1.81 0.00 0.00 61.98 60.18 1ikw s VAL 442 Cb -0.15 -3.41 0.07 0.00 0.56 0.00 0.00 36.38 33.45 1ikw s VAL 442 CO -0.03 -0.45 1.02 -0.62 -0.31 0.00 0.00 175.10 174.70 1ikw s ASP 443 N -4.34 -0.12 0.12 4.85 -1.08 -0.93 -4.65 116.67 110.52 1ikw s ASP 443 Ca 0.55 -0.43 -0.25 0.00 -0.52 0.00 0.00 52.55 51.90 1ikw s ASP 443 Cb -0.11 0.45 0.07 0.00 -1.46 0.00 0.00 42.92 41.88 1ikw s ASP 443 CO 0.47 -0.85 0.82 -0.83 0.52 0.00 0.00 175.17 175.29 1ikw s GLY 444 N -3.04 -0.38 0.22 2.66 0.00 -1.26 -2.48 107.32 103.04 1ikw s GLY 444 Ca 0.14 0.44 -0.22 0.00 0.00 0.00 0.00 44.72 45.08 1ikw s GLY 444 CO 0.02 0.14 0.70 0.00 0.00 0.00 0.00 173.10 173.96 1ikw s ALA 445 N -3.43 -1.40 -0.29 3.20 0.00 -1.26 -4.84 121.76 113.73 1ikw s ALA 445 Ca 0.07 0.03 -0.15 0.00 0.00 0.00 0.00 51.96 51.91 1ikw s ALA 445 Cb -0.02 0.83 0.13 0.00 0.00 0.00 0.00 23.12 24.06 1ikw s ALA 445 CO -0.04 -0.94 0.85 0.00 0.00 0.00 0.00 175.76 175.63 1ikw s ALA 446 N -3.79 -2.19 -0.01 0.00 0.00 -1.26 -2.84 121.76 111.67 1ikw s ALA 446 Ca 0.08 2.27 -0.30 0.00 0.00 0.00 0.00 51.96 54.01 1ikw s ALA 446 Cb -0.04 -1.68 -0.06 0.00 0.00 0.00 0.00 23.12 21.34 1ikw s ALA 446 CO -0.01 -0.52 1.62 1.21 0.00 0.00 0.00 175.76 178.06 1ikw s ASN 447 N 1.79 6.68 0.26 0.00 3.84 -0.70 -4.77 114.94 122.03 1ikw s ASN 447 Ca -0.08 2.29 -0.02 0.00 0.21 0.00 0.00 52.86 55.26 1ikw s ASN 447 Cb -0.05 -2.55 0.32 0.00 -0.55 0.00 0.00 41.25 38.42 1ikw s ASN 447 CO -0.17 -0.89 1.74 0.03 -2.79 0.00 0.00 177.10 175.02 1ikw h ARG 448 N 8.98 0.75 0.01 0.43 3.08 -1.96 0.50 114.38 126.16 1ikw h ARG 448 Ca -0.40 -0.22 -0.21 0.00 0.07 0.00 0.00 59.98 59.22 1ikw h ARG 448 Cb 1.18 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 31.13 1ikw h ARG 448 CO 0.94 0.80 -0.99 1.05 -1.07 0.00 0.00 179.97 180.71 1ikw h GLU 449 N 0.69 0.02 0.00 0.04 4.11 -2.00 -3.38 114.58 114.06 1ikw h GLU 449 Ca 0.13 -0.03 -0.19 0.00 0.07 0.00 0.00 59.36 59.35 1ikw h GLU 449 Cb 0.51 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.75 1ikw h GLU 449 CO 0.03 0.99 -1.13 2.41 0.07 0.00 0.00 179.01 181.38 1ikw n THR 450 N -3.39 1.51 -0.93 -1.06 -1.04 -1.18 -5.02 114.28 103.17 1ikw n THR 450 Ca -0.01 0.02 0.00 0.00 -2.04 0.00 0.00 64.05 62.03 1ikw n THR 450 Cb 0.92 -2.12 0.00 0.00 -1.82 0.00 0.00 70.33 67.31 1ikw n THR 450 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 1ikw n LYS 451 N -4.47 0.00 -4.01 -2.82 4.01 0.17 -4.86 118.16 106.19 1ikw n LYS 451 Ca -0.27 0.00 -0.35 0.00 -0.51 0.00 0.00 58.31 57.18 1ikw n LYS 451 Cb 0.59 -1.35 -0.14 0.00 -0.51 0.00 0.00 35.03 33.62 1ikw n LYS 451 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 1ikw s LEU 452 N -0.14 2.78 0.47 -0.35 1.43 -1.23 -0.15 118.68 121.48 1ikw s LEU 452 Ca 0.00 -0.42 0.03 0.00 -1.03 0.00 0.00 54.13 52.71 1ikw s LEU 452 Cb 0.00 -1.69 -0.03 0.00 0.03 0.00 0.00 46.19 44.50 1ikw s LEU 452 CO 0.00 -0.00 0.02 -0.83 0.23 0.00 0.00 176.35 175.77 1ikw s GLY 453 N 1.35 2.85 -0.39 -3.19 0.00 -0.90 -1.72 107.32 105.32 1ikw s GLY 453 Ca 0.04 -0.92 0.03 0.00 0.00 0.00 0.00 44.72 43.87 1ikw s GLY 453 CO -0.04 -2.13 0.32 0.54 0.00 0.00 0.00 173.10 171.79 1ikw s LYS 454 N -3.83 0.73 -0.06 2.90 1.02 -1.13 -1.42 119.74 117.96 1ikw s LYS 454 Ca 0.15 -1.52 -0.30 0.00 0.02 0.00 0.00 55.97 54.31 1ikw s LYS 454 Cb 0.04 -1.16 -0.04 0.00 -0.52 0.00 0.00 37.83 36.15 1ikw s LYS 454 CO 0.08 -1.28 1.31 0.00 -0.92 0.00 0.00 175.35 174.53 1ikw s ALA 455 N 0.74 3.57 0.04 5.17 0.00 -0.95 -4.29 121.76 126.03 1ikw s ALA 455 Ca 0.24 0.70 -0.01 0.00 0.00 0.00 0.00 51.96 52.89 1ikw s ALA 455 Cb -0.10 -3.58 0.00 0.00 0.00 0.00 0.00 23.12 19.45 1ikw s ALA 455 CO -0.08 -0.93 0.06 0.41 0.00 0.00 0.00 175.76 175.22 1ikw n GLY 456 N 3.56 2.62 3.81 0.00 0.00 -1.04 -1.92 105.19 112.22 1ikw n GLY 456 Ca 0.13 -1.27 -0.05 0.00 0.00 0.00 0.00 46.02 44.83 1ikw n GLY 456 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1ikw s TYR 457 N -6.12 -0.09 -0.16 1.61 -0.85 -0.61 -2.19 117.35 108.93 1ikw s TYR 457 Ca 0.02 -0.31 -0.13 0.00 -0.52 0.00 0.00 57.07 56.13 1ikw s TYR 457 Cb -0.00 0.69 0.05 0.00 0.38 0.00 0.00 41.96 43.07 1ikw s TYR 457 CO 0.02 -1.03 0.42 0.08 -1.52 0.00 0.00 175.55 173.52 1ikw s VAL 458 N -3.21 -0.01 0.50 -3.49 1.01 -0.97 -2.80 120.40 111.44 1ikw s VAL 458 Ca 0.13 0.02 0.04 0.00 0.00 0.00 0.00 61.98 62.18 1ikw s VAL 458 Cb -0.03 -0.60 -0.00 0.00 0.00 0.00 0.00 36.38 35.74 1ikw s VAL 458 CO 0.05 0.01 0.18 0.42 0.00 0.00 0.00 175.10 175.76 1ikw s THR 459 N 0.55 1.59 -1.91 3.92 -4.23 -0.46 -0.66 115.64 114.44 1ikw s THR 459 Ca -0.03 -1.76 0.05 0.00 -1.18 0.00 0.00 61.69 58.77 1ikw s THR 459 Cb -0.04 -2.35 0.14 0.00 1.34 0.00 0.00 72.50 71.59 1ikw s THR 459 CO -0.03 0.00 1.09 -0.46 -0.54 0.00 0.00 174.62 174.68 1ikw n ASN 460 N -1.43 0.93 -0.35 3.99 6.94 -1.23 -3.11 115.26 120.99 1ikw n ASN 460 Ca -0.09 -2.01 0.07 0.00 -0.02 0.00 0.00 54.58 52.53 1ikw n ASN 460 Cb 0.66 -0.14 0.14 0.00 -2.36 0.00 0.00 39.78 38.08 1ikw n ASN 460 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 1ikw n LYS 461 N -0.03 1.15 0.00 -3.83 5.02 -1.26 -5.01 118.16 114.20 1ikw n LYS 461 Ca 0.05 -2.58 0.00 0.00 -2.02 0.00 0.00 58.31 53.76 1ikw n LYS 461 Cb 0.16 -1.34 0.00 0.00 -0.02 0.00 0.00 35.03 33.83 1ikw n LYS 461 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1ikw n GLY 462 N -1.08 2.16 3.61 0.72 0.00 -1.18 -5.00 105.19 104.43 1ikw n GLY 462 Ca 0.14 -0.02 -0.44 0.00 0.00 0.00 0.00 46.02 45.70 1ikw n GLY 462 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ikw n ARG 463 N 0.00 1.53 -3.15 1.61 1.74 -1.26 -4.71 116.66 112.42 1ikw n ARG 463 Ca 0.00 0.54 0.04 0.00 -0.77 0.00 0.00 57.85 57.66 1ikw n ARG 463 Cb 0.00 -1.96 -0.01 0.00 -1.02 0.00 0.00 32.46 29.48 1ikw n ARG 463 CO 0.00 0.00 0.00 1.14 -1.52 0.00 0.00 177.63 177.25 1ikw s GLN 464 N -1.63 0.53 0.13 5.56 -2.07 -1.26 -1.35 119.66 119.57 1ikw s GLN 464 Ca 0.58 0.78 0.06 0.00 -1.82 0.00 0.00 55.36 54.96 1ikw s GLN 464 Cb -0.67 0.41 -0.04 0.00 -1.09 0.00 0.00 33.01 31.62 1ikw s GLN 464 CO 0.60 -0.73 0.01 0.21 -1.32 0.00 0.00 175.29 174.07 1ikw s LYS 465 N 2.86 2.52 -0.40 9.60 2.20 -1.12 -4.98 119.74 130.42 1ikw s LYS 465 Ca 0.16 -0.95 0.04 0.00 -0.36 0.00 0.00 55.97 54.86 1ikw s LYS 465 Cb -0.13 -2.48 0.16 0.00 -1.51 0.00 0.00 37.83 33.88 1ikw s LYS 465 CO -0.22 0.50 0.41 0.08 -0.36 0.00 0.00 175.35 175.76 1ikw s VAL 466 N -1.50 -0.29 0.07 4.02 1.01 -1.26 -1.57 120.40 120.87 1ikw s VAL 466 Ca 0.27 -1.29 -0.25 0.00 0.00 0.00 0.00 61.98 60.70 1ikw s VAL 466 Cb -0.11 -0.69 -0.06 0.00 0.00 0.00 0.00 36.38 35.53 1ikw s VAL 466 CO 0.19 -0.63 0.78 0.68 0.00 0.00 0.00 175.10 176.11 1ikw s VAL 467 N 1.10 4.65 0.36 2.92 -7.23 -0.81 -4.93 120.40 116.47 1ikw s VAL 467 Ca 0.21 1.67 -0.12 0.00 -1.81 0.00 0.00 61.98 61.93 1ikw s VAL 467 Cb -0.10 -4.13 -0.07 0.00 0.56 0.00 0.00 36.38 32.63 1ikw s VAL 467 CO -0.06 0.39 0.74 -2.16 -0.31 0.00 0.00 175.10 173.70 1ikw s PRO 468 N -0.24 3.87 0.08 4.82 0.04 -1.26 -2.24 135.00 140.07 1ikw s PRO 468 Ca 0.39 0.53 0.04 0.00 0.04 0.00 0.00 61.00 61.99 1ikw s PRO 468 Cb -0.21 -2.43 -0.03 0.00 0.04 0.00 0.00 34.50 31.87 1ikw s PRO 468 CO 0.24 0.07 -0.11 -0.51 0.04 0.00 0.00 177.00 176.73 1ikw s LEU 469 N -3.43 2.35 -0.10 -3.56 1.02 -0.51 -4.93 118.68 109.53 1ikw s LEU 469 Ca 0.52 -0.73 0.02 0.00 0.02 0.00 0.00 54.13 53.97 1ikw s LEU 469 Cb -0.10 -0.32 0.01 0.00 0.02 0.00 0.00 46.19 45.80 1ikw s LEU 469 CO 0.25 -0.21 -0.17 0.42 0.02 0.00 0.00 176.35 176.66 1ikw s THR 470 N -2.02 1.57 -0.25 5.49 -4.23 -1.26 -2.12 115.64 112.82 1ikw s THR 470 Ca 0.01 -0.71 -0.01 0.00 -1.18 0.00 0.00 61.69 59.80 1ikw s THR 470 Cb -0.06 -1.41 0.00 0.00 1.34 0.00 0.00 72.50 72.37 1ikw s THR 470 CO 0.01 0.45 0.22 0.59 -0.54 0.00 0.00 174.62 175.35 1ikw n ASN 471 N 3.97 -2.58 -4.25 3.99 3.02 0.78 -5.03 115.26 115.15 1ikw n ASN 471 Ca -0.20 -0.11 -0.23 0.00 -0.03 0.00 0.00 54.58 54.01 1ikw n ASN 471 Cb 0.52 -1.38 -0.13 0.00 -0.61 0.00 0.00 39.78 38.18 1ikw n ASN 471 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1ikw s THR 472 N -3.06 1.59 1.01 3.41 -4.23 -1.22 -5.08 115.64 108.05 1ikw s THR 472 Ca 0.08 -1.39 -0.17 0.00 -1.18 0.00 0.00 61.69 59.03 1ikw s THR 472 Cb -0.03 -1.43 0.22 0.00 1.34 0.00 0.00 72.50 72.59 1ikw s THR 472 CO 0.14 -0.01 1.30 0.42 -0.54 0.00 0.00 174.62 175.93 1ikw s THR 473 N -1.07 1.93 0.27 3.99 -4.23 -1.26 -4.64 115.64 110.63 1ikw s THR 473 Ca 0.05 0.00 0.19 0.00 -1.18 0.00 0.00 61.69 60.75 1ikw s THR 473 Cb -0.10 -2.92 0.16 0.00 1.34 0.00 0.00 72.50 70.98 1ikw s THR 473 CO 0.03 0.00 1.82 -1.13 -0.54 0.00 0.00 174.62 174.81 1ikw h ASN 474 N -1.82 0.00 0.15 3.99 -0.73 -1.90 -2.82 115.58 112.44 1ikw h ASN 474 Ca -0.44 0.00 -0.01 0.00 1.87 0.00 0.00 56.30 57.72 1ikw h ASN 474 Cb 1.24 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.83 1ikw h ASN 474 CO 0.36 0.32 -0.07 1.56 -0.37 0.00 0.00 177.43 179.23 1ikw h GLN 475 N 0.00 -0.19 -0.79 6.67 4.20 -1.97 -3.29 115.11 119.74 1ikw h GLN 475 Ca -0.00 0.01 0.14 0.00 0.06 0.00 0.00 58.65 58.86 1ikw h GLN 475 Cb 0.73 0.04 -0.06 0.00 0.30 0.00 0.00 27.48 28.50 1ikw h GLN 475 CO 0.04 0.21 0.52 0.87 -0.67 0.00 0.00 178.83 179.81 1ikw h LYS 476 N -0.92 0.52 0.00 1.46 1.57 -1.92 0.58 116.57 117.86 1ikw h LYS 476 Ca -0.02 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1ikw h LYS 476 Cb 0.50 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.69 1ikw h LYS 476 CO 0.03 0.35 0.00 1.79 -0.57 0.00 0.00 179.45 181.05 1ikw h THR 477 N 0.54 0.00 0.00 -0.16 1.35 -1.58 1.72 112.91 114.78 1ikw h THR 477 Ca 0.39 -0.13 -0.21 0.00 -0.55 0.00 0.00 66.41 65.91 1ikw h THR 477 Cb 0.75 1.11 -0.04 0.00 -1.73 0.00 0.00 68.15 68.24 1ikw h THR 477 CO -0.15 0.00 -1.82 0.00 -0.25 0.00 0.00 175.52 173.30 1ikw n GLN 478 N -3.05 0.65 0.07 4.72 1.13 0.19 -2.54 117.38 118.54 1ikw n GLN 478 Ca -0.02 0.09 0.02 0.00 -1.94 0.00 0.00 57.00 55.15 1ikw n GLN 478 Cb 0.13 -1.68 -0.05 0.00 0.11 0.00 0.00 30.24 28.76 1ikw n GLN 478 CO 0.00 0.00 0.00 1.25 -1.44 0.00 0.00 177.06 176.87 1ikw h LEU 479 N 0.00 0.00 0.14 1.08 5.85 0.26 -3.10 115.31 119.55 1ikw h LEU 479 Ca -0.26 0.00 -0.28 0.00 0.84 0.00 0.00 57.88 58.17 1ikw h LEU 479 Cb 1.73 0.00 0.01 0.00 0.37 0.00 0.00 40.66 42.76 1ikw h LEU 479 CO 0.04 0.48 -1.29 -0.61 -0.34 0.00 0.00 178.44 176.72 1ikw h GLN 480 N 0.00 0.30 0.00 1.25 5.75 0.24 -2.85 115.11 119.80 1ikw h GLN 480 Ca -0.11 -0.52 -0.04 0.00 -0.15 0.00 0.00 58.65 57.83 1ikw h GLN 480 Cb 1.46 0.19 -0.01 0.00 1.07 0.00 0.00 27.48 30.20 1ikw h GLN 480 CO 0.04 1.24 -0.19 0.00 -2.65 0.00 0.00 178.83 177.28 1ikw h ALA 481 N 0.52 1.44 0.00 3.38 0.00 -1.55 -1.44 119.26 121.61 1ikw h ALA 481 Ca -0.16 -0.17 -0.17 0.00 0.00 0.00 0.00 54.91 54.41 1ikw h ALA 481 Cb 2.00 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 19.74 1ikw h ALA 481 CO 0.21 0.24 -0.94 0.82 0.00 0.00 0.00 179.25 179.58 1ikw h ILE 482 N 0.00 1.07 -0.50 0.00 2.04 -1.54 -2.84 117.51 115.74 1ikw h ILE 482 Ca -0.00 -2.61 -0.09 0.00 1.00 0.00 0.00 64.86 63.15 1ikw h ILE 482 Cb 0.40 2.49 -0.02 0.00 -0.74 0.00 0.00 36.82 38.95 1ikw h ILE 482 CO 0.02 0.61 -0.06 0.22 0.00 0.00 0.00 178.15 178.94 1ikw h TYR 483 N 0.00 0.98 0.55 1.37 3.20 -1.05 -2.69 116.97 119.33 1ikw h TYR 483 Ca -0.06 -0.17 -0.03 0.00 3.14 0.00 0.00 58.73 61.61 1ikw h TYR 483 Cb 1.60 -0.25 0.01 0.00 1.54 0.00 0.00 36.73 39.63 1ikw h TYR 483 CO 0.00 0.92 -0.26 -0.07 -1.64 0.00 0.00 178.16 177.11 1ikw h LEU 484 N 0.82 -0.62 -1.85 2.82 3.38 -1.33 -2.39 115.31 116.14 1ikw h LEU 484 Ca 0.14 -0.03 0.19 0.00 0.09 0.00 0.00 57.88 58.27 1ikw h LEU 484 Cb 0.58 0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.46 1ikw h LEU 484 CO 0.04 -0.35 0.64 0.00 0.09 0.00 0.00 178.44 178.86 1ikw h ALA 485 N -0.49 2.47 0.05 1.53 0.00 -1.42 0.14 119.26 121.54 1ikw h ALA 485 Ca -0.07 -0.02 -0.25 0.00 0.00 0.00 0.00 54.91 54.56 1ikw h ALA 485 Cb 0.61 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 1ikw h ALA 485 CO 0.12 -0.98 -1.27 -0.07 0.00 0.00 0.00 179.25 177.05 1ikw h LEU 486 N 0.00 0.15 0.00 0.00 3.38 -1.13 -3.37 115.31 114.35 1ikw h LEU 486 Ca 0.32 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 58.10 1ikw h LEU 486 Cb 1.59 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 42.29 1ikw h LEU 486 CO -0.00 1.15 0.00 0.00 0.09 0.00 0.00 178.44 179.68 1ikw n GLN 487 N -3.35 0.00 -1.31 1.13 6.02 0.46 -4.05 117.38 116.29 1ikw n GLN 487 Ca -0.08 0.07 -0.40 0.00 -0.01 0.00 0.00 57.00 56.58 1ikw n GLN 487 Cb 0.99 -0.78 -0.03 0.00 1.02 0.00 0.00 30.24 31.44 1ikw n GLN 487 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 1ikw n ASP 488 N -0.72 3.57 -3.59 1.08 8.00 -1.12 -4.76 116.55 119.02 1ikw n ASP 488 Ca 0.00 -2.69 -0.17 0.00 0.71 0.00 0.00 54.79 52.65 1ikw n ASP 488 Cb 0.00 -1.32 -0.07 0.00 -0.02 0.00 0.00 41.12 39.71 1ikw n ASP 488 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1ikw s SER 489 N 4.07 -0.56 1.21 -2.24 0.15 -1.26 -4.89 113.70 110.19 1ikw s SER 489 Ca 0.53 0.66 -0.20 0.00 0.70 0.00 0.00 55.95 57.64 1ikw s SER 489 Cb 0.14 0.59 0.29 0.00 -1.71 0.00 0.00 66.02 65.33 1ikw s SER 489 CO 0.02 -0.53 1.12 -0.83 1.20 0.00 0.00 173.24 174.23 1ikw s GLY 490 N -1.03 1.60 0.32 9.45 0.00 -1.26 -4.91 107.32 111.48 1ikw s GLY 490 Ca -0.10 -1.03 0.23 0.00 0.00 0.00 0.00 44.72 43.82 1ikw s GLY 490 CO 0.08 -0.12 1.71 1.41 0.00 0.00 0.00 173.10 176.17 1ikw h LEU 491 N -2.61 0.00 -7.75 0.66 3.38 -1.95 -3.39 115.31 103.65 1ikw h LEU 491 Ca -0.44 0.00 -0.47 0.00 0.09 0.00 0.00 57.88 57.07 1ikw h LEU 491 Cb 1.28 0.00 -0.35 0.00 0.09 0.00 0.00 40.66 41.68 1ikw h LEU 491 CO 0.31 0.00 -0.79 -1.61 0.09 0.00 0.00 178.44 176.44 1ikw s GLU 492 N -3.49 1.17 -0.12 1.13 2.02 -1.26 -0.11 118.70 118.04 1ikw s GLU 492 Ca -0.00 -0.18 -0.11 0.00 0.02 0.00 0.00 54.97 54.70 1ikw s GLU 492 Cb 0.07 -1.18 0.04 0.00 0.10 0.00 0.00 34.13 33.16 1ikw s GLU 492 CO 0.28 -0.14 0.32 0.54 0.02 0.00 0.00 175.26 176.28 1ikw s VAL 493 N 1.23 -0.01 -0.24 2.63 0.11 -0.40 -4.36 120.40 119.35 1ikw s VAL 493 Ca -0.05 0.02 -0.11 0.00 -2.93 0.00 0.00 61.98 58.91 1ikw s VAL 493 Cb -0.14 -0.46 -0.05 0.00 -1.53 0.00 0.00 36.38 34.20 1ikw s VAL 493 CO -0.02 0.01 0.17 0.20 -3.33 0.00 0.00 175.10 172.13 1ikw s ASN 494 N 0.38 6.11 -0.11 3.54 0.01 -0.26 -1.76 114.94 122.85 1ikw s ASN 494 Ca -0.02 0.11 0.01 0.00 -0.71 0.00 0.00 52.86 52.25 1ikw s ASN 494 Cb -0.04 -2.11 -0.02 0.00 0.41 0.00 0.00 41.25 39.50 1ikw s ASN 494 CO -0.02 0.05 -0.13 -0.63 -1.51 0.00 0.00 177.10 174.86 1ikw s ILE 495 N 1.15 3.06 -0.28 0.60 1.01 0.84 -0.37 121.20 127.21 1ikw s ILE 495 Ca 0.08 -0.68 0.03 0.00 0.00 0.00 0.00 60.65 60.08 1ikw s ILE 495 Cb -0.14 -2.26 0.07 0.00 0.01 0.00 0.00 42.46 40.14 1ikw s ILE 495 CO 0.05 0.54 -0.07 -0.69 0.00 0.00 0.00 174.94 174.77 1ikw s VAL 496 N 0.03 2.20 0.46 2.92 1.01 -0.26 -1.76 120.40 125.01 1ikw s VAL 496 Ca -0.05 -1.79 0.07 0.00 0.00 0.00 0.00 61.98 60.21 1ikw s VAL 496 Cb -0.14 -2.37 -0.01 0.00 0.00 0.00 0.00 36.38 33.86 1ikw s VAL 496 CO 0.04 -0.15 0.37 0.28 0.00 0.00 0.00 175.10 175.64 1ikw s THR 497 N 1.06 2.32 -0.04 3.92 -1.32 -0.60 -2.86 115.64 118.13 1ikw s THR 497 Ca -0.05 -1.42 0.05 0.00 -1.21 0.00 0.00 61.69 59.06 1ikw s THR 497 Cb -0.20 -2.75 0.08 0.00 -1.51 0.00 0.00 72.50 68.12 1ikw s THR 497 CO -0.06 0.00 0.96 -0.90 -2.21 0.00 0.00 174.62 172.41 1ikw n ASP 498 N -1.58 0.82 -4.20 8.08 5.75 -1.26 -1.42 116.55 122.74 1ikw n ASP 498 Ca 0.02 -2.13 -0.41 0.00 -0.01 0.00 0.00 54.79 52.26 1ikw n ASP 498 Cb 0.63 -0.21 -0.06 0.00 -1.03 0.00 0.00 41.12 40.45 1ikw n ASP 498 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 1ikw s SER 499 N -1.35 6.01 0.39 -1.12 0.15 -1.26 -4.38 113.70 112.14 1ikw s SER 499 Ca 0.09 -2.89 0.19 0.00 0.70 0.00 0.00 55.95 54.04 1ikw s SER 499 Cb 0.08 -2.02 1.14 0.00 -1.71 0.00 0.00 66.02 63.50 1ikw s SER 499 CO 0.01 -0.44 1.72 -0.61 1.20 0.00 0.00 173.24 175.12 1ikw h GLN 500 N 7.24 0.34 -0.43 5.44 4.15 -1.94 0.49 115.11 130.40 1ikw h GLN 500 Ca 0.06 -0.02 0.04 0.00 0.77 0.00 0.00 58.65 59.50 1ikw h GLN 500 Cb 0.98 -0.08 -0.04 0.00 0.21 0.00 0.00 27.48 28.55 1ikw h GLN 500 CO 0.75 0.22 0.19 -0.92 -1.93 0.00 0.00 178.83 177.14 1ikw h TYR 501 N 0.35 0.35 -0.41 3.99 3.20 -1.99 0.20 116.97 122.66 1ikw h TYR 501 Ca 0.67 0.02 -0.09 0.00 3.14 0.00 0.00 58.73 62.46 1ikw h TYR 501 Cb 1.71 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 39.87 1ikw h TYR 501 CO -0.00 0.16 -0.10 0.00 -1.64 0.00 0.00 178.16 176.58 1ikw h ALA 502 N 1.25 0.56 -1.01 1.82 0.00 -0.50 -2.68 119.26 118.70 1ikw h ALA 502 Ca 0.19 -0.32 0.04 0.00 0.00 0.00 0.00 54.91 54.82 1ikw h ALA 502 Cb 0.13 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 17.72 1ikw h ALA 502 CO -0.16 0.43 0.66 1.25 0.00 0.00 0.00 179.25 181.43 1ikw h LEU 503 N 0.60 1.10 0.48 0.00 5.85 -0.55 -2.18 115.31 120.62 1ikw h LEU 503 Ca 0.10 -0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.79 1ikw h LEU 503 Cb 0.62 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 41.40 1ikw h LEU 503 CO 0.04 0.76 -0.23 1.23 -0.34 0.00 0.00 178.44 179.89 1ikw h GLY 504 N 1.28 -0.68 0.92 3.75 0.00 -0.33 0.79 103.07 108.80 1ikw h GLY 504 Ca 0.40 0.25 -0.01 0.00 0.00 0.00 0.00 47.33 47.97 1ikw h GLY 504 CO -0.12 -0.25 -0.18 -2.22 0.00 0.00 0.00 176.54 173.77 1ikw h ILE 505 N -0.68 0.62 -0.69 2.60 2.04 -1.32 -3.10 117.51 116.98 1ikw h ILE 505 Ca -0.07 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.74 1ikw h ILE 505 Cb 0.51 0.62 -0.03 0.00 -0.74 0.00 0.00 36.82 37.18 1ikw h ILE 505 CO 0.11 0.00 0.22 0.40 0.00 0.00 0.00 178.15 178.88 1ikw h ILE 506 N -0.47 1.25 -0.01 -0.67 2.04 -1.43 -2.85 117.51 115.38 1ikw h ILE 506 Ca -0.03 -0.87 0.00 0.00 1.00 0.00 0.00 64.86 64.96 1ikw h ILE 506 Cb 0.38 0.52 -0.00 0.00 -0.74 0.00 0.00 36.82 36.98 1ikw h ILE 506 CO 0.03 0.34 0.03 -0.61 0.00 0.00 0.00 178.15 177.94 1ikw h GLN 507 N 1.01 0.00 -1.12 2.37 4.15 -0.79 -2.43 115.11 118.30 1ikw h GLN 507 Ca 0.22 0.00 -0.44 0.00 0.77 0.00 0.00 58.65 59.20 1ikw h GLN 507 Cb 0.30 0.00 -0.23 0.00 0.21 0.00 0.00 27.48 27.76 1ikw h GLN 507 CO -0.01 0.00 0.57 0.00 -1.93 0.00 0.00 178.83 177.46 1ikw n ALA 508 N -2.18 5.26 -3.20 3.38 0.00 -1.07 -4.94 120.51 117.76 1ikw n ALA 508 Ca -0.03 -2.37 -0.07 0.00 0.00 0.00 0.00 53.44 50.97 1ikw n ALA 508 Cb 0.10 -1.45 -0.01 0.00 0.00 0.00 0.00 19.45 18.09 1ikw n ALA 508 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1ikw n GLN 509 N -0.54 -0.96 -2.38 0.00 6.02 -0.92 -4.80 117.38 113.80 1ikw n GLN 509 Ca 0.46 -0.16 -0.40 0.00 -0.01 0.00 0.00 57.00 56.89 1ikw n GLN 509 Cb 1.03 -0.25 -0.04 0.00 1.02 0.00 0.00 30.24 32.00 1ikw n GLN 509 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 1ikw s PRO 510 N -4.43 4.57 0.00 -1.09 0.04 -1.26 -4.66 135.00 128.16 1ikw s PRO 510 Ca 0.03 1.91 0.09 0.00 0.04 0.00 0.00 61.00 63.08 1ikw s PRO 510 Cb -0.02 -3.16 0.15 0.00 0.04 0.00 0.00 34.50 31.51 1ikw s PRO 510 CO 0.18 0.11 0.96 -0.40 0.04 0.00 0.00 177.00 177.88 1ikw n ASP 511 N 1.14 2.18 -3.66 6.66 5.68 -1.15 -4.95 116.55 122.45 1ikw n ASP 511 Ca -0.01 -1.63 -0.13 0.00 -0.50 0.00 0.00 54.79 52.52 1ikw n ASP 511 Cb 0.44 -0.08 -0.08 0.00 -1.14 0.00 0.00 41.12 40.26 1ikw n ASP 511 CO 0.00 0.00 0.00 -1.59 -1.33 0.00 0.00 177.20 174.28 1ikw s LYS 512 N -0.87 0.71 0.18 0.11 -2.85 -1.17 -5.05 119.74 110.80 1ikw s LYS 512 Ca 0.14 0.89 -0.07 0.00 -1.00 0.00 0.00 55.97 55.94 1ikw s LYS 512 Cb 0.09 0.32 -0.02 0.00 -2.06 0.00 0.00 37.83 36.16 1ikw s LYS 512 CO 0.12 -0.09 0.25 0.45 0.10 0.00 0.00 175.35 176.18 1ikw s SER 513 N 0.48 0.09 0.01 0.03 0.15 -1.26 -2.08 113.70 111.12 1ikw s SER 513 Ca -0.01 -1.03 0.24 0.00 0.70 0.00 0.00 55.95 55.84 1ikw s SER 513 Cb -0.05 0.42 0.23 0.00 -1.71 0.00 0.00 66.02 64.92 1ikw s SER 513 CO -0.01 -0.89 1.21 -0.62 1.20 0.00 0.00 173.24 174.12 1ikw n GLU 514 N -0.23 0.05 -3.10 5.44 1.02 -1.26 -4.83 120.64 117.73 1ikw n GLU 514 Ca -0.04 0.00 -0.36 0.00 -0.02 0.00 0.00 57.16 56.74 1ikw n GLU 514 Cb 0.63 -1.52 -0.06 0.00 -0.02 0.00 0.00 31.44 30.48 1ikw n GLU 514 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1ikw s SER 515 N -3.17 7.02 0.04 1.62 0.15 -1.26 -4.99 113.70 113.11 1ikw s SER 515 Ca 0.09 1.40 -0.17 0.00 0.70 0.00 0.00 55.95 57.97 1ikw s SER 515 Cb 0.16 -2.41 -0.22 0.00 -1.71 0.00 0.00 66.02 61.84 1ikw s SER 515 CO 0.76 -0.01 1.16 -0.08 1.20 0.00 0.00 173.24 176.28 1ikw h GLU 516 N 3.23 0.57 0.64 5.44 4.57 -2.00 -3.09 114.58 123.94 1ikw h GLU 516 Ca -0.48 -0.58 -0.03 0.00 -1.18 0.00 0.00 59.36 57.09 1ikw h GLU 516 Cb 1.19 0.16 0.01 0.00 -0.16 0.00 0.00 28.75 29.94 1ikw h GLU 516 CO 0.65 1.20 -0.31 1.25 -1.18 0.00 0.00 179.01 180.63 1ikw h LEU 517 N 0.16 -0.73 -1.53 1.64 6.46 -1.98 -2.85 115.31 116.48 1ikw h LEU 517 Ca -0.09 -0.01 0.32 0.00 -0.12 0.00 0.00 57.88 57.98 1ikw h LEU 517 Cb 1.46 0.19 -0.09 0.00 -0.73 0.00 0.00 40.66 41.49 1ikw h LEU 517 CO 0.15 -0.45 0.75 0.58 -0.62 0.00 0.00 178.44 178.85 1ikw h VAL 518 N -0.96 0.42 0.00 1.05 2.07 -1.94 1.02 116.25 117.92 1ikw h VAL 518 Ca -0.09 -0.08 -0.12 0.00 0.82 0.00 0.00 66.70 67.23 1ikw h VAL 518 Cb 0.69 0.16 -0.02 0.00 -1.52 0.00 0.00 31.29 30.60 1ikw h VAL 518 CO 0.14 0.04 -0.58 0.78 0.02 0.00 0.00 177.57 177.98 1ikw h ASN 519 N 0.24 0.00 0.06 0.57 2.35 -1.44 -2.76 115.58 114.60 1ikw h ASN 519 Ca 0.63 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 56.38 1ikw h ASN 519 Cb 1.90 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.27 1ikw h ASN 519 CO -0.25 0.58 -0.03 1.56 -1.65 0.00 0.00 177.43 177.64 1ikw h GLN 520 N 0.00 -0.08 0.00 0.81 4.20 0.12 -2.97 115.11 117.18 1ikw h GLN 520 Ca -0.01 0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1ikw h GLN 520 Cb 1.24 0.02 0.00 0.00 0.30 0.00 0.00 27.48 29.04 1ikw h GLN 520 CO 0.08 0.48 0.28 0.82 -0.67 0.00 0.00 178.83 179.81 1ikw h ILE 521 N -0.72 0.00 0.09 2.54 2.04 -0.81 -0.95 117.51 119.69 1ikw h ILE 521 Ca -0.01 0.00 -0.12 0.00 1.00 0.00 0.00 64.86 65.73 1ikw h ILE 521 Cb 0.59 0.51 0.01 0.00 -0.74 0.00 0.00 36.82 37.20 1ikw h ILE 521 CO 0.01 0.00 -0.55 0.40 0.00 0.00 0.00 178.15 178.02 1ikw h ILE 522 N 0.00 1.60 -0.06 -0.67 2.04 -1.33 -2.81 117.51 116.28 1ikw h ILE 522 Ca 0.00 -2.47 0.04 0.00 1.00 0.00 0.00 64.86 63.43 1ikw h ILE 522 Cb 0.55 3.25 -0.06 0.00 -0.74 0.00 0.00 36.82 39.82 1ikw h ILE 522 CO 0.00 0.67 -0.39 -0.33 0.00 0.00 0.00 178.15 178.11 1ikw h GLU 523 N -0.60 -0.49 -0.20 2.37 5.08 -1.12 0.16 114.58 119.78 1ikw h GLU 523 Ca -0.10 0.03 0.02 0.00 -1.00 0.00 0.00 59.36 58.31 1ikw h GLU 523 Cb 1.41 0.11 -0.03 0.00 0.50 0.00 0.00 28.75 30.75 1ikw h GLU 523 CO 0.09 -0.32 -0.16 1.96 -1.00 0.00 0.00 179.01 179.58 1ikw h GLN 524 N -0.50 -0.05 -1.05 2.33 1.08 -1.63 0.15 115.11 115.43 1ikw h GLN 524 Ca 0.07 0.00 0.32 0.00 -1.45 0.00 0.00 58.65 57.59 1ikw h GLN 524 Cb 0.61 0.01 -0.13 0.00 -0.05 0.00 0.00 27.48 27.92 1ikw h GLN 524 CO -0.34 -0.03 0.63 -0.07 -0.95 0.00 0.00 178.83 178.07 1ikw h LEU 525 N -0.05 0.50 0.00 1.46 3.38 -1.06 1.23 115.31 120.76 1ikw h LEU 525 Ca 0.03 0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.16 1ikw h LEU 525 Cb 0.14 0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1ikw h LEU 525 CO -0.22 -0.07 0.00 -0.38 0.09 0.00 0.00 178.44 177.86 1ikw n ILE 526 N -4.91 0.40 -0.10 1.22 5.41 0.47 -3.32 119.36 118.54 1ikw n ILE 526 Ca 0.31 0.10 -0.11 0.00 1.00 0.00 0.00 62.75 64.04 1ikw n ILE 526 Cb 0.99 -0.71 -0.15 0.00 -0.71 0.00 0.00 39.64 39.06 1ikw n ILE 526 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 1ikw n LYS 527 N -1.46 0.68 -0.84 0.38 5.02 0.41 -4.97 118.16 117.38 1ikw n LYS 527 Ca 0.07 0.03 -0.28 0.00 -2.02 0.00 0.00 58.31 56.10 1ikw n LYS 527 Cb 0.25 -1.53 0.22 0.00 -0.02 0.00 0.00 35.03 33.95 1ikw n LYS 527 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1ikw s LYS 528 N -2.50 -0.35 -0.00 1.97 -0.14 -0.65 -4.96 119.74 113.11 1ikw s LYS 528 Ca -0.14 0.66 0.04 0.00 -1.36 0.00 0.00 55.97 55.16 1ikw s LYS 528 Cb 0.07 -1.63 -0.04 0.00 -1.68 0.00 0.00 37.83 34.54 1ikw s LYS 528 CO 0.79 -3.29 0.13 0.39 -0.76 0.00 0.00 175.35 172.60 1ikw n GLU 529 N -4.59 4.23 -3.35 1.68 1.02 0.84 -4.97 120.64 115.50 1ikw n GLU 529 Ca 0.04 -0.01 0.02 0.00 -0.02 0.00 0.00 57.16 57.19 1ikw n GLU 529 Cb 0.56 -0.78 -0.02 0.00 -0.02 0.00 0.00 31.44 31.17 1ikw n GLU 529 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1ikw s LYS 530 N -1.59 0.52 -0.07 3.49 1.02 -1.03 -5.01 119.74 117.07 1ikw s LYS 530 Ca 0.01 1.10 0.03 0.00 0.02 0.00 0.00 55.97 57.13 1ikw s LYS 530 Cb 0.03 0.64 0.01 0.00 -0.52 0.00 0.00 37.83 37.98 1ikw s LYS 530 CO 0.15 -0.39 -0.17 0.08 -0.92 0.00 0.00 175.35 174.10 1ikw s VAL 531 N 2.85 1.49 -0.12 3.17 1.01 -1.26 -1.28 120.40 126.26 1ikw s VAL 531 Ca 0.07 -0.70 0.03 0.00 0.00 0.00 0.00 61.98 61.38 1ikw s VAL 531 Cb -0.13 -1.31 0.01 0.00 0.00 0.00 0.00 36.38 34.95 1ikw s VAL 531 CO -0.19 0.43 -0.21 -0.47 0.00 0.00 0.00 175.10 174.66 1ikw s TYR 532 N 0.43 2.44 -0.12 5.22 5.04 -0.72 -0.81 117.35 128.83 1ikw s TYR 532 Ca -0.14 -1.15 0.03 0.00 -2.44 0.00 0.00 57.07 53.37 1ikw s TYR 532 Cb -0.16 -1.67 0.00 0.00 0.35 0.00 0.00 41.96 40.48 1ikw s TYR 532 CO 0.05 -0.52 -0.21 -1.17 -1.34 0.00 0.00 175.55 172.35 1ikw s LEU 533 N 0.73 2.20 0.25 6.97 0.20 -1.26 -0.11 118.68 127.66 1ikw s LEU 533 Ca -0.10 -0.55 0.05 0.00 0.69 0.00 0.00 54.13 54.22 1ikw s LEU 533 Cb -0.16 -1.46 -0.05 0.00 -0.43 0.00 0.00 46.19 44.09 1ikw s LEU 533 CO 0.01 0.12 -0.04 0.00 -0.29 0.00 0.00 176.35 176.15 1ikw s ALA 534 N 0.57 2.09 0.07 5.97 0.00 -0.72 -5.00 121.76 124.74 1ikw s ALA 534 Ca -0.12 -1.83 0.06 0.00 0.00 0.00 0.00 51.96 50.07 1ikw s ALA 534 Cb -0.17 0.30 -0.03 0.00 0.00 0.00 0.00 23.12 23.22 1ikw s ALA 534 CO 0.04 -0.14 -0.16 -0.46 0.00 0.00 0.00 175.76 175.03 1ikw s TRP 535 N -3.19 1.38 -0.04 0.00 -0.00 -1.26 -1.56 118.94 114.28 1ikw s TRP 535 Ca 0.28 -0.43 -0.10 0.00 -0.00 0.00 0.00 56.10 55.86 1ikw s TRP 535 Cb 0.04 -0.78 0.02 0.00 -0.00 0.00 0.00 33.47 32.75 1ikw s TRP 535 CO 0.10 0.09 0.23 0.14 -0.00 0.00 0.00 176.95 177.51 1ikw s VAL 536 N -1.15 0.05 0.06 5.86 -7.23 -0.51 -4.95 120.40 112.53 1ikw s VAL 536 Ca 0.01 -0.38 -0.37 0.00 -1.81 0.00 0.00 61.98 59.43 1ikw s VAL 536 Cb -0.10 -0.46 -0.16 0.00 0.56 0.00 0.00 36.38 36.22 1ikw s VAL 536 CO 0.03 -0.21 1.41 -2.65 -0.31 0.00 0.00 175.10 173.36 1ikw n PRO 537 N 1.92 1.27 -2.11 4.82 -0.02 -1.26 -4.13 135.00 135.49 1ikw n PRO 537 Ca -0.19 0.46 -0.39 0.00 -2.02 0.00 0.00 63.50 61.36 1ikw n PRO 537 Cb 0.57 -2.12 -0.00 0.00 -0.02 0.00 0.00 33.50 31.92 1ikw n PRO 537 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ikw s ALA 538 N 0.86 3.15 -0.35 3.55 0.00 -1.26 -3.85 121.76 123.87 1ikw s ALA 538 Ca 0.85 1.14 -0.01 0.00 0.00 0.00 0.00 51.96 53.94 1ikw s ALA 538 Cb -0.93 -3.46 0.01 0.00 0.00 0.00 0.00 23.12 18.74 1ikw s ALA 538 CO 0.48 -0.79 0.02 0.72 0.00 0.00 0.00 175.76 176.19 1ikw n HIS 539 N -0.09 -0.27 0.09 0.00 8.25 -1.26 -4.67 115.22 117.27 1ikw n HIS 539 Ca 0.05 0.13 0.05 0.00 -0.26 0.00 0.00 57.72 57.69 1ikw n HIS 539 Cb 0.45 -0.57 0.09 0.00 1.12 0.00 0.00 29.99 31.08 1ikw n HIS 539 CO 0.00 0.00 0.00 1.17 0.64 0.00 0.00 176.34 178.15 1ikw n LYS 540 N -1.69 1.77 -2.18 -0.41 3.00 -1.25 -5.03 118.16 112.37 1ikw n LYS 540 Ca -0.05 -1.58 -0.03 0.00 -0.00 0.00 0.00 58.31 56.64 1ikw n LYS 540 Cb 0.14 -1.21 0.00 0.00 0.00 0.00 0.00 35.03 33.96 1ikw n LYS 540 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1ikw n GLY 541 N 0.45 -0.93 3.31 3.14 0.00 -1.26 -5.09 105.19 104.81 1ikw n GLY 541 Ca 0.08 0.45 -0.26 0.00 0.00 0.00 0.00 46.02 46.29 1ikw n GLY 541 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ikw s ILE 542 N -2.11 1.87 -0.58 -0.61 -1.09 -1.26 -4.93 121.20 112.49 1ikw s ILE 542 Ca 0.09 -1.53 -0.30 0.00 -2.23 0.00 0.00 60.65 56.68 1ikw s ILE 542 Cb -0.03 -1.67 -0.13 0.00 -1.58 0.00 0.00 42.46 39.06 1ikw s ILE 542 CO 0.37 0.05 2.42 0.61 -1.23 0.00 0.00 174.94 177.16 1ikw n GLY 543 N 1.21 0.11 0.00 6.18 0.00 -1.26 -1.54 105.19 109.89 1ikw n GLY 543 Ca -0.19 0.88 0.00 0.00 0.00 0.00 0.00 46.02 46.72 1ikw n GLY 543 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ikw n GLY 544 N 6.31 2.77 0.30 -0.02 0.00 -1.26 -4.85 105.19 108.44 1ikw n GLY 544 Ca 0.46 -0.82 -0.05 0.00 0.00 0.00 0.00 46.02 45.62 1ikw n GLY 544 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1ikw h ASN 545 N 0.00 0.88 0.44 1.61 -0.73 -1.77 -1.77 115.58 114.25 1ikw h ASN 545 Ca 0.00 -0.04 -0.01 0.00 1.87 0.00 0.00 56.30 58.12 1ikw h ASN 545 Cb 0.00 -0.22 -0.01 0.00 0.27 0.00 0.00 38.32 38.35 1ikw h ASN 545 CO 0.00 0.65 -0.35 -0.08 -0.37 0.00 0.00 177.43 177.28 1ikw h GLU 546 N 1.03 -0.76 -0.06 6.67 4.81 -1.61 0.26 114.58 124.92 1ikw h GLU 546 Ca 0.28 0.05 0.04 0.00 -0.13 0.00 0.00 59.36 59.60 1ikw h GLU 546 Cb -0.09 0.17 -0.06 0.00 0.63 0.00 0.00 28.75 29.40 1ikw h GLU 546 CO -0.06 -0.51 -0.32 0.37 -0.73 0.00 0.00 179.01 177.76 1ikw h GLN 547 N -0.79 -0.42 -0.29 1.92 -0.00 -1.73 0.12 115.11 113.91 1ikw h GLN 547 Ca -0.04 0.03 -0.00 0.00 -0.00 0.00 0.00 58.65 58.63 1ikw h GLN 547 Cb 0.68 0.10 -0.01 0.00 0.00 0.00 0.00 27.48 28.24 1ikw h GLN 547 CO -0.01 -0.28 0.17 0.28 0.00 0.00 0.00 178.83 178.99 1ikw h VAL 548 N -0.44 1.12 -1.07 2.39 2.07 -1.29 -1.67 116.25 117.36 1ikw h VAL 548 Ca 0.08 -0.30 0.29 0.00 0.82 0.00 0.00 66.70 67.58 1ikw h VAL 548 Cb 0.56 0.79 -0.10 0.00 -1.52 0.00 0.00 31.29 31.02 1ikw h VAL 548 CO -0.31 0.12 0.69 -0.78 0.02 0.00 0.00 177.57 177.31 1ikw h ASP 549 N 0.36 0.41 0.57 0.57 -0.00 0.21 0.61 116.42 119.15 1ikw h ASP 549 Ca 0.10 0.09 -0.03 0.00 -0.00 0.00 0.00 57.03 57.19 1ikw h ASP 549 Cb 0.04 0.03 0.01 0.00 -0.00 0.00 0.00 39.33 39.41 1ikw h ASP 549 CO -0.02 0.05 -0.27 0.50 -0.00 0.00 0.00 179.24 179.50 1ikw h LYS 550 N 0.35 -0.74 0.00 0.28 1.63 0.21 0.34 116.57 118.64 1ikw h LYS 550 Ca 0.62 0.05 0.00 0.00 -0.85 0.00 0.00 60.65 60.47 1ikw h LYS 550 Cb 1.64 0.17 0.00 0.00 -0.60 0.00 0.00 32.23 33.44 1ikw h LYS 550 CO -0.31 -0.46 0.00 1.47 -3.45 0.00 0.00 179.45 176.70 1ikw n LEU 551 N -5.39 0.00 -0.01 5.20 -0.00 -0.79 -0.86 117.00 115.15 1ikw n LEU 551 Ca -0.12 0.48 -0.20 0.00 -0.00 0.00 0.00 56.01 56.16 1ikw n LEU 551 Cb 0.33 -0.48 -0.14 0.00 -0.00 0.00 0.00 43.42 43.13 1ikw n LEU 551 CO 0.36 -0.08 -0.20 0.58 -0.00 0.00 0.00 177.39 178.04 1ikw h VAL 552 N 0.00 1.24 -0.33 1.47 2.07 -0.54 -3.38 116.25 116.78 1ikw h VAL 552 Ca 0.00 -2.39 0.00 0.00 0.82 0.00 0.00 66.70 65.13 1ikw h VAL 552 Cb 0.39 2.86 0.00 0.00 -1.52 0.00 0.00 31.29 33.02 1ikw h VAL 552 CO 0.00 0.64 0.00 -1.54 0.02 0.00 0.00 177.57 176.69 1ikw n SER 553 N -4.15 3.10 -4.57 0.57 3.41 0.12 -4.54 113.62 107.55 1ikw n SER 553 Ca -0.21 -1.90 -0.41 0.00 -0.26 0.00 0.00 58.87 56.09 1ikw n SER 553 Cb 0.78 -0.21 -0.03 0.00 -0.26 0.00 0.00 64.21 64.49 1ikw n SER 553 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ikw s ALA 554 N -1.24 2.68 0.16 7.33 0.00 -0.04 -4.45 121.76 126.20 1ikw s ALA 554 Ca 0.31 -0.68 0.00 0.00 0.00 0.00 0.00 51.96 51.59 1ikw s ALA 554 Cb 0.18 -4.15 0.00 0.00 0.00 0.00 0.00 23.12 19.15 1ikw s ALA 554 CO 0.25 -3.14 0.00 0.41 0.00 0.00 0.00 175.76 173.28 1ikw n GLY 555 N 5.37 -3.16 3.33 0.00 0.00 -1.26 -4.91 105.19 104.57 1ikw n GLY 555 Ca 0.14 -1.17 -0.16 0.00 0.00 0.00 0.00 46.02 44.82 1ikw n GLY 555 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1ikw n ILE 556 N -1.75 -7.89 -1.42 -0.61 -5.35 -1.26 -5.01 119.36 96.07 1ikw n ILE 556 Ca 0.00 -1.02 0.00 0.00 -0.27 0.00 0.00 62.75 61.46 1ikw n ILE 556 Cb 0.12 -5.89 0.00 0.00 -1.74 0.00 0.00 39.64 32.14 1ikw n ILE 556 CO 0.00 0.00 0.00 -1.14 -1.76 0.00 0.00 176.55 173.65