#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fsr s LYS 2 N 0.00 4.10 -0.29 3.17 2.20 -1.26 -0.56 119.74 127.10 3fsr s LYS 2 Ca 0.00 0.89 -0.18 0.00 -0.36 0.00 0.00 55.97 56.32 3fsr s LYS 2 Cb 0.00 -2.30 0.14 0.00 -1.51 0.00 0.00 37.83 34.16 3fsr s LYS 2 CO 0.00 0.05 0.98 0.20 -0.36 0.00 0.00 175.35 176.22 3fsr s GLY 3 N -2.27 -0.06 -0.41 5.54 0.00 -0.84 -2.07 107.32 107.22 3fsr s GLY 3 Ca 0.58 3.02 -0.26 0.00 0.00 0.00 0.00 44.72 48.06 3fsr s GLY 3 CO 0.16 2.41 0.93 -0.12 0.00 0.00 0.00 173.10 176.48 3fsr s PHE 4 N 1.09 3.01 0.29 1.90 5.36 -0.14 -1.08 117.98 128.41 3fsr s PHE 4 Ca -0.06 0.62 0.10 0.00 -0.96 0.00 0.00 56.93 56.63 3fsr s PHE 4 Cb -0.04 -3.79 -0.05 0.00 -0.34 0.00 0.00 43.02 38.80 3fsr s PHE 4 CO -0.13 -0.94 -0.16 0.00 -1.46 0.00 0.00 175.22 172.53 3fsr s ALA 5 N 3.60 2.68 -0.37 11.12 0.00 -0.62 -1.47 121.76 136.69 3fsr s ALA 5 Ca 0.38 -1.91 -0.24 0.00 0.00 0.00 0.00 51.96 50.19 3fsr s ALA 5 Cb -0.11 -0.15 0.01 0.00 0.00 0.00 0.00 23.12 22.87 3fsr s ALA 5 CO 0.22 0.17 0.81 1.41 0.00 0.00 0.00 175.76 178.37 3fsr s MET 6 N -3.57 3.73 0.07 0.00 1.75 0.69 -0.98 119.30 121.00 3fsr s MET 6 Ca 0.30 0.32 -0.13 0.00 -1.25 0.00 0.00 55.69 54.92 3fsr s MET 6 Cb -0.02 -3.82 -0.25 0.00 2.84 0.00 0.00 34.83 33.58 3fsr s MET 6 CO 0.14 -0.90 1.16 -0.07 -0.65 0.00 0.00 175.02 174.70 3fsr h LEU 7 N 9.85 0.86 -7.39 4.11 3.38 -0.84 0.97 115.31 126.25 3fsr h LEU 7 Ca -0.24 -0.74 0.27 0.00 0.09 0.00 0.00 57.88 57.26 3fsr h LEU 7 Cb 1.09 -0.27 -0.10 0.00 0.09 0.00 0.00 40.66 41.47 3fsr h LEU 7 CO 0.93 1.54 0.71 -0.94 0.09 0.00 0.00 178.44 180.77 3fsr s SER 8 N -7.34 -0.10 -0.06 -0.43 1.04 -1.02 -3.34 113.70 102.45 3fsr s SER 8 Ca -0.09 -0.24 -0.39 0.00 0.48 0.00 0.00 55.95 55.71 3fsr s SER 8 Cb 0.06 0.28 -0.17 0.00 0.10 0.00 0.00 66.02 66.30 3fsr s SER 8 CO 0.92 -0.52 1.44 2.30 0.98 0.00 0.00 173.24 178.36 3fsr n ILE 9 N -0.49 0.09 0.00 -1.02 -5.35 -1.26 0.47 119.36 111.79 3fsr n ILE 9 Ca -0.08 -0.02 0.00 0.00 -0.27 0.00 0.00 62.75 62.39 3fsr n ILE 9 Cb 0.62 -0.83 0.00 0.00 -1.74 0.00 0.00 39.64 37.70 3fsr n ILE 9 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3fsr n GLY 10 N 2.97 2.44 3.16 3.28 0.00 0.24 -4.99 105.19 112.30 3fsr n GLY 10 Ca 0.22 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.94 3fsr n GLY 10 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3fsr s LYS 11 N -0.22 2.65 0.13 1.61 1.02 0.18 -4.96 119.74 120.15 3fsr s LYS 11 Ca 0.00 -0.74 0.02 0.00 0.02 0.00 0.00 55.97 55.26 3fsr s LYS 11 Cb 0.00 -2.04 -0.04 0.00 -0.52 0.00 0.00 37.83 35.23 3fsr s LYS 11 CO 0.00 0.14 -0.04 0.14 -0.92 0.00 0.00 175.35 174.67 3fsr s VAL 12 N 0.43 0.69 0.00 3.17 -7.23 -1.26 -0.14 120.40 116.07 3fsr s VAL 12 Ca -0.18 -1.96 0.00 0.00 -1.81 0.00 0.00 61.98 58.04 3fsr s VAL 12 Cb -0.17 -1.86 0.00 0.00 0.56 0.00 0.00 36.38 34.91 3fsr s VAL 12 CO 0.07 -0.71 0.00 0.61 -0.31 0.00 0.00 175.10 174.76 3fsr n GLY 13 N -0.12 1.38 3.72 2.32 0.00 -0.15 -4.81 105.19 107.52 3fsr n GLY 13 Ca -0.10 -0.82 -0.42 0.00 0.00 0.00 0.00 46.02 44.68 3fsr n GLY 13 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3fsr s TRP 14 N -2.00 3.34 0.24 1.61 0.52 -1.26 -1.59 118.94 119.80 3fsr s TRP 14 Ca 0.00 1.14 0.01 0.00 0.02 0.00 0.00 56.10 57.27 3fsr s TRP 14 Cb 0.00 -3.55 -0.05 0.00 -1.15 0.00 0.00 33.47 28.72 3fsr s TRP 14 CO 0.00 -1.83 0.07 0.96 0.02 0.00 0.00 176.95 176.17 3fsr s ILE 15 N 0.98 0.61 -0.21 2.03 -4.36 -0.24 -4.95 121.20 115.06 3fsr s ILE 15 Ca 0.61 -2.00 -0.06 0.00 -0.26 0.00 0.00 60.65 58.95 3fsr s ILE 15 Cb -0.33 -2.51 -0.03 0.00 1.25 0.00 0.00 42.46 40.84 3fsr s ILE 15 CO 0.30 -0.12 0.02 -0.70 0.24 0.00 0.00 174.94 174.69 3fsr s GLU 16 N -4.00 3.69 0.14 0.37 2.56 -1.26 -1.98 118.70 118.20 3fsr s GLU 16 Ca 0.34 -0.48 0.07 0.00 0.00 0.00 0.00 54.97 54.90 3fsr s GLU 16 Cb 0.07 -3.15 -0.04 0.00 2.00 0.00 0.00 34.13 33.01 3fsr s GLU 16 CO 0.11 0.02 -0.15 0.15 -0.56 0.00 0.00 175.26 174.83 3fsr s LYS 17 N 1.02 1.10 0.07 4.30 1.02 0.27 -4.92 119.74 122.60 3fsr s LYS 17 Ca 0.03 -1.29 -0.30 0.00 0.02 0.00 0.00 55.97 54.42 3fsr s LYS 17 Cb -0.14 -1.04 -0.09 0.00 -0.52 0.00 0.00 37.83 36.03 3fsr s LYS 17 CO 0.02 0.20 1.89 -2.00 -0.92 0.00 0.00 175.35 174.54 3fsr s GLU 18 N -2.71 4.14 0.18 1.68 2.12 -1.26 0.78 118.70 123.63 3fsr s GLU 18 Ca 0.11 2.58 -0.31 0.00 0.36 0.00 0.00 54.97 57.70 3fsr s GLU 18 Cb -0.05 -3.91 -0.10 0.00 0.26 0.00 0.00 34.13 30.33 3fsr s GLU 18 CO 0.04 -0.90 1.51 0.21 -0.54 0.00 0.00 175.26 175.58 3fsr s LYS 19 N 3.70 4.24 0.63 4.30 2.20 -1.26 -4.85 119.74 128.71 3fsr s LYS 19 Ca 0.84 2.30 -0.15 0.00 -0.36 0.00 0.00 55.97 58.60 3fsr s LYS 19 Cb -0.43 -3.16 -0.01 0.00 -1.51 0.00 0.00 37.83 32.72 3fsr s LYS 19 CO 0.39 -0.53 1.10 -1.25 -0.36 0.00 0.00 175.35 174.69 3fsr s PRO 20 N 0.75 2.98 0.08 4.03 0.05 -1.26 -5.04 135.00 136.58 3fsr s PRO 20 Ca 0.66 1.35 0.09 0.00 0.05 0.00 0.00 61.00 63.16 3fsr s PRO 20 Cb -0.42 -1.98 -0.03 0.00 0.05 0.00 0.00 34.50 32.12 3fsr s PRO 20 CO 0.34 -1.10 -0.25 0.00 0.05 0.00 0.00 177.00 176.04 3fsr s ALA 21 N -2.34 2.17 0.18 8.56 0.00 -1.26 -4.98 121.76 124.10 3fsr s ALA 21 Ca 0.66 -1.30 -0.25 0.00 0.00 0.00 0.00 51.96 51.08 3fsr s ALA 21 Cb -0.19 -0.40 -0.08 0.00 0.00 0.00 0.00 23.12 22.44 3fsr s ALA 21 CO 0.39 0.50 0.78 -1.25 0.00 0.00 0.00 175.76 176.18 3fsr s PRO 22 N -1.55 4.54 1.23 0.00 0.05 -1.26 -5.04 135.00 132.97 3fsr s PRO 22 Ca 0.11 1.14 -0.19 0.00 0.05 0.00 0.00 61.00 62.11 3fsr s PRO 22 Cb -0.10 -3.19 0.29 0.00 0.05 0.00 0.00 34.50 31.56 3fsr s PRO 22 CO 0.03 0.53 1.07 0.20 0.05 0.00 0.00 177.00 178.89 3fsr s GLY 23 N -1.24 1.55 0.58 0.56 0.00 -1.26 -4.79 107.32 102.72 3fsr s GLY 23 Ca 0.37 -0.82 0.30 0.00 0.00 0.00 0.00 44.72 44.57 3fsr s GLY 23 CO 0.26 0.05 1.84 -2.55 0.00 0.00 0.00 173.10 172.70 3fsr h PRO 24 N -2.69 0.00 -0.03 2.90 0.11 -1.97 -2.17 132.00 128.16 3fsr h PRO 24 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3fsr h PRO 24 Cb 1.31 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.42 3fsr h PRO 24 CO 0.36 0.00 0.00 1.19 -0.21 0.00 0.00 178.00 179.34 3fsr n PHE 25 N -3.79 0.02 -3.18 0.65 3.72 -1.26 -0.71 117.46 112.90 3fsr n PHE 25 Ca 0.12 -0.02 -0.18 0.00 -0.05 0.00 0.00 57.45 57.32 3fsr n PHE 25 Cb 0.82 -0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.36 3fsr n PHE 25 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 3fsr s ASP 26 N -0.92 5.44 0.04 4.37 1.01 -0.82 -1.00 116.67 124.79 3fsr s ASP 26 Ca 0.13 -0.55 0.04 0.00 0.71 0.00 0.00 52.55 52.88 3fsr s ASP 26 Cb 0.09 -0.57 -0.02 0.00 1.01 0.00 0.00 42.92 43.44 3fsr s ASP 26 CO 0.14 -0.77 -0.11 0.00 0.21 0.00 0.00 175.17 174.64 3fsr s ALA 27 N -2.41 0.87 -0.10 5.23 0.00 -0.67 -1.60 121.76 123.07 3fsr s ALA 27 Ca 0.53 -0.74 -0.12 0.00 0.00 0.00 0.00 51.96 51.64 3fsr s ALA 27 Cb -0.08 -0.09 -0.05 0.00 0.00 0.00 0.00 23.12 22.91 3fsr s ALA 27 CO 0.32 0.12 0.28 0.42 0.00 0.00 0.00 175.76 176.89 3fsr s ILE 28 N -0.96 5.28 -0.01 0.00 -1.09 -0.29 -0.87 121.20 123.26 3fsr s ILE 28 Ca -0.03 0.52 0.03 0.00 -2.23 0.00 0.00 60.65 58.95 3fsr s ILE 28 Cb -0.08 -3.58 -0.01 0.00 -1.58 0.00 0.00 42.46 37.22 3fsr s ILE 28 CO 0.01 0.53 -0.11 -0.69 -1.23 0.00 0.00 174.94 173.45 3fsr s VAL 29 N -0.52 0.88 -0.12 2.92 1.01 -0.33 -1.28 120.40 122.96 3fsr s VAL 29 Ca 0.18 -0.46 -0.05 0.00 0.00 0.00 0.00 61.98 61.65 3fsr s VAL 29 Cb -0.14 -0.75 -0.04 0.00 0.00 0.00 0.00 36.38 35.46 3fsr s VAL 29 CO 0.07 0.26 0.05 0.00 0.00 0.00 0.00 175.10 175.47 3fsr s ARG 30 N -0.16 3.40 0.29 2.72 1.70 -0.41 -0.91 118.95 125.59 3fsr s ARG 30 Ca 0.02 -0.33 -0.29 0.00 -0.47 0.00 0.00 55.73 54.66 3fsr s ARG 30 Cb -0.05 -3.01 -0.10 0.00 -0.57 0.00 0.00 34.95 31.22 3fsr s ARG 30 CO -0.00 0.57 1.37 -2.14 -1.08 0.00 0.00 175.30 174.02 3fsr s PRO 31 N -0.49 4.31 -0.12 3.89 0.02 -1.26 -1.11 135.00 140.24 3fsr s PRO 31 Ca 0.10 2.26 0.16 0.00 0.02 0.00 0.00 61.00 63.54 3fsr s PRO 31 Cb -0.12 -3.09 -0.23 0.00 0.02 0.00 0.00 34.50 31.08 3fsr s PRO 31 CO 0.02 -0.30 0.17 1.28 -0.33 0.00 0.00 177.00 177.83 3fsr n LEU 32 N 1.53 0.00 -3.64 -5.54 4.77 0.59 -4.78 117.00 109.93 3fsr n LEU 32 Ca 0.03 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 55.94 3fsr n LEU 32 Cb 0.41 0.29 -0.07 0.00 -2.33 0.00 0.00 43.42 41.72 3fsr n LEU 32 CO 0.60 0.29 0.46 0.00 -1.33 0.00 0.00 177.39 177.41 3fsr s ALA 33 N -2.68 -1.96 0.21 -1.18 0.00 -1.01 -1.47 121.76 113.66 3fsr s ALA 33 Ca -0.08 2.29 0.04 0.00 0.00 0.00 0.00 51.96 54.22 3fsr s ALA 33 Cb 0.07 -1.46 -0.05 0.00 0.00 0.00 0.00 23.12 21.68 3fsr s ALA 33 CO 0.71 -0.36 -0.04 0.14 0.00 0.00 0.00 175.76 176.21 3fsr s VAL 34 N 1.32 1.15 -0.01 0.00 -7.23 -0.61 -1.55 120.40 113.46 3fsr s VAL 34 Ca -0.08 -2.06 -0.00 0.00 -1.81 0.00 0.00 61.98 58.03 3fsr s VAL 34 Cb -0.05 -2.18 0.01 0.00 0.56 0.00 0.00 36.38 34.72 3fsr s VAL 34 CO -0.15 -0.47 0.03 0.00 -0.31 0.00 0.00 175.10 174.20 3fsr s ALA 35 N -3.34 0.00 0.49 1.32 0.00 -1.02 -0.12 121.76 119.09 3fsr s ALA 35 Ca 0.25 0.18 -0.12 0.00 0.00 0.00 0.00 51.96 52.27 3fsr s ALA 35 Cb 0.04 -0.14 -0.06 0.00 0.00 0.00 0.00 23.12 22.96 3fsr s ALA 35 CO 0.06 -0.06 0.89 -1.25 0.00 0.00 0.00 175.76 175.41 3fsr s PRO 36 N 0.50 3.77 0.17 0.00 0.04 -1.25 -4.36 135.00 133.87 3fsr s PRO 36 Ca -0.04 0.65 0.09 0.00 0.04 0.00 0.00 61.00 61.74 3fsr s PRO 36 Cb -0.06 -2.24 -0.04 0.00 0.04 0.00 0.00 34.50 32.20 3fsr s PRO 36 CO -0.02 -0.24 -0.20 0.00 0.04 0.00 0.00 177.00 176.59 3fsr h THR 38 N 3.32 0.51 -0.83 0.00 2.02 -1.97 -1.79 112.91 114.17 3fsr h THR 38 Ca -0.44 -0.17 -0.01 0.00 0.77 0.00 0.00 66.41 66.57 3fsr h THR 38 Cb 1.20 -0.03 -0.04 0.00 -1.74 0.00 0.00 68.15 67.54 3fsr h THR 38 CO 0.49 0.09 0.50 0.77 0.37 0.00 0.00 175.52 177.74 3fsr h SER 39 N 0.50 1.01 -0.74 4.18 4.64 -1.99 -1.96 113.55 119.18 3fsr h SER 39 Ca 0.64 -0.07 -0.02 0.00 -0.47 0.00 0.00 61.79 61.87 3fsr h SER 39 Cb 1.37 -0.25 -0.04 0.00 -0.31 0.00 0.00 62.40 63.17 3fsr h SER 39 CO -0.42 0.78 0.39 0.44 -0.87 0.00 0.00 176.83 177.15 3fsr h ASP 40 N 1.15 0.96 0.90 4.97 3.32 -1.73 0.11 116.42 126.10 3fsr h ASP 40 Ca 0.30 -0.09 -0.04 0.00 0.02 0.00 0.00 57.03 57.21 3fsr h ASP 40 Cb -0.04 -0.25 0.01 0.00 0.22 0.00 0.00 39.33 39.27 3fsr h ASP 40 CO -0.06 0.79 -0.43 0.40 -1.72 0.00 0.00 179.24 178.22 3fsr h ILE 41 N 1.07 0.07 -0.92 0.35 1.08 -1.32 -1.13 117.51 116.71 3fsr h ILE 41 Ca 0.27 -0.06 0.17 0.00 -0.39 0.00 0.00 64.86 64.85 3fsr h ILE 41 Cb 0.07 0.07 -0.08 0.00 -3.07 0.00 0.00 36.82 33.82 3fsr h ILE 41 CO -0.04 0.00 0.59 0.45 -0.69 0.00 0.00 178.15 178.46 3fsr h HIS 42 N -1.26 0.76 -0.35 1.37 3.86 -1.26 0.13 115.15 118.39 3fsr h HIS 42 Ca -0.12 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.10 3fsr h HIS 42 Cb 0.93 -0.23 -0.02 0.00 1.06 0.00 0.00 27.41 29.15 3fsr h HIS 42 CO -0.00 0.23 0.20 1.15 0.86 0.00 0.00 177.93 180.37 3fsr h THR 43 N 0.60 1.14 0.00 2.45 2.02 -0.56 -0.62 112.91 117.95 3fsr h THR 43 Ca 0.48 -0.35 -0.01 0.00 0.77 0.00 0.00 66.41 67.30 3fsr h THR 43 Cb 0.92 0.73 0.00 0.00 -1.74 0.00 0.00 68.15 68.05 3fsr h THR 43 CO -0.23 0.14 -0.05 0.58 0.37 0.00 0.00 175.52 176.33 3fsr h VAL 44 N 0.45 1.64 0.00 3.16 2.07 -0.21 -3.26 116.25 120.10 3fsr h VAL 44 Ca 0.13 -1.96 -0.04 0.00 0.82 0.00 0.00 66.70 65.65 3fsr h VAL 44 Cb 0.05 2.96 -0.01 0.00 -1.52 0.00 0.00 31.29 32.77 3fsr h VAL 44 CO -0.02 0.51 -1.79 0.49 0.02 0.00 0.00 177.57 176.78 3fsr n PHE 45 N -4.65 0.26 -0.48 1.57 3.72 0.34 0.82 117.46 119.04 3fsr n PHE 45 Ca -0.10 0.08 0.06 0.00 -0.05 0.00 0.00 57.45 57.44 3fsr n PHE 45 Cb 0.42 -0.68 0.14 0.00 -0.94 0.00 0.00 39.48 38.43 3fsr n PHE 45 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 3fsr n GLU 46 N -2.43 2.64 -2.73 -1.08 4.71 -0.30 -4.73 120.64 116.73 3fsr n GLU 46 Ca -0.06 -2.19 -0.16 0.00 -0.01 0.00 0.00 57.16 54.74 3fsr n GLU 46 Cb 0.63 -1.38 -0.00 0.00 -1.01 0.00 0.00 31.44 29.68 3fsr n GLU 46 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3fsr n GLY 47 N -0.33 -0.50 0.43 0.62 0.00 -1.05 -4.83 105.19 99.53 3fsr n GLY 47 Ca 0.12 0.03 0.25 0.00 0.00 0.00 0.00 46.02 46.42 3fsr n GLY 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fsr h ALA 48 N 0.99 2.40 0.00 4.61 0.00 -1.52 -1.37 119.26 124.37 3fsr h ALA 48 Ca -0.34 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.60 3fsr h ALA 48 Cb 1.24 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.07 3fsr h ALA 48 CO 0.41 -0.77 -0.00 0.44 0.00 0.00 0.00 179.25 179.32 3fsr n ILE 49 N -4.52 1.54 0.00 0.00 -5.35 -1.26 -4.84 119.36 104.93 3fsr n ILE 49 Ca 0.24 -1.78 0.00 0.00 -0.27 0.00 0.00 62.75 60.94 3fsr n ILE 49 Cb 0.91 0.04 0.00 0.00 -1.74 0.00 0.00 39.64 38.85 3fsr n ILE 49 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3fsr n GLY 50 N -1.08 -0.50 3.77 3.28 0.00 -0.52 -4.95 105.19 105.19 3fsr n GLY 50 Ca 0.10 -1.79 -0.37 0.00 0.00 0.00 0.00 46.02 43.96 3fsr n GLY 50 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3fsr s GLU 51 N -1.15 3.63 0.07 1.61 0.41 -1.26 -4.88 118.70 117.12 3fsr s GLU 51 Ca 0.00 1.83 -0.03 0.00 -0.41 0.00 0.00 54.97 56.36 3fsr s GLU 51 Cb 0.00 -2.35 -0.03 0.00 -1.78 0.00 0.00 34.13 29.97 3fsr s GLU 51 CO 0.00 -0.67 0.04 1.03 -0.49 0.00 0.00 175.26 175.17 3fsr s ARG 52 N -2.77 0.70 -0.06 1.61 1.81 -1.26 -5.07 118.95 113.91 3fsr s ARG 52 Ca 0.65 -1.15 -0.00 0.00 -1.72 0.00 0.00 55.73 53.51 3fsr s ARG 52 Cb -0.30 0.25 0.03 0.00 -0.45 0.00 0.00 34.95 34.48 3fsr s ARG 52 CO 0.36 -0.17 -0.01 -1.58 -0.68 0.00 0.00 175.30 173.23 3fsr s HIS 53 N -3.91 0.60 -1.54 -0.53 5.65 -1.26 -3.97 115.29 110.32 3fsr s HIS 53 Ca 0.07 -0.13 -0.14 0.00 0.25 0.00 0.00 55.06 55.11 3fsr s HIS 53 Cb 0.07 -0.68 0.09 0.00 -1.18 0.00 0.00 32.58 30.88 3fsr s HIS 53 CO -0.10 -0.25 0.94 0.09 -0.65 0.00 0.00 174.74 174.77 3fsr n ASN 54 N 4.70 -4.69 -4.62 9.88 3.02 0.29 -4.95 115.26 118.90 3fsr n ASN 54 Ca -0.15 -0.78 -0.40 0.00 -0.03 0.00 0.00 54.58 53.22 3fsr n ASN 54 Cb 0.50 -3.76 -0.07 0.00 -0.61 0.00 0.00 39.78 35.85 3fsr n ASN 54 CO 0.00 0.00 0.00 -0.32 -2.62 0.00 0.00 177.26 174.32 3fsr s MET 55 N -6.62 4.06 0.23 3.52 -2.45 -0.94 -4.88 119.30 112.22 3fsr s MET 55 Ca 0.66 0.39 -0.31 0.00 -1.25 0.00 0.00 55.69 55.18 3fsr s MET 55 Cb -0.34 -3.66 -0.11 0.00 1.25 0.00 0.00 34.83 31.97 3fsr s MET 55 CO 0.82 -0.39 1.65 0.42 1.05 0.00 0.00 175.02 178.56 3fsr s ILE 56 N 2.40 2.15 0.74 10.11 1.01 -1.26 -0.22 121.20 136.12 3fsr s ILE 56 Ca 0.23 0.11 -0.03 0.00 0.00 0.00 0.00 60.65 60.96 3fsr s ILE 56 Cb -0.16 -3.07 0.12 0.00 0.01 0.00 0.00 42.46 39.37 3fsr s ILE 56 CO 0.09 0.01 1.02 -0.76 0.00 0.00 0.00 174.94 175.31 3fsr s LEU 57 N 0.56 2.95 0.00 2.97 1.43 -0.55 -0.56 118.68 125.49 3fsr s LEU 57 Ca 0.70 -0.17 0.00 0.00 -1.03 0.00 0.00 54.13 53.62 3fsr s LEU 57 Cb -0.48 -2.20 0.00 0.00 0.03 0.00 0.00 46.19 43.54 3fsr s LEU 57 CO 0.37 -1.90 0.00 0.61 0.23 0.00 0.00 176.35 175.66 3fsr n GLY 58 N -2.93 -1.00 0.32 -3.19 0.00 -1.26 -1.12 105.19 96.01 3fsr n GLY 58 Ca 0.14 -1.33 0.00 0.00 0.00 0.00 0.00 46.02 44.83 3fsr n GLY 58 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 3fsr n HIS 59 N 0.16 0.00 -3.91 1.61 1.44 -1.26 -1.62 115.22 111.63 3fsr n HIS 59 Ca 0.00 0.00 -0.31 0.00 -2.01 0.00 0.00 57.72 55.40 3fsr n HIS 59 Cb 0.00 0.01 -0.15 0.00 0.12 0.00 0.00 29.99 29.97 3fsr n HIS 59 CO 0.00 0.00 0.00 -1.21 -2.81 0.00 0.00 176.34 172.32 3fsr s GLU 60 N 0.00 1.25 -0.02 -1.40 2.02 -1.26 -3.99 118.70 115.30 3fsr s GLU 60 Ca 0.00 -1.46 -0.06 0.00 0.02 0.00 0.00 54.97 53.47 3fsr s GLU 60 Cb 0.00 -2.69 0.01 0.00 0.10 0.00 0.00 34.13 31.54 3fsr s GLU 60 CO 0.00 -0.90 0.13 0.00 0.02 0.00 0.00 175.26 174.51 3fsr s ALA 61 N 1.22 -0.32 0.06 5.21 0.00 -1.26 -2.44 121.76 124.24 3fsr s ALA 61 Ca 0.08 0.07 0.04 0.00 0.00 0.00 0.00 51.96 52.15 3fsr s ALA 61 Cb -0.18 -0.04 -0.04 0.00 0.00 0.00 0.00 23.12 22.86 3fsr s ALA 61 CO -0.14 -0.15 0.00 0.14 0.00 0.00 0.00 175.76 175.62 3fsr s VAL 62 N -0.77 4.08 0.32 0.00 -7.23 -0.60 -2.13 120.40 114.07 3fsr s VAL 62 Ca -0.09 -0.87 -0.11 0.00 -1.81 0.00 0.00 61.98 59.11 3fsr s VAL 62 Cb -0.05 -2.91 0.04 0.00 0.56 0.00 0.00 36.38 34.02 3fsr s VAL 62 CO 0.01 0.19 0.61 0.61 -0.31 0.00 0.00 175.10 176.21 3fsr n GLY 63 N 0.79 1.30 3.41 2.32 0.00 -0.32 -0.30 105.19 112.38 3fsr n GLY 63 Ca -0.12 -1.25 -0.33 0.00 0.00 0.00 0.00 46.02 44.33 3fsr n GLY 63 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3fsr s GLU 64 N -2.14 3.26 0.16 1.61 2.12 -0.26 -0.58 118.70 122.88 3fsr s GLU 64 Ca 0.14 -0.66 -0.30 0.00 0.36 0.00 0.00 54.97 54.50 3fsr s GLU 64 Cb -0.04 -2.62 -0.08 0.00 0.26 0.00 0.00 34.13 31.65 3fsr s GLU 64 CO 0.10 0.30 1.32 0.08 -0.54 0.00 0.00 175.26 176.52 3fsr s VAL 65 N 0.14 3.33 -0.03 3.70 1.01 -0.12 -1.29 120.40 127.15 3fsr s VAL 65 Ca -0.06 1.04 0.04 0.00 0.00 0.00 0.00 61.98 63.00 3fsr s VAL 65 Cb -0.15 -3.66 -0.07 0.00 0.00 0.00 0.00 36.38 32.50 3fsr s VAL 65 CO 0.04 0.13 0.11 1.33 0.00 0.00 0.00 175.10 176.71 3fsr n VAL 66 N 3.14 0.00 -3.61 2.92 0.24 -0.40 -0.34 118.33 120.27 3fsr n VAL 66 Ca 0.08 -0.13 -0.15 0.00 -2.04 0.00 0.00 64.34 62.10 3fsr n VAL 66 Cb 0.43 0.46 -0.07 0.00 -1.47 0.00 0.00 33.84 33.19 3fsr n VAL 66 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 3fsr s GLU 67 N -2.22 0.87 0.07 7.34 2.12 -1.16 -4.75 118.70 120.97 3fsr s GLU 67 Ca -0.01 0.84 0.04 0.00 0.36 0.00 0.00 54.97 56.19 3fsr s GLU 67 Cb 0.03 0.42 -0.03 0.00 0.26 0.00 0.00 34.13 34.81 3fsr s GLU 67 CO 0.18 -0.14 -0.12 0.14 -0.54 0.00 0.00 175.26 174.78 3fsr s VAL 68 N 0.06 0.95 0.91 3.70 -7.23 -1.26 -1.14 120.40 116.39 3fsr s VAL 68 Ca -0.02 -1.33 -0.12 0.00 -1.81 0.00 0.00 61.98 58.70 3fsr s VAL 68 Cb -0.04 -1.04 0.14 0.00 0.56 0.00 0.00 36.38 36.00 3fsr s VAL 68 CO 0.03 -0.34 1.10 -0.83 -0.31 0.00 0.00 175.10 174.75 3fsr s GLY 69 N -1.87 1.60 0.56 2.32 0.00 -0.63 -4.93 107.32 104.36 3fsr s GLY 69 Ca -0.02 -0.24 0.37 0.00 0.00 0.00 0.00 44.72 44.84 3fsr s GLY 69 CO 0.01 0.28 2.14 1.48 0.00 0.00 0.00 173.10 177.02 3fsr h SER 70 N -1.55 0.00 -0.01 1.64 4.64 -1.77 -2.19 113.55 114.30 3fsr h SER 70 Ca -0.51 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.81 3fsr h SER 70 Cb 1.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 3fsr h SER 70 CO 0.57 0.00 -0.33 -0.62 -0.87 0.00 0.00 176.83 175.58 3fsr n GLU 71 N -2.85 1.54 -2.28 4.77 -0.58 0.11 -4.94 120.64 116.40 3fsr n GLU 71 Ca -0.02 -0.98 -0.42 0.00 -0.42 0.00 0.00 57.16 55.32 3fsr n GLU 71 Cb 0.10 -1.35 -0.03 0.00 -0.57 0.00 0.00 31.44 29.59 3fsr n GLU 71 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 3fsr s VAL 72 N -2.04 3.79 -0.02 2.62 1.01 -0.83 -4.92 120.40 120.02 3fsr s VAL 72 Ca 0.16 1.21 0.08 0.00 0.00 0.00 0.00 61.98 63.43 3fsr s VAL 72 Cb 0.15 -3.77 -0.12 0.00 0.00 0.00 0.00 36.38 32.63 3fsr s VAL 72 CO 0.43 0.02 0.15 0.29 0.00 0.00 0.00 175.10 176.00 3fsr n LYS 73 N 4.94 0.76 -0.00 2.72 4.76 -1.26 -4.78 118.16 125.30 3fsr n LYS 73 Ca 0.12 -0.06 0.04 0.00 -2.87 0.00 0.00 58.31 55.54 3fsr n LYS 73 Cb 0.44 -1.20 -0.05 0.00 -1.84 0.00 0.00 35.03 32.38 3fsr n LYS 73 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 3fsr n ASP 74 N -1.89 0.96 -4.18 4.39 8.00 -1.26 -4.97 116.55 117.60 3fsr n ASP 74 Ca -0.04 -0.55 -0.22 0.00 0.71 0.00 0.00 54.79 54.70 3fsr n ASP 74 Cb 0.32 1.09 -0.14 0.00 -0.02 0.00 0.00 41.12 42.37 3fsr n ASP 74 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3fsr s PHE 75 N -1.97 1.44 0.04 1.24 0.08 -1.26 -5.06 117.98 112.48 3fsr s PHE 75 Ca 0.02 -0.36 -0.08 0.00 0.12 0.00 0.00 56.93 56.62 3fsr s PHE 75 Cb 0.06 -0.85 -0.00 0.00 -0.57 0.00 0.00 43.02 41.66 3fsr s PHE 75 CO 0.35 0.06 0.17 -1.59 -0.10 0.00 0.00 175.22 174.10 3fsr s LYS 76 N -1.17 0.65 0.16 0.44 -2.85 -1.26 -4.92 119.74 110.80 3fsr s LYS 76 Ca 0.04 -0.65 -0.33 0.00 -1.00 0.00 0.00 55.97 54.03 3fsr s LYS 76 Cb -0.08 0.27 -0.16 0.00 -2.06 0.00 0.00 37.83 35.79 3fsr s LYS 76 CO 0.01 -0.18 1.06 -2.30 0.10 0.00 0.00 175.35 174.05 3fsr n PRO 77 N 0.76 0.90 0.00 1.78 -0.02 -1.26 -1.41 135.00 135.75 3fsr n PRO 77 Ca -0.19 0.32 0.00 0.00 -2.02 0.00 0.00 63.50 61.61 3fsr n PRO 77 Cb 0.59 -1.75 0.00 0.00 -0.02 0.00 0.00 33.50 32.32 3fsr n PRO 77 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3fsr n GLY 78 N 1.90 2.61 3.71 -1.23 0.00 0.53 -4.98 105.19 107.73 3fsr n GLY 78 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 3fsr n GLY 78 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3fsr s ASP 79 N -1.26 6.82 -0.00 1.61 1.01 -0.50 -4.74 116.67 119.60 3fsr s ASP 79 Ca 0.00 2.31 -0.27 0.00 0.71 0.00 0.00 52.55 55.29 3fsr s ASP 79 Cb 0.00 -2.58 -0.04 0.00 1.01 0.00 0.00 42.92 41.31 3fsr s ASP 79 CO 0.00 -0.67 0.87 -0.13 0.21 0.00 0.00 175.17 175.44 3fsr s ARG 80 N 1.34 4.53 0.04 8.23 0.52 -1.26 -0.95 118.95 131.40 3fsr s ARG 80 Ca 0.65 1.22 0.02 0.00 -0.52 0.00 0.00 55.73 57.09 3fsr s ARG 80 Cb -0.36 -3.44 -0.02 0.00 0.52 0.00 0.00 34.95 31.65 3fsr s ARG 80 CO 0.30 0.05 -0.07 0.14 0.02 0.00 0.00 175.30 175.74 3fsr s VAL 81 N 0.71 0.48 -0.09 3.52 -7.23 0.26 -1.20 120.40 116.85 3fsr s VAL 81 Ca 0.45 -1.01 -0.19 0.00 -1.81 0.00 0.00 61.98 59.43 3fsr s VAL 81 Cb -0.20 -0.55 -0.04 0.00 0.56 0.00 0.00 36.38 36.14 3fsr s VAL 81 CO 0.25 -0.37 0.51 -0.69 -0.31 0.00 0.00 175.10 174.49 3fsr s VAL 82 N -1.31 5.13 -0.27 1.32 1.01 0.21 -1.18 120.40 125.31 3fsr s VAL 82 Ca -0.10 1.04 -0.09 0.00 0.00 0.00 0.00 61.98 62.83 3fsr s VAL 82 Cb -0.10 -3.85 -0.03 0.00 0.00 0.00 0.00 36.38 32.41 3fsr s VAL 82 CO 0.00 0.34 0.12 -0.69 0.00 0.00 0.00 175.10 174.87 3fsr s VAL 83 N 0.46 4.57 0.48 2.92 1.01 -0.90 -2.69 120.40 126.25 3fsr s VAL 83 Ca 0.28 -0.18 -0.22 0.00 0.00 0.00 0.00 61.98 61.85 3fsr s VAL 83 Cb -0.16 -3.20 -0.07 0.00 0.00 0.00 0.00 36.38 32.95 3fsr s VAL 83 CO 0.12 0.24 1.16 -2.16 0.00 0.00 0.00 175.10 174.47 3fsr s PRO 84 N 1.64 3.66 0.49 2.72 0.04 -1.26 -4.28 135.00 138.02 3fsr s PRO 84 Ca 0.06 1.76 0.15 0.00 0.04 0.00 0.00 61.00 63.01 3fsr s PRO 84 Cb -0.16 -2.33 1.17 0.00 0.04 0.00 0.00 34.50 33.22 3fsr s PRO 84 CO 0.06 -0.63 2.10 0.00 0.04 0.00 0.00 177.00 178.57 3fsr h ALA 85 N 1.87 1.89 -2.93 8.56 0.00 -1.38 -3.40 119.26 123.87 3fsr h ALA 85 Ca -0.49 -0.05 -0.66 0.00 0.00 0.00 0.00 54.91 53.70 3fsr h ALA 85 Cb 1.25 -0.02 -0.23 0.00 0.00 0.00 0.00 17.79 18.80 3fsr h ALA 85 CO 0.59 0.08 -0.59 0.42 0.00 0.00 0.00 179.25 179.75 3fsr s ILE 86 N -4.95 4.42 -0.56 0.00 1.09 -1.26 -4.30 121.20 115.65 3fsr s ILE 86 Ca -0.05 -0.32 0.04 0.00 -1.10 0.00 0.00 60.65 59.22 3fsr s ILE 86 Cb 0.17 -3.17 0.16 0.00 -1.06 0.00 0.00 42.46 38.56 3fsr s ILE 86 CO 0.68 0.20 0.39 0.42 -0.10 0.00 0.00 174.94 176.53 3fsr s THR 87 N 1.61 1.78 0.78 2.92 -4.23 -0.33 -1.89 115.64 116.27 3fsr s THR 87 Ca 0.05 -3.41 -0.10 0.00 -1.18 0.00 0.00 61.69 57.04 3fsr s THR 87 Cb -0.16 -2.20 0.06 0.00 1.34 0.00 0.00 72.50 71.54 3fsr s THR 87 CO 0.05 -1.06 1.09 -2.84 -0.54 0.00 0.00 174.62 171.32 3fsr s PRO 88 N -0.61 2.22 -0.03 3.99 0.02 -1.25 -4.79 135.00 134.56 3fsr s PRO 88 Ca 0.26 1.17 -0.30 0.00 0.02 0.00 0.00 61.00 62.15 3fsr s PRO 88 Cb -0.06 -1.89 -0.04 0.00 0.02 0.00 0.00 34.50 32.53 3fsr s PRO 88 CO -0.14 -1.67 1.17 0.34 -0.33 0.00 0.00 177.00 176.36 3fsr s ASP 89 N -3.38 7.10 0.00 2.53 -1.08 -1.26 -4.91 116.67 115.66 3fsr s ASP 89 Ca 0.61 1.82 0.25 0.00 -0.52 0.00 0.00 52.55 54.72 3fsr s ASP 89 Cb -0.17 -2.56 0.55 0.00 -1.46 0.00 0.00 42.92 39.27 3fsr s ASP 89 CO 0.56 -0.52 1.44 0.79 0.52 0.00 0.00 175.17 177.96 3fsr n TRP 90 N 4.79 0.00 -3.14 -5.34 7.02 -1.26 -4.53 117.44 114.98 3fsr n TRP 90 Ca 0.10 0.00 -0.36 0.00 -1.02 0.00 0.00 57.50 56.22 3fsr n TRP 90 Cb 0.47 -0.07 -0.03 0.00 -2.42 0.00 0.00 31.31 29.27 3fsr n TRP 90 CO 0.00 0.00 0.00 0.54 -2.02 0.00 0.00 177.69 176.21 3fsr n ARG 91 N -0.27 3.77 -4.16 -0.99 1.74 -1.26 -4.88 116.66 110.62 3fsr n ARG 91 Ca 0.12 -4.62 -0.11 0.00 -0.77 0.00 0.00 57.85 52.47 3fsr n ARG 91 Cb 0.40 -2.40 -0.09 0.00 -1.02 0.00 0.00 32.46 29.34 3fsr n ARG 91 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 3fsr s THR 92 N -2.83 0.02 0.19 0.55 -4.23 -1.26 -5.06 115.64 103.02 3fsr s THR 92 Ca 0.35 -1.89 0.06 0.00 -1.18 0.00 0.00 61.69 59.04 3fsr s THR 92 Cb 0.10 -2.36 -0.12 0.00 1.34 0.00 0.00 72.50 71.47 3fsr s THR 92 CO 0.04 -0.09 1.44 0.77 -0.54 0.00 0.00 174.62 176.24 3fsr h SER 93 N 2.62 0.12 -0.86 3.99 4.64 -1.97 -2.39 113.55 119.68 3fsr h SER 93 Ca -0.34 -0.09 0.09 0.00 -0.47 0.00 0.00 61.79 60.98 3fsr h SER 93 Cb 1.24 -0.04 -0.06 0.00 -0.31 0.00 0.00 62.40 63.23 3fsr h SER 93 CO 0.52 0.87 0.56 -0.33 -0.87 0.00 0.00 176.83 177.58 3fsr h GLU 94 N 0.05 0.83 -0.26 4.77 3.07 -1.88 0.40 114.58 121.56 3fsr h GLU 94 Ca -0.02 -0.05 -0.19 0.00 -0.50 0.00 0.00 59.36 58.60 3fsr h GLU 94 Cb 1.41 -0.19 0.00 0.00 -0.84 0.00 0.00 28.75 29.14 3fsr h GLU 94 CO 0.11 0.55 -0.57 0.28 -1.40 0.00 0.00 179.01 177.98 3fsr h VAL 95 N 0.85 1.28 0.00 3.13 2.07 -1.70 0.54 116.25 122.42 3fsr h VAL 95 Ca 0.40 -1.77 -0.03 0.00 0.82 0.00 0.00 66.70 66.12 3fsr h VAL 95 Cb 0.40 1.68 -0.00 0.00 -1.52 0.00 0.00 31.29 31.85 3fsr h VAL 95 CO -0.16 0.57 -0.14 1.56 0.02 0.00 0.00 177.57 179.42 3fsr h GLN 96 N 0.63 0.00 -0.00 1.57 4.20 -0.82 -1.42 115.11 119.26 3fsr h GLN 96 Ca 0.01 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.72 3fsr h GLN 96 Cb 1.18 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.96 3fsr h GLN 96 CO 0.12 0.14 -0.06 0.54 -0.67 0.00 0.00 178.83 178.91 3fsr n ARG 97 N -4.10 0.50 -1.08 1.46 1.74 0.13 -4.93 116.66 110.38 3fsr n ARG 97 Ca -0.02 -0.09 0.00 0.00 -0.77 0.00 0.00 57.85 56.97 3fsr n ARG 97 Cb 0.22 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.16 3fsr n ARG 97 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3fsr n GLY 98 N 1.29 0.66 2.45 -0.13 0.00 -0.47 -5.01 105.19 103.98 3fsr n GLY 98 Ca 0.14 -0.74 -0.26 0.00 0.00 0.00 0.00 46.02 45.15 3fsr n GLY 98 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3fsr n TYR 99 N -2.96 1.77 0.25 1.61 4.01 0.06 -4.94 117.16 116.95 3fsr n TYR 99 Ca 0.00 -3.90 0.09 0.00 -0.16 0.00 0.00 57.90 53.94 3fsr n TYR 99 Cb 0.17 -0.39 0.65 0.00 -0.31 0.00 0.00 39.34 39.46 3fsr n TYR 99 CO 0.00 0.00 0.00 1.12 -0.46 0.00 0.00 176.86 177.52 3fsr h HIS 100 N 4.61 0.00 -0.01 -0.72 2.07 -1.88 -1.40 115.15 117.81 3fsr h HIS 100 Ca 0.17 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.69 3fsr h HIS 100 Cb 0.78 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.76 3fsr h HIS 100 CO 0.55 0.12 0.07 1.96 -3.07 0.00 0.00 177.93 177.56 3fsr h GLN 101 N 0.00 0.00 0.00 5.12 7.50 -1.92 -1.54 115.11 124.27 3fsr h GLN 101 Ca -0.00 0.00 -0.01 0.00 0.50 0.00 0.00 58.65 59.14 3fsr h GLN 101 Cb 0.25 0.00 -0.03 0.00 0.05 0.00 0.00 27.48 27.75 3fsr h GLN 101 CO 0.02 0.00 -0.46 0.72 -1.50 0.00 0.00 178.83 177.61 3fsr n HIS 102 N -3.18 0.00 -1.83 2.96 8.25 -0.53 -1.16 115.22 119.73 3fsr n HIS 102 Ca -0.02 -1.33 -0.43 0.00 -0.26 0.00 0.00 57.72 55.68 3fsr n HIS 102 Cb 0.15 -0.22 -0.03 0.00 1.12 0.00 0.00 29.99 31.00 3fsr n HIS 102 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 3fsr s SER 103 N -3.06 5.95 -0.45 0.41 0.15 -0.58 -2.25 113.70 113.88 3fsr s SER 103 Ca 0.36 1.84 0.00 0.00 0.70 0.00 0.00 55.95 58.85 3fsr s SER 103 Cb 0.35 -2.52 0.00 0.00 -1.71 0.00 0.00 66.02 62.14 3fsr s SER 103 CO -0.06 -1.57 0.00 0.61 1.20 0.00 0.00 173.24 173.42 3fsr n GLY 104 N 5.20 0.48 0.00 9.45 0.00 -1.26 -4.21 105.19 114.85 3fsr n GLY 104 Ca 0.24 -0.78 0.00 0.00 0.00 0.00 0.00 46.02 45.48 3fsr n GLY 104 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fsr n GLY 105 N -1.78 3.95 3.66 -0.02 0.00 -0.95 -4.85 105.19 105.20 3fsr n GLY 105 Ca -0.05 -1.54 -0.42 0.00 0.00 0.00 0.00 46.02 44.00 3fsr n GLY 105 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3fsr s MET 106 N -2.63 4.19 -1.37 1.61 -2.45 -1.26 -1.66 119.30 115.73 3fsr s MET 106 Ca 0.00 2.08 0.00 0.00 -1.25 0.00 0.00 55.69 56.52 3fsr s MET 106 Cb 0.00 -3.92 0.00 0.00 1.25 0.00 0.00 34.83 32.16 3fsr s MET 106 CO 0.00 -0.81 0.00 1.28 1.05 0.00 0.00 175.02 176.54 3fsr n LEU 107 N 6.95 -0.71 0.00 4.11 4.32 -1.23 -4.86 117.00 125.58 3fsr n LEU 107 Ca 0.16 0.32 0.10 0.00 -0.02 0.00 0.00 56.01 56.58 3fsr n LEU 107 Cb 0.43 -2.42 0.49 0.00 -1.62 0.00 0.00 43.42 40.30 3fsr n LEU 107 CO 0.61 -0.90 0.84 0.00 -1.22 0.00 0.00 177.39 176.72 3fsr n ALA 108 N 1.24 2.03 0.27 -1.18 0.00 -0.67 -1.55 120.51 120.64 3fsr n ALA 108 Ca -0.13 -0.08 0.15 0.00 0.00 0.00 0.00 53.44 53.38 3fsr n ALA 108 Cb 0.54 -1.35 0.71 0.00 0.00 0.00 0.00 19.45 19.35 3fsr n ALA 108 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3fsr h GLY 109 N 3.64 0.00 -7.16 0.00 0.00 -1.31 -3.39 103.07 94.85 3fsr h GLY 109 Ca 0.00 0.00 -0.65 0.00 0.00 0.00 0.00 47.33 46.68 3fsr h GLY 109 CO 0.00 0.00 0.25 0.86 0.00 0.00 0.00 176.54 177.65 3fsr s TRP 110 N -3.84 2.97 -0.22 5.60 -0.00 -0.60 -1.19 118.94 121.67 3fsr s TRP 110 Ca -0.01 -0.18 -0.12 0.00 -0.00 0.00 0.00 56.10 55.79 3fsr s TRP 110 Cb 0.11 -3.66 -0.09 0.00 -0.00 0.00 0.00 33.47 29.82 3fsr s TRP 110 CO 0.56 -1.08 -0.30 1.63 -0.00 0.00 0.00 176.95 177.76 3fsr n LYS 111 N 6.64 0.49 -1.65 5.86 5.02 -1.26 -4.51 118.16 128.75 3fsr n LYS 111 Ca -0.02 0.21 -0.47 0.00 -2.02 0.00 0.00 58.31 56.01 3fsr n LYS 111 Cb 0.47 -1.33 -0.04 0.00 -0.02 0.00 0.00 35.03 34.11 3fsr n LYS 111 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 3fsr n PHE 112 N -4.09 2.03 -1.70 2.13 3.72 -1.26 -1.07 117.46 117.22 3fsr n PHE 112 Ca -0.41 0.40 -0.17 0.00 -0.05 0.00 0.00 57.45 57.22 3fsr n PHE 112 Cb 0.77 -2.47 -0.05 0.00 -0.94 0.00 0.00 39.48 36.78 3fsr n PHE 112 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 3fsr n SER 113 N 2.96 -4.97 0.01 4.37 2.88 0.33 -4.74 113.62 114.46 3fsr n SER 113 Ca 0.16 0.30 0.00 0.00 -1.33 0.00 0.00 58.87 58.00 3fsr n SER 113 Cb 0.27 -3.97 0.00 0.00 -0.75 0.00 0.00 64.21 59.75 3fsr n SER 113 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 3fsr n ASN 114 N -0.81 0.01 -0.14 -3.46 5.15 -0.23 -4.94 115.26 110.84 3fsr n ASN 114 Ca -0.17 0.03 0.03 0.00 -0.60 0.00 0.00 54.58 53.87 3fsr n ASN 114 Cb 0.57 0.02 -0.00 0.00 -0.53 0.00 0.00 39.78 39.83 3fsr n ASN 114 CO 0.00 0.00 0.00 1.33 1.40 0.00 0.00 177.26 179.99 3fsr n VAL 115 N -2.56 0.00 -3.99 3.44 0.24 -0.61 -5.02 118.33 109.83 3fsr n VAL 115 Ca 0.00 -0.42 -0.09 0.00 -2.04 0.00 0.00 64.34 61.80 3fsr n VAL 115 Cb 0.00 1.07 -0.08 0.00 -1.47 0.00 0.00 33.84 33.36 3fsr n VAL 115 CO 0.00 0.00 0.00 -1.59 -2.14 0.00 0.00 176.83 173.10 3fsr s LYS 116 N -1.15 0.84 0.26 7.34 -2.85 -0.86 -5.04 119.74 118.28 3fsr s LYS 116 Ca 0.05 -1.15 -0.31 0.00 -1.00 0.00 0.00 55.97 53.57 3fsr s LYS 116 Cb 0.06 0.29 -0.12 0.00 -2.06 0.00 0.00 37.83 36.00 3fsr s LYS 116 CO 0.19 -0.25 1.59 -0.25 0.10 0.00 0.00 175.35 176.73 3fsr n ASP 117 N -0.04 3.65 -2.44 0.03 8.00 -1.26 -0.51 116.55 123.98 3fsr n ASP 117 Ca -0.12 1.13 0.00 0.00 0.71 0.00 0.00 54.79 56.51 3fsr n ASP 117 Cb 0.62 -1.55 0.00 0.00 -0.02 0.00 0.00 41.12 40.17 3fsr n ASP 117 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3fsr n GLY 118 N 2.54 0.18 0.57 0.44 0.00 0.27 -4.45 105.19 104.75 3fsr n GLY 118 Ca 0.11 -1.66 0.10 0.00 0.00 0.00 0.00 46.02 44.57 3fsr n GLY 118 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3fsr n VAL 119 N 0.00 0.00 -0.90 1.61 0.24 -0.64 -4.43 118.33 114.21 3fsr n VAL 119 Ca 0.00 -0.34 -0.14 0.00 -2.04 0.00 0.00 64.34 61.82 3fsr n VAL 119 Cb 0.00 1.30 -0.12 0.00 -1.47 0.00 0.00 33.84 33.55 3fsr n VAL 119 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 3fsr n PHE 120 N 0.29 0.37 -4.15 6.34 3.72 -0.28 -4.79 117.46 118.97 3fsr n PHE 120 Ca 0.10 -1.53 -0.10 0.00 -0.05 0.00 0.00 57.45 55.87 3fsr n PHE 120 Cb 0.47 -1.56 -0.10 0.00 -0.94 0.00 0.00 39.48 37.34 3fsr n PHE 120 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 3fsr s GLY 121 N 2.23 0.86 0.43 1.37 0.00 -1.26 -0.97 107.32 109.97 3fsr s GLY 121 Ca 0.58 -1.41 0.12 0.00 0.00 0.00 0.00 44.72 44.01 3fsr s GLY 121 CO -0.01 -1.38 2.01 0.83 0.00 0.00 0.00 173.10 174.54 3fsr h GLU 122 N 2.93 0.43 -4.24 2.90 5.08 -1.73 -3.41 114.58 116.53 3fsr h GLU 122 Ca -0.35 -0.03 -0.14 0.00 -1.00 0.00 0.00 59.36 57.85 3fsr h GLU 122 Cb 1.18 -0.10 -0.15 0.00 0.50 0.00 0.00 28.75 30.19 3fsr h GLU 122 CO 0.62 0.28 -0.62 -0.06 -1.00 0.00 0.00 179.01 178.23 3fsr s PHE 123 N -5.41 0.60 0.22 4.33 0.08 -1.26 -4.30 117.98 112.23 3fsr s PHE 123 Ca -0.08 -1.06 -0.06 0.00 0.12 0.00 0.00 56.93 55.85 3fsr s PHE 123 Cb 0.19 -0.37 -0.03 0.00 -0.57 0.00 0.00 43.02 42.24 3fsr s PHE 123 CO 0.74 -0.46 0.27 -0.59 -0.10 0.00 0.00 175.22 175.08 3fsr s PHE 124 N -3.96 0.83 -0.19 0.36 -0.12 -0.09 -4.92 117.98 109.90 3fsr s PHE 124 Ca 0.13 -1.11 -0.04 0.00 -0.05 0.00 0.00 56.93 55.85 3fsr s PHE 124 Cb 0.07 -0.26 -0.02 0.00 -0.63 0.00 0.00 43.02 42.18 3fsr s PHE 124 CO -0.06 -0.78 -0.02 -1.58 -0.05 0.00 0.00 175.22 172.74 3fsr s HIS 125 N -4.10 3.02 -0.30 3.49 5.65 -1.26 -1.18 115.29 120.61 3fsr s HIS 125 Ca 0.32 -0.48 -0.07 0.00 0.25 0.00 0.00 55.06 55.08 3fsr s HIS 125 Cb 0.04 -2.05 0.01 0.00 -1.18 0.00 0.00 32.58 29.40 3fsr s HIS 125 CO 0.11 -0.23 0.08 0.08 -0.65 0.00 0.00 174.74 174.12 3fsr s VAL 126 N 0.90 3.91 0.22 0.89 1.01 -0.05 -5.00 120.40 122.28 3fsr s VAL 126 Ca 0.00 -0.74 -0.30 0.00 0.00 0.00 0.00 61.98 60.94 3fsr s VAL 126 Cb -0.14 -3.03 -0.09 0.00 0.00 0.00 0.00 36.38 33.12 3fsr s VAL 126 CO 0.02 0.06 1.20 0.54 0.00 0.00 0.00 175.10 176.92 3fsr s ASN 127 N 1.48 7.07 -0.85 3.32 4.22 -1.26 -1.68 114.94 127.24 3fsr s ASN 127 Ca 0.02 2.31 -0.04 0.00 -2.14 0.00 0.00 52.86 53.01 3fsr s ASN 127 Cb -0.17 -2.62 -0.01 0.00 1.28 0.00 0.00 41.25 39.73 3fsr s ASN 127 CO 0.02 -0.36 0.72 -0.67 -2.04 0.00 0.00 177.10 174.78 3fsr n ASP 128 N 2.04 -6.74 -0.26 3.54 -0.08 -1.13 -4.60 116.55 109.32 3fsr n ASP 128 Ca 0.03 -0.46 0.01 0.00 -1.51 0.00 0.00 54.79 52.85 3fsr n ASP 128 Cb 0.44 -4.33 0.13 0.00 2.34 0.00 0.00 41.12 39.70 3fsr n ASP 128 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3fsr h ALA 129 N 0.60 1.02 -0.38 -1.67 0.00 -1.23 -0.70 119.26 116.91 3fsr h ALA 129 Ca -0.30 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.64 3fsr h ALA 129 Cb 1.17 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 3fsr h ALA 129 CO 0.36 0.05 0.23 -0.44 0.00 0.00 0.00 179.25 179.45 3fsr h ASP 130 N 0.71 0.44 0.54 0.00 3.32 -1.90 -1.69 116.42 117.84 3fsr h ASP 130 Ca 0.35 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.38 3fsr h ASP 130 Cb 0.29 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.73 3fsr h ASP 130 CO -0.23 0.33 -0.93 0.23 -1.72 0.00 0.00 179.24 176.93 3fsr n MET 131 N -4.46 0.29 -0.05 3.56 2.81 -0.58 -4.50 117.12 114.19 3fsr n MET 131 Ca 0.03 0.02 0.02 0.00 -1.81 0.00 0.00 57.70 55.96 3fsr n MET 131 Cb 0.08 -1.62 0.03 0.00 -0.71 0.00 0.00 33.22 31.00 3fsr n MET 131 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 3fsr n ASN 132 N -2.00 1.59 -4.28 7.83 3.02 -0.37 -0.85 115.26 120.20 3fsr n ASN 132 Ca 0.02 -2.06 -0.20 0.00 -0.03 0.00 0.00 54.58 52.31 3fsr n ASN 132 Cb 0.44 -0.11 -0.11 0.00 -0.61 0.00 0.00 39.78 39.39 3fsr n ASN 132 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3fsr s LEU 133 N -1.17 2.40 -0.01 3.41 1.43 -0.68 -4.23 118.68 119.83 3fsr s LEU 133 Ca 0.07 -0.80 0.04 0.00 -1.03 0.00 0.00 54.13 52.40 3fsr s LEU 133 Cb 0.06 -0.69 -0.01 0.00 0.03 0.00 0.00 46.19 45.58 3fsr s LEU 133 CO 0.01 -0.08 -0.12 0.00 0.23 0.00 0.00 176.35 176.39 3fsr s ALA 134 N -1.94 1.05 0.31 4.21 0.00 -1.10 -4.41 121.76 119.89 3fsr s ALA 134 Ca 0.10 -0.52 -0.29 0.00 0.00 0.00 0.00 51.96 51.25 3fsr s ALA 134 Cb -0.06 -0.29 -0.10 0.00 0.00 0.00 0.00 23.12 22.66 3fsr s ALA 134 CO 0.04 0.24 1.42 -1.01 0.00 0.00 0.00 175.76 176.46 3fsr s HIS 135 N -0.19 2.90 -0.26 0.00 0.09 -1.26 -0.62 115.29 115.95 3fsr s HIS 135 Ca 0.03 1.16 -0.08 0.00 -0.00 0.00 0.00 55.06 56.17 3fsr s HIS 135 Cb -0.06 -3.85 -0.03 0.00 -0.00 0.00 0.00 32.58 28.64 3fsr s HIS 135 CO -0.00 -2.58 0.10 -1.17 -0.00 0.00 0.00 174.74 171.09 3fsr s LEU 136 N -1.26 3.59 0.61 0.89 2.96 -0.34 -4.70 118.68 120.43 3fsr s LEU 136 Ca 0.55 -0.15 -0.18 0.00 -0.22 0.00 0.00 54.13 54.13 3fsr s LEU 136 Cb -0.43 -1.97 -0.02 0.00 0.50 0.00 0.00 46.19 44.26 3fsr s LEU 136 CO 0.52 -0.03 1.21 -2.84 -1.32 0.00 0.00 176.35 173.88 3fsr s PRO 137 N 1.62 2.85 0.41 0.98 0.02 -1.26 -4.80 135.00 134.82 3fsr s PRO 137 Ca 0.06 1.80 0.12 0.00 0.02 0.00 0.00 61.00 63.00 3fsr s PRO 137 Cb -0.15 -1.92 0.85 0.00 0.02 0.00 0.00 34.50 33.31 3fsr s PRO 137 CO 0.05 -1.29 1.93 0.87 -0.33 0.00 0.00 177.00 178.23 3fsr h LYS 138 N 0.69 0.12 -0.07 5.54 6.56 -1.99 -2.97 116.57 124.45 3fsr h LYS 138 Ca -0.50 -0.03 0.00 0.00 -1.06 0.00 0.00 60.65 59.07 3fsr h LYS 138 Cb 1.30 -0.02 -0.00 0.00 -0.57 0.00 0.00 32.23 32.94 3fsr h LYS 138 CO 0.54 0.31 0.05 0.93 -2.06 0.00 0.00 179.45 179.22 3fsr h GLU 139 N 0.12 0.07 -5.83 3.15 3.07 -2.03 -3.41 114.58 109.72 3fsr h GLU 139 Ca 0.02 -0.00 -0.58 0.00 -0.50 0.00 0.00 59.36 58.30 3fsr h GLU 139 Cb 0.39 -0.02 -0.08 0.00 -0.84 0.00 0.00 28.75 28.20 3fsr h GLU 139 CO 0.03 0.05 0.21 0.42 -1.40 0.00 0.00 179.01 178.32 3fsr s ILE 140 N -5.13 4.97 0.43 3.13 1.01 -1.13 -5.02 121.20 119.47 3fsr s ILE 140 Ca -0.05 1.39 -0.26 0.00 0.00 0.00 0.00 60.65 61.73 3fsr s ILE 140 Cb 0.17 -4.03 -0.08 0.00 0.01 0.00 0.00 42.46 38.53 3fsr s ILE 140 CO 0.68 0.11 1.36 -2.84 0.00 0.00 0.00 174.94 174.24 3fsr s PRO 141 N 1.79 3.82 0.26 2.79 0.02 -1.26 -4.82 135.00 137.59 3fsr s PRO 141 Ca 0.34 2.27 -0.02 0.00 0.02 0.00 0.00 61.00 63.61 3fsr s PRO 141 Cb -0.16 -2.70 0.50 0.00 0.02 0.00 0.00 34.50 32.16 3fsr s PRO 141 CO 0.12 -0.65 1.77 -0.07 -0.33 0.00 0.00 177.00 177.84 3fsr h LEU 142 N 2.48 0.55 -1.26 -5.54 3.38 -1.95 -0.78 115.31 112.20 3fsr h LEU 142 Ca -0.50 0.08 -0.07 0.00 0.09 0.00 0.00 57.88 57.48 3fsr h LEU 142 Cb 1.26 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.99 3fsr h LEU 142 CO 0.62 0.25 -0.26 1.05 0.09 0.00 0.00 178.44 180.18 3fsr h GLU 143 N 0.65 0.17 -0.05 1.13 9.09 -2.00 -0.31 114.58 123.27 3fsr h GLU 143 Ca 0.45 -0.06 -0.09 0.00 0.05 0.00 0.00 59.36 59.71 3fsr h GLU 143 Cb 0.60 -0.02 0.00 0.00 -1.65 0.00 0.00 28.75 27.69 3fsr h GLU 143 CO -0.34 0.43 -0.31 0.00 0.05 0.00 0.00 179.01 178.84 3fsr h ALA 144 N 1.58 0.10 -0.48 1.06 0.00 -1.69 -3.31 119.26 116.51 3fsr h ALA 144 Ca 0.03 -0.45 -0.00 0.00 0.00 0.00 0.00 54.91 54.49 3fsr h ALA 144 Cb 0.55 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 3fsr h ALA 144 CO 0.04 0.16 0.30 0.00 0.00 0.00 0.00 179.25 179.75 3fsr h ALA 145 N 0.39 1.62 0.00 0.00 0.00 -0.16 -1.63 119.26 119.47 3fsr h ALA 145 Ca -0.03 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3fsr h ALA 145 Cb 0.98 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.58 3fsr h ALA 145 CO 0.06 0.34 0.00 1.55 0.00 0.00 0.00 179.25 181.21 3fsr n VAL 146 N -4.44 0.41 1.12 0.00 3.14 -0.22 -1.53 118.33 116.81 3fsr n VAL 146 Ca 0.04 0.10 0.14 0.00 -2.96 0.00 0.00 64.34 61.66 3fsr n VAL 146 Cb 0.07 -0.72 0.65 0.00 -1.06 0.00 0.00 33.84 32.78 3fsr n VAL 146 CO 0.00 0.00 0.00 0.23 -6.46 0.00 0.00 176.83 170.60 3fsr n MET 147 N -1.43 0.16 0.05 1.45 2.81 -0.61 -4.14 117.12 115.40 3fsr n MET 147 Ca 0.07 0.02 -0.21 0.00 -1.81 0.00 0.00 57.70 55.77 3fsr n MET 147 Cb 0.24 -1.50 -0.15 0.00 -0.71 0.00 0.00 33.22 31.10 3fsr n MET 147 CO 0.00 0.00 0.00 0.82 1.51 0.00 0.00 175.97 178.30 3fsr h ILE 148 N 0.00 1.36 -0.86 2.02 2.04 -1.41 -0.98 117.51 119.68 3fsr h ILE 148 Ca 0.00 -2.52 0.25 0.00 1.00 0.00 0.00 64.86 63.58 3fsr h ILE 148 Cb 0.40 3.06 -0.03 0.00 -0.74 0.00 0.00 36.82 39.51 3fsr h ILE 148 CO 0.00 0.73 0.63 -0.65 0.00 0.00 0.00 178.15 178.86 3fsr h PRO 149 N -0.29 0.00 0.00 2.37 0.11 -1.74 -3.15 132.00 129.30 3fsr h PRO 149 Ca -0.20 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.91 3fsr h PRO 149 Cb 1.74 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.85 3fsr h PRO 149 CO 0.14 0.00 0.00 -3.47 -0.21 0.00 0.00 178.00 174.46 3fsr n ASP 150 N -4.22 -0.09 0.08 -2.05 -0.08 -1.26 -1.46 116.55 107.47 3fsr n ASP 150 Ca 0.18 0.42 -0.13 0.00 -1.51 0.00 0.00 54.79 53.75 3fsr n ASP 150 Cb 0.94 0.33 -0.06 0.00 2.34 0.00 0.00 41.12 44.67 3fsr n ASP 150 CO 0.00 0.00 0.00 0.24 0.12 0.00 0.00 177.20 177.56 3fsr h MET 151 N 0.00 -0.51 -0.19 -0.67 2.86 -1.74 0.18 114.93 114.86 3fsr h MET 151 Ca 0.00 0.03 -0.09 0.00 -2.06 0.00 0.00 59.70 57.59 3fsr h MET 151 Cb 0.00 0.12 -0.00 0.00 0.06 0.00 0.00 31.60 31.77 3fsr h MET 151 CO 0.00 -0.34 -0.21 1.98 1.06 0.00 0.00 176.91 179.40 3fsr h MET 152 N -0.53 0.48 -0.67 1.72 1.85 -1.31 0.78 114.93 117.26 3fsr h MET 152 Ca 0.05 -0.26 -0.07 0.00 -0.61 0.00 0.00 59.70 58.80 3fsr h MET 152 Cb 0.59 0.01 -0.03 0.00 0.43 0.00 0.00 31.60 32.61 3fsr h MET 152 CO -0.25 0.84 0.13 0.00 -0.40 0.00 0.00 176.91 177.23 3fsr h THR 153 N 0.15 1.26 0.37 -0.77 1.03 -1.47 -0.91 112.91 112.57 3fsr h THR 153 Ca 0.03 -1.01 -0.02 0.00 -0.01 0.00 0.00 66.41 65.40 3fsr h THR 153 Cb 0.77 0.62 0.00 0.00 -1.07 0.00 0.00 68.15 68.47 3fsr h THR 153 CO 0.05 0.38 -0.18 0.74 -0.01 0.00 0.00 175.52 176.50 3fsr h THR 154 N 1.02 0.63 -0.70 0.00 2.02 -0.53 0.64 112.91 115.99 3fsr h THR 154 Ca 0.21 -0.38 0.04 0.00 0.77 0.00 0.00 66.41 67.05 3fsr h THR 154 Cb 0.41 0.82 -0.05 0.00 -1.74 0.00 0.00 68.15 67.59 3fsr h THR 154 CO 0.01 0.07 0.42 1.23 0.37 0.00 0.00 175.52 177.62 3fsr h GLY 155 N -0.72 1.02 1.69 2.16 0.00 -0.82 -1.81 103.07 104.59 3fsr h GLY 155 Ca -0.05 -0.31 -0.13 0.00 0.00 0.00 0.00 47.33 46.85 3fsr h GLY 155 CO 0.08 0.23 -0.46 0.74 0.00 0.00 0.00 176.54 177.13 3fsr h PHE 156 N 0.79 0.41 -0.01 5.60 -1.00 -1.17 -2.37 116.94 119.19 3fsr h PHE 156 Ca 0.30 -0.13 0.00 0.00 2.81 0.00 0.00 57.97 60.95 3fsr h PHE 156 Cb 0.10 -0.09 -0.00 0.00 3.61 0.00 0.00 35.95 39.58 3fsr h PHE 156 CO -0.06 0.75 0.01 1.25 -1.61 0.00 0.00 178.31 178.65 3fsr h HIS 157 N 0.28 0.00 -0.38 -0.55 2.76 -0.04 -0.55 115.15 116.68 3fsr h HIS 157 Ca 0.02 0.00 -0.07 0.00 -2.20 0.00 0.00 60.37 58.11 3fsr h HIS 157 Cb 0.92 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.87 3fsr h HIS 157 CO 0.02 0.00 -0.06 0.78 -1.30 0.00 0.00 177.93 177.38 3fsr h GLY 158 N 0.00 0.76 1.52 5.26 0.00 -0.88 0.11 103.07 109.85 3fsr h GLY 158 Ca 0.01 -0.60 -0.11 0.00 0.00 0.00 0.00 47.33 46.62 3fsr h GLY 158 CO -0.00 0.55 -0.29 0.00 0.00 0.00 0.00 176.54 176.80 3fsr h ALA 159 N 0.85 0.99 -0.09 3.60 0.00 -1.26 -1.73 119.26 121.61 3fsr h ALA 159 Ca 0.10 -0.38 -0.02 0.00 0.00 0.00 0.00 54.91 54.61 3fsr h ALA 159 Cb 0.55 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 3fsr h ALA 159 CO 0.03 0.60 -0.02 0.93 0.00 0.00 0.00 179.25 180.79 3fsr h GLU 160 N 0.47 0.17 -0.31 0.00 5.08 -0.82 -2.94 114.58 116.23 3fsr h GLU 160 Ca 0.06 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.33 3fsr h GLU 160 Cb 0.75 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.98 3fsr h GLU 160 CO 0.06 0.50 0.07 -0.07 -1.00 0.00 0.00 179.01 178.57 3fsr h LEU 161 N -0.16 0.41 -2.12 1.33 3.38 -0.73 -1.79 115.31 115.63 3fsr h LEU 161 Ca 0.02 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.94 3fsr h LEU 161 Cb 0.43 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.08 3fsr h LEU 161 CO 0.01 0.42 0.00 0.00 0.09 0.00 0.00 178.44 178.96 3fsr h ALA 162 N 1.64 1.00 -6.22 1.53 0.00 -1.14 -3.47 119.26 112.61 3fsr h ALA 162 Ca 0.11 0.00 -0.43 0.00 0.00 0.00 0.00 54.91 54.58 3fsr h ALA 162 Cb 0.18 0.00 0.06 0.00 0.00 0.00 0.00 17.79 18.02 3fsr h ALA 162 CO -0.00 0.00 -0.90 -3.47 0.00 0.00 0.00 179.25 174.87 3fsr n ASP 163 N -3.08 -3.56 -4.74 0.00 2.03 -0.67 -4.81 116.55 101.72 3fsr n ASP 163 Ca -0.01 -0.96 -0.42 0.00 0.52 0.00 0.00 54.79 53.92 3fsr n ASP 163 Cb 0.20 -3.53 -0.02 0.00 -0.72 0.00 0.00 41.12 37.04 3fsr n ASP 163 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 3fsr s ILE 164 N -3.61 2.69 0.17 5.18 1.01 -1.25 -5.02 121.20 120.36 3fsr s ILE 164 Ca 0.29 0.55 -0.06 0.00 0.00 0.00 0.00 60.65 61.43 3fsr s ILE 164 Cb -0.10 -3.35 -0.06 0.00 0.01 0.00 0.00 42.46 38.96 3fsr s ILE 164 CO 0.85 0.07 0.42 -1.10 0.00 0.00 0.00 174.94 175.18 3fsr s GLN 165 N 0.06 3.65 0.03 2.79 -1.52 -1.26 -4.93 119.66 118.48 3fsr s GLN 165 Ca 0.62 -0.02 -0.31 0.00 -1.95 0.00 0.00 55.36 53.71 3fsr s GLN 165 Cb -0.42 -2.80 -0.10 0.00 -0.22 0.00 0.00 33.01 29.47 3fsr s GLN 165 CO 0.40 0.43 1.95 -1.33 -0.25 0.00 0.00 175.29 176.48 3fsr n MET 166 N -0.01 2.75 -0.09 2.91 2.81 -1.26 -1.56 117.12 122.67 3fsr n MET 166 Ca -0.02 1.01 0.00 0.00 -1.81 0.00 0.00 57.70 56.88 3fsr n MET 166 Cb 0.52 -2.94 0.00 0.00 -0.71 0.00 0.00 33.22 30.09 3fsr n MET 166 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3fsr n GLY 167 N 4.49 1.12 3.81 3.03 0.00 0.97 -4.93 105.19 113.69 3fsr n GLY 167 Ca 0.20 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.91 3fsr n GLY 167 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3fsr s SER 168 N -2.87 5.08 0.02 1.61 1.04 -0.60 -3.73 113.70 114.24 3fsr s SER 168 Ca 0.00 1.61 -0.07 0.00 0.48 0.00 0.00 55.95 57.97 3fsr s SER 168 Cb 0.00 -2.44 -0.05 0.00 0.10 0.00 0.00 66.02 63.64 3fsr s SER 168 CO 0.00 -1.64 0.29 -0.94 0.98 0.00 0.00 173.24 171.93 3fsr s SER 169 N -3.73 6.51 -0.02 7.02 1.04 -1.26 -1.47 113.70 121.79 3fsr s SER 169 Ca 0.59 0.59 0.01 0.00 0.48 0.00 0.00 55.95 57.62 3fsr s SER 169 Cb -0.15 -2.10 0.01 0.00 0.10 0.00 0.00 66.02 63.89 3fsr s SER 169 CO 0.55 0.24 -0.04 -0.69 0.98 0.00 0.00 173.24 174.29 3fsr s VAL 170 N -1.31 0.39 -0.15 5.02 1.01 -0.29 -2.22 120.40 122.85 3fsr s VAL 170 Ca 0.28 -0.10 -0.07 0.00 0.00 0.00 0.00 61.98 62.09 3fsr s VAL 170 Cb -0.13 -0.40 -0.04 0.00 0.00 0.00 0.00 36.38 35.80 3fsr s VAL 170 CO 0.16 0.16 0.08 -0.69 0.00 0.00 0.00 175.10 174.82 3fsr s VAL 171 N 0.55 5.01 -0.22 2.92 1.01 0.17 0.04 120.40 129.87 3fsr s VAL 171 Ca -0.06 0.03 -0.01 0.00 0.00 0.00 0.00 61.98 61.94 3fsr s VAL 171 Cb -0.10 -3.21 0.02 0.00 0.00 0.00 0.00 36.38 33.09 3fsr s VAL 171 CO -0.00 0.54 -0.10 -0.69 0.00 0.00 0.00 175.10 174.84 3fsr s VAL 172 N -0.33 2.65 -0.26 2.92 1.01 0.53 0.59 120.40 127.50 3fsr s VAL 172 Ca 0.10 -0.96 -0.15 0.00 0.00 0.00 0.00 61.98 60.97 3fsr s VAL 172 Cb -0.12 -2.27 -0.04 0.00 0.00 0.00 0.00 36.38 33.95 3fsr s VAL 172 CO 0.01 0.32 0.39 -0.63 0.00 0.00 0.00 175.10 175.19 3fsr s ILE 173 N 1.32 5.17 0.00 2.22 1.01 -0.11 -1.25 121.20 129.56 3fsr s ILE 173 Ca 0.02 0.61 0.00 0.00 0.00 0.00 0.00 60.65 61.28 3fsr s ILE 173 Cb -0.15 -3.71 0.00 0.00 0.01 0.00 0.00 42.46 38.61 3fsr s ILE 173 CO -0.07 0.16 0.00 0.61 0.00 0.00 0.00 174.94 175.64 3fsr n GLY 174 N 4.58 0.74 1.79 6.18 0.00 -0.57 -0.55 105.19 117.36 3fsr n GLY 174 Ca -0.08 -1.15 -0.19 0.00 0.00 0.00 0.00 46.02 44.60 3fsr n GLY 174 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3fsr n ILE 175 N 2.65 2.51 -0.76 -0.61 -5.35 -1.24 -4.02 119.36 112.54 3fsr n ILE 175 Ca 0.00 -4.01 0.00 0.00 -0.27 0.00 0.00 62.75 58.47 3fsr n ILE 175 Cb 0.00 -0.99 0.00 0.00 -1.74 0.00 0.00 39.64 36.91 3fsr n ILE 175 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3fsr n GLY 176 N -0.79 -0.97 0.24 3.28 0.00 -1.26 -4.56 105.19 101.13 3fsr n GLY 176 Ca 0.40 -1.67 0.00 0.00 0.00 0.00 0.00 46.02 44.76 3fsr n GLY 176 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fsr h ALA 177 N -1.96 0.51 -0.38 4.61 0.00 -1.95 0.82 119.26 120.92 3fsr h ALA 177 Ca 0.00 0.22 -0.11 0.00 0.00 0.00 0.00 54.91 55.02 3fsr h ALA 177 Cb 0.00 0.41 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 3fsr h ALA 177 CO 0.00 -0.42 -0.20 0.28 0.00 0.00 0.00 179.25 178.91 3fsr h VAL 178 N 0.05 1.28 -0.34 0.00 2.07 -1.92 -1.34 116.25 116.05 3fsr h VAL 178 Ca 0.31 -1.34 -0.07 0.00 0.82 0.00 0.00 66.70 66.43 3fsr h VAL 178 Cb 0.50 1.34 -0.02 0.00 -1.52 0.00 0.00 31.29 31.59 3fsr h VAL 178 CO -0.59 0.44 -0.09 1.23 0.02 0.00 0.00 177.57 178.58 3fsr h GLY 179 N 0.60 0.61 0.93 2.17 0.00 -1.54 0.39 103.07 106.23 3fsr h GLY 179 Ca 0.08 -0.42 -0.03 0.00 0.00 0.00 0.00 47.33 46.97 3fsr h GLY 179 CO 0.06 0.39 0.13 1.41 0.00 0.00 0.00 176.54 178.53 3fsr h LEU 180 N 0.53 0.54 -1.33 3.11 3.38 -0.54 0.37 115.31 121.37 3fsr h LEU 180 Ca 0.10 -0.19 -0.07 0.00 0.09 0.00 0.00 57.88 57.81 3fsr h LEU 180 Cb 0.48 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 3fsr h LEU 180 CO 0.03 0.58 -0.34 0.24 0.09 0.00 0.00 178.44 179.04 3fsr h MET 181 N 0.46 0.00 -0.32 1.13 2.86 -0.95 -0.31 114.93 117.80 3fsr h MET 181 Ca 0.12 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.76 3fsr h MET 181 Cb 0.23 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.87 3fsr h MET 181 CO -0.01 0.34 0.18 0.78 1.06 0.00 0.00 176.91 179.26 3fsr h GLY 182 N 1.01 0.48 1.00 8.32 0.00 0.67 0.12 103.07 114.67 3fsr h GLY 182 Ca -0.00 -0.21 -0.00 0.00 0.00 0.00 0.00 47.33 47.11 3fsr h GLY 182 CO 0.04 0.21 -0.05 -2.22 0.00 0.00 0.00 176.54 174.52 3fsr h ILE 183 N 0.40 0.91 -0.63 2.60 2.04 0.10 -0.21 117.51 122.71 3fsr h ILE 183 Ca 0.11 -0.01 0.05 0.00 1.00 0.00 0.00 64.86 66.01 3fsr h ILE 183 Cb 0.05 0.92 -0.05 0.00 -0.74 0.00 0.00 36.82 37.00 3fsr h ILE 183 CO -0.02 0.00 0.34 0.00 0.00 0.00 0.00 178.15 178.48 3fsr h ALA 184 N 0.76 0.84 -0.62 1.87 0.00 -0.99 -1.45 119.26 119.68 3fsr h ALA 184 Ca -0.01 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 3fsr h ALA 184 Cb 0.11 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 3fsr h ALA 184 CO 0.02 0.02 0.28 0.78 0.00 0.00 0.00 179.25 180.35 3fsr h GLY 185 N 0.64 0.94 1.18 0.00 0.00 -0.58 -1.35 103.07 103.90 3fsr h GLY 185 Ca 0.28 -0.45 -0.15 0.00 0.00 0.00 0.00 47.33 47.01 3fsr h GLY 185 CO -0.18 0.43 -0.35 0.00 0.00 0.00 0.00 176.54 176.45 3fsr h ALA 186 N 1.44 0.64 -0.64 3.60 0.00 -0.33 -1.59 119.26 122.37 3fsr h ALA 186 Ca 0.21 -0.44 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 3fsr h ALA 186 Cb 0.11 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 3fsr h ALA 186 CO -0.03 0.67 0.32 -0.22 0.00 0.00 0.00 179.25 179.99 3fsr h LYS 187 N 0.75 0.91 0.00 0.00 3.64 -0.93 -2.11 116.57 118.83 3fsr h LYS 187 Ca 0.07 -0.13 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 3fsr h LYS 187 Cb 0.93 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.58 3fsr h LYS 187 CO 0.09 0.72 0.00 1.28 -2.27 0.00 0.00 179.45 179.27 3fsr n LEU 188 N -4.50 0.59 -0.60 5.20 4.77 -0.54 -1.28 117.00 120.64 3fsr n LEU 188 Ca 0.04 0.65 0.13 0.00 -0.03 0.00 0.00 56.01 56.80 3fsr n LEU 188 Cb 0.12 -0.57 0.41 0.00 -2.33 0.00 0.00 43.42 41.04 3fsr n LEU 188 CO 0.38 -0.54 0.80 0.54 -1.33 0.00 0.00 177.39 177.24 3fsr n ARG 189 N -2.16 1.82 -0.59 3.23 5.12 -0.62 -4.94 116.66 118.52 3fsr n ARG 189 Ca 0.02 -1.20 0.00 0.00 -1.93 0.00 0.00 57.85 54.74 3fsr n ARG 189 Cb 0.22 -1.45 0.00 0.00 -1.16 0.00 0.00 32.46 30.06 3fsr n ARG 189 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3fsr n GLY 190 N 1.20 1.06 3.77 -0.13 0.00 -0.40 -4.46 105.19 106.23 3fsr n GLY 190 Ca 0.18 -0.39 -0.40 0.00 0.00 0.00 0.00 46.02 45.40 3fsr n GLY 190 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fsr s ALA 191 N -2.00 3.44 0.00 4.61 0.00 -0.88 -0.02 121.76 126.91 3fsr s ALA 191 Ca 0.00 1.17 0.00 0.00 0.00 0.00 0.00 51.96 53.13 3fsr s ALA 191 Cb 0.00 -3.44 0.00 0.00 0.00 0.00 0.00 23.12 19.68 3fsr s ALA 191 CO 0.00 -0.56 0.00 0.41 0.00 0.00 0.00 175.76 175.61 3fsr n GLY 192 N 0.85 1.22 3.72 0.00 0.00 -0.54 -4.73 105.19 105.71 3fsr n GLY 192 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 3fsr n GLY 192 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3fsr s ARG 193 N 0.00 4.33 -0.21 1.61 3.52 -1.26 -4.94 118.95 122.01 3fsr s ARG 193 Ca 0.00 2.05 0.00 0.00 -0.13 0.00 0.00 55.73 57.65 3fsr s ARG 193 Cb 0.00 -3.25 0.05 0.00 -1.56 0.00 0.00 34.95 30.19 3fsr s ARG 193 CO 0.00 -0.41 -0.06 0.42 -0.81 0.00 0.00 175.30 174.44 3fsr s ILE 194 N 1.02 1.44 -0.29 4.11 1.01 -1.26 -1.14 121.20 126.10 3fsr s ILE 194 Ca 0.63 -1.03 -0.15 0.00 0.00 0.00 0.00 60.65 60.10 3fsr s ILE 194 Cb -0.36 -1.65 -0.03 0.00 0.01 0.00 0.00 42.46 40.43 3fsr s ILE 194 CO 0.31 0.01 0.38 -0.63 0.00 0.00 0.00 174.94 175.01 3fsr s ILE 195 N 1.46 5.16 -0.12 2.92 1.01 0.11 -0.57 121.20 131.16 3fsr s ILE 195 Ca -0.03 0.47 -0.08 0.00 0.00 0.00 0.00 60.65 61.01 3fsr s ILE 195 Cb -0.17 -3.74 -0.04 0.00 0.01 0.00 0.00 42.46 38.51 3fsr s ILE 195 CO -0.07 0.09 0.17 -0.83 0.00 0.00 0.00 174.94 174.30 3fsr s GLY 196 N 1.66 2.18 -0.20 6.18 0.00 0.11 -0.35 107.32 116.91 3fsr s GLY 196 Ca 0.15 -0.60 -0.02 0.00 0.00 0.00 0.00 44.72 44.25 3fsr s GLY 196 CO 0.10 -0.24 -0.11 0.14 0.00 0.00 0.00 173.10 172.99 3fsr s VAL 197 N -0.83 2.80 0.00 1.40 1.01 -0.38 -0.57 120.40 123.83 3fsr s VAL 197 Ca 0.15 -0.69 0.00 0.00 0.00 0.00 0.00 61.98 61.44 3fsr s VAL 197 Cb -0.12 -2.24 0.00 0.00 0.00 0.00 0.00 36.38 34.02 3fsr s VAL 197 CO 0.04 0.48 0.00 0.61 0.00 0.00 0.00 175.10 176.23 3fsr n GLY 198 N 4.69 0.04 0.00 4.51 0.00 0.13 -1.51 105.19 113.05 3fsr n GLY 198 Ca -0.19 -1.21 0.00 0.00 0.00 0.00 0.00 46.02 44.61 3fsr n GLY 198 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3fsr n SER 199 N 0.00 0.00 -4.64 1.61 3.41 -1.26 -4.18 113.62 108.56 3fsr n SER 199 Ca 0.00 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.19 3fsr n SER 199 Cb 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 3fsr n SER 199 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3fsr s ARG 200 N 0.00 3.94 0.27 4.33 0.52 -1.26 -4.85 118.95 121.90 3fsr s ARG 200 Ca 0.00 2.10 -0.00 0.00 -0.52 0.00 0.00 55.73 57.31 3fsr s ARG 200 Cb 0.00 -4.08 0.61 0.00 0.52 0.00 0.00 34.95 32.00 3fsr s ARG 200 CO 0.00 -1.14 1.69 -1.35 0.02 0.00 0.00 175.30 174.52 3fsr h PRO 201 N 10.70 0.33 -0.95 3.54 0.11 -1.97 0.31 132.00 144.07 3fsr h PRO 201 Ca -0.40 -0.02 0.03 0.00 0.11 0.00 0.00 66.00 65.72 3fsr h PRO 201 Cb 1.19 -0.07 -0.05 0.00 0.11 0.00 0.00 31.00 32.17 3fsr h PRO 201 CO 0.97 0.22 0.62 0.97 -0.21 0.00 0.00 178.00 180.57 3fsr h ILE 202 N 0.34 1.17 -0.31 4.15 6.09 -1.90 -0.43 117.51 126.62 3fsr h ILE 202 Ca 0.49 -0.42 -0.17 0.00 -1.37 0.00 0.00 64.86 63.40 3fsr h ILE 202 Cb 0.90 -0.15 -0.00 0.00 0.47 0.00 0.00 36.82 38.04 3fsr h ILE 202 CO -0.53 0.22 -0.48 0.00 -3.07 0.00 0.00 178.15 174.29 3fsr h VAL 204 N 0.67 1.24 -0.51 0.00 2.07 -0.35 0.35 116.25 119.73 3fsr h VAL 204 Ca 0.03 -0.85 0.08 0.00 0.82 0.00 0.00 66.70 66.78 3fsr h VAL 204 Cb 1.08 1.04 -0.06 0.00 -1.52 0.00 0.00 31.29 31.82 3fsr h VAL 204 CO 0.11 0.29 0.14 -0.08 0.02 0.00 0.00 177.57 178.06 3fsr h GLU 205 N 0.50 0.29 -0.41 1.57 4.81 -1.08 -1.24 114.58 119.02 3fsr h GLU 205 Ca 0.12 -0.02 -0.08 0.00 -0.13 0.00 0.00 59.36 59.25 3fsr h GLU 205 Cb 0.36 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.66 3fsr h GLU 205 CO 0.01 0.19 -0.06 0.00 -0.73 0.00 0.00 179.01 178.42 3fsr h ALA 206 N 1.37 0.57 -0.64 2.92 0.00 -1.05 -1.82 119.26 120.61 3fsr h ALA 206 Ca 0.25 -0.30 0.10 0.00 0.00 0.00 0.00 54.91 54.96 3fsr h ALA 206 Cb 0.31 -0.15 -0.07 0.00 0.00 0.00 0.00 17.79 17.88 3fsr h ALA 206 CO -0.29 0.41 0.25 0.00 0.00 0.00 0.00 179.25 179.61 3fsr h ALA 207 N 0.87 0.83 -0.45 0.00 0.00 0.13 0.23 119.26 120.87 3fsr h ALA 207 Ca 0.11 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 3fsr h ALA 207 Cb 0.57 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 3fsr h ALA 207 CO 0.03 -0.18 0.19 0.87 0.00 0.00 0.00 179.25 180.16 3fsr h LYS 208 N 0.43 0.67 -1.00 0.00 1.57 -1.14 -0.90 116.57 116.20 3fsr h LYS 208 Ca 0.32 -0.12 0.15 0.00 -1.87 0.00 0.00 60.65 59.14 3fsr h LYS 208 Cb 0.41 -0.11 -0.09 0.00 0.08 0.00 0.00 32.23 32.51 3fsr h LYS 208 CO -0.32 0.61 0.62 0.35 -0.57 0.00 0.00 179.45 180.14 3fsr h PHE 209 N 0.59 1.10 -0.01 -1.35 3.57 -0.14 -1.98 116.94 118.71 3fsr h PHE 209 Ca 0.15 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.68 3fsr h PHE 209 Cb 0.18 -0.34 0.00 0.00 2.79 0.00 0.00 35.95 38.58 3fsr h PHE 209 CO 0.00 0.35 -0.14 0.66 -2.23 0.00 0.00 178.31 176.96 3fsr n TYR 210 N -4.68 0.00 0.00 0.41 4.01 -0.20 -4.90 117.16 111.80 3fsr n TYR 210 Ca 0.21 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.95 3fsr n TYR 210 Cb 0.46 -0.09 0.00 0.00 -0.31 0.00 0.00 39.34 39.40 3fsr n TYR 210 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3fsr n GLY 211 N 1.26 0.27 3.69 2.72 0.00 -0.75 -3.84 105.19 108.55 3fsr n GLY 211 Ca 0.15 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.73 3fsr n GLY 211 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fsr n ALA 212 N 0.00 1.91 0.49 4.61 0.00 -0.38 -4.55 120.51 122.58 3fsr n ALA 212 Ca 0.00 0.36 0.11 0.00 0.00 0.00 0.00 53.44 53.91 3fsr n ALA 212 Cb 0.00 -2.51 -0.08 0.00 0.00 0.00 0.00 19.45 16.86 3fsr n ALA 212 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3fsr n THR 213 N 4.32 0.08 -3.79 0.00 -2.24 0.26 -4.56 114.28 108.34 3fsr n THR 213 Ca 0.18 -0.27 -0.13 0.00 -2.27 0.00 0.00 64.05 61.57 3fsr n THR 213 Cb 0.34 0.35 -0.11 0.00 -2.10 0.00 0.00 70.33 68.81 3fsr n THR 213 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 3fsr s ASP 214 N -3.90 -0.22 -0.05 3.42 1.11 -1.11 -4.98 116.67 110.95 3fsr s ASP 214 Ca 0.01 0.34 0.05 0.00 0.18 0.00 0.00 52.55 53.13 3fsr s ASP 214 Cb 0.15 0.45 -0.01 0.00 1.07 0.00 0.00 42.92 44.58 3fsr s ASP 214 CO 0.86 -0.20 -0.21 -0.63 1.18 0.00 0.00 175.17 176.17 3fsr s ILE 215 N -0.36 1.70 0.02 0.77 -1.09 -1.26 -0.71 121.20 120.27 3fsr s ILE 215 Ca -0.05 -0.87 0.03 0.00 -2.23 0.00 0.00 60.65 57.52 3fsr s ILE 215 Cb -0.03 -1.45 -0.02 0.00 -1.58 0.00 0.00 42.46 39.38 3fsr s ILE 215 CO 0.01 0.48 -0.08 -0.76 -1.23 0.00 0.00 174.94 173.36 3fsr s LEU 216 N -0.08 2.13 0.20 2.97 1.43 0.27 -4.97 118.68 120.63 3fsr s LEU 216 Ca -0.03 -0.34 0.07 0.00 -1.03 0.00 0.00 54.13 52.80 3fsr s LEU 216 Cb -0.12 -0.31 -0.05 0.00 0.03 0.00 0.00 46.19 45.74 3fsr s LEU 216 CO 0.03 -0.04 -0.14 0.21 0.23 0.00 0.00 176.35 176.64 3fsr s ASN 217 N -0.88 2.44 0.55 2.29 2.47 -1.26 -0.69 114.94 119.86 3fsr s ASN 217 Ca -0.02 -1.02 0.36 0.00 0.42 0.00 0.00 52.86 52.59 3fsr s ASN 217 Cb -0.06 -0.11 1.62 0.00 -1.45 0.00 0.00 41.25 41.25 3fsr s ASN 217 CO 0.00 -0.20 2.06 1.88 -3.72 0.00 0.00 177.10 177.12 3fsr h TYR 218 N 2.59 0.00 0.00 0.43 0.05 -1.90 -3.09 116.97 115.05 3fsr h TYR 218 Ca -0.38 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.40 3fsr h TYR 218 Cb 1.22 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.96 3fsr h TYR 218 CO 0.70 0.00 0.48 -0.22 -1.05 0.00 0.00 178.16 178.08 3fsr h LYS 219 N 0.00 0.00 -2.11 4.88 3.64 -1.97 1.90 116.57 122.91 3fsr h LYS 219 Ca 0.00 0.00 -0.75 0.00 -1.27 0.00 0.00 60.65 58.63 3fsr h LYS 219 Cb 0.34 0.00 -0.30 0.00 -0.41 0.00 0.00 32.23 31.86 3fsr h LYS 219 CO 0.00 0.00 0.66 0.09 -2.27 0.00 0.00 179.45 177.93 3fsr n ASN 220 N -2.04 6.79 0.00 4.20 4.13 -1.17 -5.03 115.26 122.13 3fsr n ASN 220 Ca -0.01 -3.74 0.00 0.00 1.68 0.00 0.00 54.58 52.51 3fsr n ASN 220 Cb 0.50 -0.99 0.00 0.00 -1.54 0.00 0.00 39.78 37.75 3fsr n ASN 220 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3fsr n GLY 221 N -0.27 1.19 3.29 7.41 0.00 0.64 -4.70 105.19 112.75 3fsr n GLY 221 Ca 0.46 0.27 -0.34 0.00 0.00 0.00 0.00 46.02 46.41 3fsr n GLY 221 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3fsr s HIS 222 N 0.00 2.90 0.19 1.61 3.76 -1.26 -4.76 115.29 117.73 3fsr s HIS 222 Ca 0.00 -0.99 -0.10 0.00 -0.15 0.00 0.00 55.06 53.83 3fsr s HIS 222 Cb 0.00 -2.02 0.10 0.00 1.11 0.00 0.00 32.58 31.76 3fsr s HIS 222 CO 0.00 -0.52 1.70 0.97 -0.85 0.00 0.00 174.74 176.05 3fsr h ILE 223 N 5.68 1.26 -0.08 0.60 6.09 -1.89 -3.26 117.51 125.91 3fsr h ILE 223 Ca -0.39 -0.94 0.04 0.00 -1.37 0.00 0.00 64.86 62.20 3fsr h ILE 223 Cb 1.17 0.60 -0.05 0.00 0.47 0.00 0.00 36.82 39.00 3fsr h ILE 223 CO 0.60 0.36 -0.25 0.58 -3.07 0.00 0.00 178.15 176.37 3fsr h VAL 224 N 0.98 0.41 -0.93 2.19 2.07 -1.96 -0.80 116.25 118.22 3fsr h VAL 224 Ca 0.21 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.81 3fsr h VAL 224 Cb 0.36 0.41 -0.07 0.00 -1.52 0.00 0.00 31.29 30.47 3fsr h VAL 224 CO 0.00 0.00 0.58 0.44 0.02 0.00 0.00 177.57 178.61 3fsr h ASP 225 N -0.35 0.90 -0.68 0.57 3.32 -1.99 0.13 116.42 118.32 3fsr h ASP 225 Ca 0.09 0.02 0.03 0.00 0.02 0.00 0.00 57.03 57.19 3fsr h ASP 225 Cb 0.47 -0.16 -0.04 0.00 0.22 0.00 0.00 39.33 39.81 3fsr h ASP 225 CO -0.28 0.55 0.42 1.56 -1.72 0.00 0.00 179.24 179.77 3fsr h GLN 226 N 1.02 0.79 -0.33 3.56 4.20 -1.27 0.56 115.11 123.64 3fsr h GLN 226 Ca 0.42 -0.05 -0.05 0.00 0.06 0.00 0.00 58.65 59.03 3fsr h GLN 226 Cb 0.26 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 27.85 3fsr h GLN 226 CO -0.20 0.53 0.01 0.28 -0.67 0.00 0.00 178.83 178.77 3fsr h VAL 227 N 0.82 1.26 -0.33 -0.54 2.07 -0.03 -1.36 116.25 118.13 3fsr h VAL 227 Ca 0.28 -0.95 -0.01 0.00 0.82 0.00 0.00 66.70 66.84 3fsr h VAL 227 Cb 0.03 1.22 -0.02 0.00 -1.52 0.00 0.00 31.29 31.01 3fsr h VAL 227 CO -0.11 0.31 0.18 0.24 0.02 0.00 0.00 177.57 178.21 3fsr h MET 228 N 0.39 0.45 -0.15 1.57 2.86 -0.39 -0.98 114.93 118.69 3fsr h MET 228 Ca 0.10 -0.04 -0.19 0.00 -2.06 0.00 0.00 59.70 57.51 3fsr h MET 228 Cb 0.44 -0.10 0.01 0.00 0.06 0.00 0.00 31.60 32.01 3fsr h MET 228 CO 0.02 0.33 -0.65 -0.22 1.06 0.00 0.00 176.91 177.45 3fsr h LYS 229 N 0.46 0.70 -0.59 1.72 3.64 -0.64 1.20 116.57 123.07 3fsr h LYS 229 Ca 0.12 -0.56 0.00 0.00 -1.27 0.00 0.00 60.65 58.94 3fsr h LYS 229 Cb 0.01 0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 31.91 3fsr h LYS 229 CO -0.02 1.18 0.39 -0.07 -2.27 0.00 0.00 179.45 178.65 3fsr h LEU 230 N 0.40 0.68 -2.87 5.20 3.38 -0.70 -2.96 115.31 118.43 3fsr h LEU 230 Ca -0.04 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.91 3fsr h LEU 230 Cb 1.29 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.87 3fsr h LEU 230 CO 0.14 0.50 0.00 0.35 0.09 0.00 0.00 178.44 179.52 3fsr n THR 231 N -4.44 1.20 -3.44 0.22 -2.24 -0.42 -4.96 114.28 100.20 3fsr n THR 231 Ca 0.06 -1.06 -0.20 0.00 -2.27 0.00 0.00 64.05 60.58 3fsr n THR 231 Cb 0.05 0.41 0.08 0.00 -2.10 0.00 0.00 70.33 68.76 3fsr n THR 231 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3fsr n ASN 232 N 1.25 -4.64 0.00 3.42 3.02 -0.32 -1.92 115.26 116.06 3fsr n ASN 232 Ca 0.22 -0.52 0.00 0.00 -0.03 0.00 0.00 54.58 54.25 3fsr n ASN 232 Cb 0.64 -4.69 0.00 0.00 -0.61 0.00 0.00 39.78 35.12 3fsr n ASN 232 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3fsr n GLY 233 N -1.62 0.22 0.08 7.41 0.00 0.40 -4.83 105.19 106.85 3fsr n GLY 233 Ca -0.09 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.87 3fsr n GLY 233 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3fsr h LYS 234 N 0.48 0.00 0.00 1.61 1.57 -1.58 -3.50 116.57 115.15 3fsr h LYS 234 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3fsr h LYS 234 Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.85 3fsr h LYS 234 CO 0.00 0.51 0.00 0.41 -0.57 0.00 0.00 179.45 179.80 3fsr n GLY 235 N 1.48 -2.07 3.40 3.86 0.00 -1.26 -4.65 105.19 105.95 3fsr n GLY 235 Ca -0.13 -1.53 -0.21 0.00 0.00 0.00 0.00 46.02 44.15 3fsr n GLY 235 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3fsr s VAL 236 N -0.06 2.06 0.25 1.61 -7.23 -0.55 -4.87 120.40 111.62 3fsr s VAL 236 Ca 0.00 -2.28 0.05 0.00 -1.81 0.00 0.00 61.98 57.94 3fsr s VAL 236 Cb 0.00 -2.14 -0.02 0.00 0.56 0.00 0.00 36.38 34.78 3fsr s VAL 236 CO 0.00 -0.49 1.60 0.44 -0.31 0.00 0.00 175.10 176.34 3fsr h ASP 237 N 2.48 0.25 -3.71 4.85 3.32 -1.82 0.70 116.42 122.49 3fsr h ASP 237 Ca -0.39 -0.13 -0.15 0.00 0.02 0.00 0.00 57.03 56.38 3fsr h ASP 237 Cb 1.24 -0.07 -0.26 0.00 0.22 0.00 0.00 39.33 40.46 3fsr h ASP 237 CO 0.60 0.76 -0.35 -0.13 -1.72 0.00 0.00 179.24 178.40 3fsr s ARG 238 N -3.85 0.36 -0.08 3.56 1.81 -0.94 -3.11 118.95 116.70 3fsr s ARG 238 Ca -0.04 0.50 0.04 0.00 -1.72 0.00 0.00 55.73 54.51 3fsr s ARG 238 Cb 0.12 0.12 -0.00 0.00 -0.45 0.00 0.00 34.95 34.74 3fsr s ARG 238 CO 0.79 -0.07 -0.22 0.08 -0.68 0.00 0.00 175.30 175.20 3fsr s VAL 239 N 0.46 1.87 -0.24 3.52 1.01 -0.98 -0.66 120.40 125.38 3fsr s VAL 239 Ca -0.02 -0.92 -0.07 0.00 0.00 0.00 0.00 61.98 60.97 3fsr s VAL 239 Cb -0.04 -1.62 -0.03 0.00 0.00 0.00 0.00 36.38 34.70 3fsr s VAL 239 CO -0.02 0.52 0.05 -0.63 0.00 0.00 0.00 175.10 175.02 3fsr s ILE 240 N 0.28 4.23 -0.57 2.22 1.01 0.20 -1.41 121.20 127.16 3fsr s ILE 240 Ca -0.14 -0.21 -0.20 0.00 0.00 0.00 0.00 60.65 60.10 3fsr s ILE 240 Cb -0.16 -2.96 0.08 0.00 0.01 0.00 0.00 42.46 39.43 3fsr s ILE 240 CO 0.07 0.37 0.72 -0.04 0.00 0.00 0.00 174.94 176.06 3fsr s MET 241 N 1.43 3.10 -0.14 2.79 -1.94 -0.18 -0.94 119.30 123.43 3fsr s MET 241 Ca 0.05 -1.04 0.08 0.00 -1.71 0.00 0.00 55.69 53.07 3fsr s MET 241 Cb -0.15 -4.19 -0.14 0.00 2.01 0.00 0.00 34.83 32.36 3fsr s MET 241 CO 0.03 -1.46 -0.03 0.00 -0.01 0.00 0.00 175.02 173.55 3fsr n ALA 242 N 6.51 1.67 -2.88 3.03 0.00 0.29 -1.90 120.51 127.23 3fsr n ALA 242 Ca -0.07 -0.79 -0.10 0.00 0.00 0.00 0.00 53.44 52.48 3fsr n ALA 242 Cb 0.44 0.03 -0.05 0.00 0.00 0.00 0.00 19.45 19.87 3fsr n ALA 242 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3fsr s GLY 243 N -4.94 -0.06 0.00 0.00 0.00 -0.37 -4.50 107.32 97.45 3fsr s GLY 243 Ca -0.12 -0.33 0.00 0.00 0.00 0.00 0.00 44.72 44.27 3fsr s GLY 243 CO 0.47 -0.50 0.00 0.61 0.00 0.00 0.00 173.10 173.68 3fsr n GLY 244 N -0.20 -0.23 3.53 0.20 0.00 -1.26 -3.98 105.19 103.26 3fsr n GLY 244 Ca -0.14 -2.27 -0.25 0.00 0.00 0.00 0.00 46.02 43.36 3fsr n GLY 244 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fsr n GLY 245 N -0.47 -0.85 0.26 -0.02 0.00 -1.26 -4.94 105.19 97.89 3fsr n GLY 245 Ca 0.00 -1.80 0.13 0.00 0.00 0.00 0.00 46.02 44.36 3fsr n GLY 245 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3fsr h SER 246 N -1.29 0.00 0.07 1.61 4.64 -1.92 -2.00 113.55 114.65 3fsr h SER 246 Ca -0.37 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 60.95 3fsr h SER 246 Cb 1.09 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.18 3fsr h SER 246 CO 0.29 0.12 -0.00 1.05 -0.87 0.00 0.00 176.83 177.42 3fsr h GLU 247 N 0.00 0.00 -1.00 4.77 9.09 -1.93 -2.47 114.58 123.04 3fsr h GLU 247 Ca -0.00 0.00 0.17 0.00 0.05 0.00 0.00 59.36 59.57 3fsr h GLU 247 Cb 0.53 0.00 -0.10 0.00 -1.65 0.00 0.00 28.75 27.53 3fsr h GLU 247 CO 0.02 0.00 0.61 1.15 0.05 0.00 0.00 179.01 180.84 3fsr h THR 248 N 0.00 0.78 -0.49 -1.06 2.02 -1.72 -2.06 112.91 110.37 3fsr h THR 248 Ca -0.00 -0.29 -0.01 0.00 0.77 0.00 0.00 66.41 66.88 3fsr h THR 248 Cb 0.03 -0.13 -0.02 0.00 -1.74 0.00 0.00 68.15 66.29 3fsr h THR 248 CO 0.00 0.15 0.25 0.25 0.37 0.00 0.00 175.52 176.55 3fsr h LEU 249 N 0.83 0.63 -0.63 2.58 5.85 -1.66 -0.68 115.31 122.22 3fsr h LEU 249 Ca 0.55 -0.11 -0.06 0.00 0.84 0.00 0.00 57.88 59.10 3fsr h LEU 249 Cb 0.75 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.60 3fsr h LEU 249 CO -0.34 0.56 0.18 -1.28 -0.34 0.00 0.00 178.44 177.21 3fsr h SER 250 N 0.65 0.93 -0.78 1.25 0.87 -1.46 -2.01 113.55 113.00 3fsr h SER 250 Ca 0.17 -0.22 -0.02 0.00 -1.23 0.00 0.00 61.79 60.49 3fsr h SER 250 Cb 0.08 -0.25 -0.04 0.00 -0.44 0.00 0.00 62.40 61.76 3fsr h SER 250 CO -0.02 0.91 0.41 1.56 -0.53 0.00 0.00 176.83 179.15 3fsr h GLN 251 N 0.92 1.09 -0.25 2.24 4.20 -1.05 -2.40 115.11 119.86 3fsr h GLN 251 Ca 0.20 -0.14 -0.01 0.00 0.06 0.00 0.00 58.65 58.76 3fsr h GLN 251 Cb 0.32 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 27.88 3fsr h GLN 251 CO -0.00 0.82 0.11 0.00 -0.67 0.00 0.00 178.83 179.09 3fsr h ALA 252 N 1.21 0.33 -0.57 3.87 0.00 -0.80 -1.82 119.26 121.48 3fsr h ALA 252 Ca 0.27 -0.11 0.04 0.00 0.00 0.00 0.00 54.91 55.11 3fsr h ALA 252 Cb 0.06 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 17.71 3fsr h ALA 252 CO -0.04 -0.08 0.31 0.28 0.00 0.00 0.00 179.25 179.72 3fsr h VAL 253 N 0.26 0.99 0.00 0.00 2.07 -1.25 -1.67 116.25 116.65 3fsr h VAL 253 Ca 0.09 -0.21 -0.05 0.00 0.82 0.00 0.00 66.70 67.35 3fsr h VAL 253 Cb 0.17 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 30.26 3fsr h VAL 253 CO -0.01 0.11 -0.25 0.28 0.02 0.00 0.00 177.57 177.72 3fsr h SER 254 N 0.60 0.00 0.50 0.57 0.02 -1.23 -3.17 113.55 110.84 3fsr h SER 254 Ca 0.25 0.00 -0.29 0.00 -0.84 0.00 0.00 61.79 60.91 3fsr h SER 254 Cb 0.12 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 62.61 3fsr h SER 254 CO -0.15 0.25 -1.69 0.24 -1.14 0.00 0.00 176.83 174.34 3fsr h MET 255 N 0.00 0.01 -6.70 3.45 2.86 -0.73 -3.48 114.93 110.34 3fsr h MET 255 Ca -0.00 -0.01 -0.50 0.00 -2.06 0.00 0.00 59.70 57.13 3fsr h MET 255 Cb 0.49 0.01 -0.03 0.00 0.06 0.00 0.00 31.60 32.13 3fsr h MET 255 CO 0.03 0.53 0.13 0.54 1.06 0.00 0.00 176.91 179.20 3fsr s VAL 256 N -2.60 4.60 0.67 -2.22 0.11 -0.68 -1.48 120.40 118.79 3fsr s VAL 256 Ca -0.05 1.14 -0.15 0.00 -2.93 0.00 0.00 61.98 60.00 3fsr s VAL 256 Cb 0.08 -3.71 0.00 0.00 -1.53 0.00 0.00 36.38 31.22 3fsr s VAL 256 CO 0.82 -0.04 1.12 -0.54 -3.33 0.00 0.00 175.10 173.13 3fsr s LYS 257 N -2.60 2.72 0.24 1.54 1.02 0.24 -4.79 119.74 118.11 3fsr s LYS 257 Ca 0.51 1.43 -0.30 0.00 0.02 0.00 0.00 55.97 57.63 3fsr s LYS 257 Cb -0.13 -1.94 -0.14 0.00 -0.52 0.00 0.00 37.83 35.10 3fsr s LYS 257 CO 0.19 -1.32 1.19 -2.30 -0.92 0.00 0.00 175.35 172.18 3fsr n PRO 258 N -2.45 1.54 -0.11 -1.68 -0.02 -1.26 -1.11 135.00 129.91 3fsr n PRO 258 Ca 0.11 0.54 0.00 0.00 -2.02 0.00 0.00 63.50 62.13 3fsr n PRO 258 Cb 0.52 -2.05 0.00 0.00 -0.02 0.00 0.00 33.50 31.95 3fsr n PRO 258 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3fsr n GLY 259 N 1.68 1.95 0.20 -1.23 0.00 0.25 -4.95 105.19 103.10 3fsr n GLY 259 Ca 0.11 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.12 3fsr n GLY 259 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fsr n GLY 260 N -2.00 -1.49 2.97 -0.02 0.00 -0.27 -4.80 105.19 99.58 3fsr n GLY 260 Ca 0.00 -1.61 -0.13 0.00 0.00 0.00 0.00 46.02 44.28 3fsr n GLY 260 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3fsr s ILE 261 N -1.14 -0.02 -0.08 -0.61 1.01 -1.18 -1.33 121.20 117.84 3fsr s ILE 261 Ca 0.04 0.06 0.02 0.00 0.00 0.00 0.00 60.65 60.77 3fsr s ILE 261 Cb -0.00 -0.20 -0.02 0.00 0.01 0.00 0.00 42.46 42.25 3fsr s ILE 261 CO 0.03 0.03 -0.14 -0.63 0.00 0.00 0.00 174.94 174.22 3fsr s ILE 262 N 0.45 3.00 -0.09 2.92 1.01 0.71 -2.31 121.20 126.90 3fsr s ILE 262 Ca -0.03 -0.72 0.01 0.00 0.00 0.00 0.00 60.65 59.91 3fsr s ILE 262 Cb -0.05 -2.21 0.02 0.00 0.01 0.00 0.00 42.46 40.24 3fsr s ILE 262 CO -0.02 0.56 -0.11 -0.94 0.00 0.00 0.00 174.94 174.44 3fsr s SER 263 N -0.25 1.98 -0.20 3.58 1.04 -0.50 -0.17 113.70 119.18 3fsr s SER 263 Ca 0.01 -0.31 -0.11 0.00 0.48 0.00 0.00 55.95 56.02 3fsr s SER 263 Cb -0.13 -0.85 -0.05 0.00 0.10 0.00 0.00 66.02 65.09 3fsr s SER 263 CO 0.03 -0.03 0.19 0.21 0.98 0.00 0.00 173.24 174.62 3fsr s ASN 264 N 1.10 6.25 -0.19 7.02 2.47 0.20 -1.01 114.94 130.79 3fsr s ASN 264 Ca -0.06 0.28 0.16 0.00 0.42 0.00 0.00 52.86 53.66 3fsr s ASN 264 Cb -0.14 -2.12 0.45 0.00 -1.45 0.00 0.00 41.25 37.99 3fsr s ASN 264 CO -0.02 0.12 1.17 2.30 -3.72 0.00 0.00 177.10 176.96 3fsr n ILE 265 N 3.74 1.55 -4.23 -5.21 -5.35 -0.80 -2.27 119.36 106.79 3fsr n ILE 265 Ca -0.14 -2.89 -0.33 0.00 -0.27 0.00 0.00 62.75 59.11 3fsr n ILE 265 Cb 0.52 0.18 -0.16 0.00 -1.74 0.00 0.00 39.64 38.44 3fsr n ILE 265 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 3fsr s ASN 266 N -3.17 3.47 -0.40 7.28 3.84 -1.24 -4.86 114.94 119.86 3fsr s ASN 266 Ca 0.38 -0.55 -0.29 0.00 0.21 0.00 0.00 52.86 52.61 3fsr s ASN 266 Cb 0.37 -1.54 0.00 0.00 -0.55 0.00 0.00 41.25 39.53 3fsr s ASN 266 CO -0.06 0.02 1.51 -0.47 -2.79 0.00 0.00 177.10 175.32 3fsr s TYR 267 N 1.17 2.24 -1.02 0.43 5.04 -1.26 -4.93 117.35 119.02 3fsr s TYR 267 Ca 0.01 0.65 -0.20 0.00 -2.44 0.00 0.00 57.07 55.10 3fsr s TYR 267 Cb -0.14 -4.27 0.10 0.00 0.35 0.00 0.00 41.96 38.00 3fsr s TYR 267 CO -0.07 -2.22 1.32 -1.01 -1.34 0.00 0.00 175.55 172.23 3fsr s HIS 268 N 5.85 2.90 -0.56 4.97 3.76 -1.26 -4.76 115.29 126.20 3fsr s HIS 268 Ca 0.65 -1.27 0.23 0.00 -0.15 0.00 0.00 55.06 54.53 3fsr s HIS 268 Cb -0.16 -4.48 0.15 0.00 1.11 0.00 0.00 32.58 29.21 3fsr s HIS 268 CO 0.32 -1.68 1.13 0.41 -0.85 0.00 0.00 174.74 174.08 3fsr n GLY 269 N 5.90 -1.32 3.84 -2.22 0.00 -1.26 -4.91 105.19 105.22 3fsr n GLY 269 Ca 0.30 -0.32 -0.29 0.00 0.00 0.00 0.00 46.02 45.71 3fsr n GLY 269 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3fsr s SER 270 N -4.24 4.09 -0.01 1.61 1.04 -1.26 -4.71 113.70 110.22 3fsr s SER 270 Ca 0.04 0.91 0.10 0.00 0.48 0.00 0.00 55.95 57.47 3fsr s SER 270 Cb 0.13 -1.46 0.29 0.00 0.10 0.00 0.00 66.02 65.09 3fsr s SER 270 CO 0.77 -2.18 1.22 0.61 0.98 0.00 0.00 173.24 174.64 3fsr n GLY 271 N -2.74 0.68 3.73 7.32 0.00 -1.26 -4.92 105.19 108.01 3fsr n GLY 271 Ca 0.07 -0.36 -0.36 0.00 0.00 0.00 0.00 46.02 45.38 3fsr n GLY 271 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3fsr s ASP 272 N -0.93 4.57 0.08 1.61 1.01 -1.26 -4.98 116.67 116.77 3fsr s ASP 272 Ca 0.22 2.45 -0.20 0.00 0.71 0.00 0.00 52.55 55.73 3fsr s ASP 272 Cb 0.12 -2.60 -0.07 0.00 1.01 0.00 0.00 42.92 41.38 3fsr s ASP 272 CO 0.14 -2.01 0.59 0.00 0.21 0.00 0.00 175.17 174.10 3fsr s ALA 273 N -1.70 3.58 -0.56 5.23 0.00 -1.26 -4.94 121.76 122.10 3fsr s ALA 273 Ca 0.78 0.07 -0.20 0.00 0.00 0.00 0.00 51.96 52.60 3fsr s ALA 273 Cb -0.32 -2.67 0.07 0.00 0.00 0.00 0.00 23.12 20.21 3fsr s ALA 273 CO 0.40 0.39 0.74 -0.51 0.00 0.00 0.00 175.76 176.79 3fsr s LEU 274 N -1.13 4.91 -0.11 0.00 1.43 -1.26 -4.64 118.68 117.88 3fsr s LEU 274 Ca 0.30 -1.03 -0.01 0.00 -1.03 0.00 0.00 54.13 52.36 3fsr s LEU 274 Cb -0.20 -2.44 -0.03 0.00 0.03 0.00 0.00 46.19 43.56 3fsr s LEU 274 CO 0.20 -1.09 -0.06 -0.76 0.23 0.00 0.00 176.35 174.86 3fsr s LEU 275 N 3.03 3.14 -0.36 1.79 1.43 -1.26 -5.07 118.68 121.38 3fsr s LEU 275 Ca 0.17 -0.11 -0.14 0.00 -1.03 0.00 0.00 54.13 53.02 3fsr s LEU 275 Cb -0.20 -1.72 -0.01 0.00 0.03 0.00 0.00 46.19 44.30 3fsr s LEU 275 CO 0.11 0.26 0.28 -0.63 0.23 0.00 0.00 176.35 176.60 3fsr s ILE 276 N -0.18 5.25 -0.02 -0.59 1.01 -1.26 -3.66 121.20 121.75 3fsr s ILE 276 Ca 0.02 -0.26 -0.30 0.00 0.00 0.00 0.00 60.65 60.11 3fsr s ILE 276 Cb -0.13 -3.79 -0.06 0.00 0.01 0.00 0.00 42.46 38.49 3fsr s ILE 276 CO 0.03 -0.11 1.58 -2.16 0.00 0.00 0.00 174.94 174.28 3fsr s PRO 277 N 1.79 4.21 0.09 2.79 0.05 -1.26 -4.89 135.00 137.77 3fsr s PRO 277 Ca 0.07 2.14 -0.23 0.00 0.05 0.00 0.00 61.00 63.03 3fsr s PRO 277 Cb -0.18 -3.80 -0.14 0.00 0.05 0.00 0.00 34.50 30.43 3fsr s PRO 277 CO 0.11 -0.75 1.72 -0.09 0.05 0.00 0.00 177.00 178.03 3fsr h ARG 278 N 8.83 0.03 0.20 4.56 2.43 -1.96 -1.89 114.38 126.58 3fsr h ARG 278 Ca -0.39 -0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 58.77 3fsr h ARG 278 Cb 1.18 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.72 3fsr h ARG 278 CO 0.94 0.05 -0.10 0.28 -1.51 0.00 0.00 179.97 179.63 3fsr h VAL 279 N 0.01 0.87 0.00 0.20 2.07 -1.96 0.11 116.25 117.55 3fsr h VAL 279 Ca 0.01 -0.39 -0.00 0.00 0.82 0.00 0.00 66.70 67.13 3fsr h VAL 279 Cb 0.02 1.11 -0.00 0.00 -1.52 0.00 0.00 31.29 30.90 3fsr h VAL 279 CO -0.00 0.09 -0.01 -0.33 0.02 0.00 0.00 177.57 177.34 3fsr h GLU 280 N -0.46 0.00 -0.65 1.57 3.07 -1.94 0.62 114.58 116.78 3fsr h GLU 280 Ca -0.03 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.83 3fsr h GLU 280 Cb 0.35 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.26 3fsr h GLU 280 CO 0.05 0.01 0.00 1.87 -1.40 0.00 0.00 179.01 179.54 3fsr n TRP 281 N -3.47 0.85 -3.57 4.33 -0.00 -0.71 -4.69 117.44 110.16 3fsr n TRP 281 Ca -0.03 -0.32 -0.27 0.00 -0.00 0.00 0.00 57.50 56.89 3fsr n TRP 281 Cb 0.10 -0.20 0.01 0.00 -0.00 0.00 0.00 31.31 31.23 3fsr n TRP 281 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 3fsr n GLY 282 N 0.58 -0.50 2.30 5.87 0.00 0.21 -0.59 105.19 113.06 3fsr n GLY 282 Ca 0.13 0.14 -0.16 0.00 0.00 0.00 0.00 46.02 46.13 3fsr n GLY 282 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fsr n GLY 284 N -0.49 1.01 0.46 0.00 0.00 0.24 -4.95 105.19 101.47 3fsr n GLY 284 Ca -0.17 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.32 3fsr n GLY 284 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3fsr n MET 285 N -1.22 0.00 -0.13 1.61 2.81 -0.62 -4.82 117.12 114.74 3fsr n MET 285 Ca 0.00 -0.70 0.10 0.00 -1.81 0.00 0.00 57.70 55.29 3fsr n MET 285 Cb 0.25 -0.37 0.30 0.00 -0.71 0.00 0.00 33.22 32.69 3fsr n MET 285 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3fsr n ALA 286 N 0.00 2.48 -2.27 3.04 0.00 -1.24 -4.92 120.51 117.60 3fsr n ALA 286 Ca 0.00 -0.67 -0.14 0.00 0.00 0.00 0.00 53.44 52.63 3fsr n ALA 286 Cb 0.63 -1.02 -0.02 0.00 0.00 0.00 0.00 19.45 19.05 3fsr n ALA 286 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3fsr n HIS 287 N 0.66 -1.16 -2.71 0.00 8.25 -1.26 -0.58 115.22 118.42 3fsr n HIS 287 Ca 0.16 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.20 3fsr n HIS 287 Cb 0.39 -2.99 -0.03 0.00 1.12 0.00 0.00 29.99 28.48 3fsr n HIS 287 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 3fsr s LYS 288 N -4.74 3.27 0.31 -0.41 1.02 -1.26 -2.83 119.74 115.09 3fsr s LYS 288 Ca 0.00 -0.78 -0.28 0.00 0.02 0.00 0.00 55.97 54.94 3fsr s LYS 288 Cb 0.00 -4.46 -0.09 0.00 -0.52 0.00 0.00 37.83 32.75 3fsr s LYS 288 CO 0.00 -1.99 1.06 0.99 -0.92 0.00 0.00 175.35 174.49 3fsr s THR 289 N 4.64 3.65 -0.19 2.17 2.01 -0.44 -4.88 115.64 122.60 3fsr s THR 289 Ca 0.32 1.54 0.01 0.00 0.31 0.00 0.00 61.69 63.86 3fsr s THR 289 Cb -0.10 -3.93 0.03 0.00 0.01 0.00 0.00 72.50 68.52 3fsr s THR 289 CO 0.06 0.27 -0.16 -0.63 -0.69 0.00 0.00 174.62 173.48 3fsr s ILE 290 N -1.32 1.91 0.28 1.82 1.01 -1.26 -0.20 121.20 123.43 3fsr s ILE 290 Ca 0.48 -0.99 0.11 0.00 0.00 0.00 0.00 60.65 60.26 3fsr s ILE 290 Cb -0.28 -1.82 -0.05 0.00 0.01 0.00 0.00 42.46 40.32 3fsr s ILE 290 CO 0.35 0.39 -0.16 -0.54 0.00 0.00 0.00 174.94 174.98 3fsr s LYS 291 N 1.32 1.80 -0.29 2.79 1.02 0.76 -4.99 119.74 122.15 3fsr s LYS 291 Ca 0.02 -1.69 -0.16 0.00 0.02 0.00 0.00 55.97 54.16 3fsr s LYS 291 Cb -0.14 -1.85 0.16 0.00 -0.52 0.00 0.00 37.83 35.47 3fsr s LYS 291 CO -0.11 0.34 1.02 0.20 -0.92 0.00 0.00 175.35 175.88 3fsr s GLY 292 N -3.52 0.08 -0.25 -3.33 0.00 -1.26 0.63 107.32 99.66 3fsr s GLY 292 Ca 0.30 3.24 -0.21 0.00 0.00 0.00 0.00 44.72 48.05 3fsr s GLY 292 CO 0.16 2.68 0.66 -0.32 0.00 0.00 0.00 173.10 176.28 3fsr s GLY 293 N 1.40 -0.52 0.39 0.20 0.00 -0.96 -4.94 107.32 102.89 3fsr s GLY 293 Ca -0.08 1.97 -0.27 0.00 0.00 0.00 0.00 44.72 46.33 3fsr s GLY 293 CO -0.14 1.77 1.43 -2.27 0.00 0.00 0.00 173.10 173.89 3fsr s LEU 294 N 0.64 4.29 0.49 0.66 2.96 -1.26 -4.76 118.68 121.70 3fsr s LEU 294 Ca -0.02 2.93 -0.23 0.00 -0.22 0.00 0.00 54.13 56.59 3fsr s LEU 294 Cb -0.05 -3.73 -0.07 0.00 0.50 0.00 0.00 46.19 42.83 3fsr s LEU 294 CO -0.04 -0.87 1.22 0.00 -1.32 0.00 0.00 176.35 175.34 3fsr s PRO 296 N -2.51 2.20 0.00 0.00 0.02 -1.26 -4.87 135.00 128.58 3fsr s PRO 296 Ca 0.67 1.88 0.00 0.00 0.02 0.00 0.00 61.00 63.58 3fsr s PRO 296 Cb -0.47 -1.83 0.00 0.00 0.02 0.00 0.00 34.50 32.23 3fsr s PRO 296 CO 0.53 -1.82 0.00 0.41 -0.33 0.00 0.00 177.00 175.79 3fsr n GLY 297 N 0.62 5.93 0.00 0.52 0.00 -1.26 -4.76 105.19 106.25 3fsr n GLY 297 Ca 0.14 -1.59 0.00 0.00 0.00 0.00 0.00 46.02 44.58 3fsr n GLY 297 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fsr n GLY 298 N 2.10 -1.84 0.25 -0.02 0.00 -0.79 -4.22 105.19 100.66 3fsr n GLY 298 Ca 0.00 -1.52 -0.12 0.00 0.00 0.00 0.00 46.02 44.39 3fsr n GLY 298 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3fsr h ARG 299 N 0.00 -0.36 -0.53 1.61 2.43 -1.20 -2.54 114.38 113.79 3fsr h ARG 299 Ca 0.00 0.02 0.02 0.00 -0.81 0.00 0.00 59.98 59.21 3fsr h ARG 299 Cb 0.00 0.08 -0.03 0.00 -0.42 0.00 0.00 29.97 29.60 3fsr h ARG 299 CO 0.00 -0.24 0.33 1.25 -1.51 0.00 0.00 179.97 179.80 3fsr h LEU 300 N -0.37 0.55 -0.25 3.80 5.85 -1.84 0.30 115.31 123.35 3fsr h LEU 300 Ca 0.04 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.76 3fsr h LEU 300 Cb 0.42 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.31 3fsr h LEU 300 CO -0.15 0.39 0.16 -0.09 -0.34 0.00 0.00 178.44 178.41 3fsr h ARG 301 N 0.66 0.33 -0.85 1.25 9.65 -1.71 -0.61 114.38 123.10 3fsr h ARG 301 Ca 0.21 -0.02 -0.03 0.00 -1.10 0.00 0.00 59.98 59.04 3fsr h ARG 301 Cb -0.01 -0.07 -0.04 0.00 -1.39 0.00 0.00 29.97 28.45 3fsr h ARG 301 CO -0.08 0.22 0.43 0.52 2.80 0.00 0.00 179.97 183.86 3fsr h MET 302 N 0.34 1.22 -0.64 0.20 2.86 -0.94 -1.72 114.93 116.25 3fsr h MET 302 Ca 0.09 -0.17 -0.08 0.00 -2.06 0.00 0.00 59.70 57.49 3fsr h MET 302 Cb -0.04 -0.22 -0.02 0.00 0.06 0.00 0.00 31.60 31.37 3fsr h MET 302 CO -0.02 0.92 0.10 0.93 1.06 0.00 0.00 176.91 179.90 3fsr h GLU 303 N 1.21 1.06 -0.59 1.72 5.08 -0.00 -0.17 114.58 122.88 3fsr h GLU 303 Ca 0.30 -0.29 -0.10 0.00 -1.00 0.00 0.00 59.36 58.27 3fsr h GLU 303 Cb 0.09 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.20 3fsr h GLU 303 CO -0.04 0.98 -0.04 0.00 -1.00 0.00 0.00 179.01 178.91 3fsr h ARG 304 N 0.97 1.06 -0.04 2.33 3.08 -0.90 -0.96 114.38 119.93 3fsr h ARG 304 Ca 0.19 -0.36 -0.19 0.00 0.07 0.00 0.00 59.98 59.69 3fsr h ARG 304 Cb 0.44 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.40 3fsr h ARG 304 CO 0.01 1.06 -0.81 -0.07 -1.07 0.00 0.00 179.97 179.10 3fsr h LEU 305 N 0.96 0.41 -0.60 3.04 3.38 -1.14 -2.45 115.31 118.91 3fsr h LEU 305 Ca 0.16 -0.30 0.03 0.00 0.09 0.00 0.00 57.88 57.87 3fsr h LEU 305 Cb 0.60 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 41.19 3fsr h LEU 305 CO 0.04 1.06 0.35 0.40 0.09 0.00 0.00 178.44 180.38 3fsr h ILE 306 N 0.21 1.04 -0.62 1.22 2.04 -0.85 -1.13 117.51 119.41 3fsr h ILE 306 Ca -0.04 -0.24 0.06 0.00 1.00 0.00 0.00 64.86 65.64 3fsr h ILE 306 Cb 1.40 0.29 -0.04 0.00 -0.74 0.00 0.00 36.82 37.74 3fsr h ILE 306 CO 0.13 0.13 0.41 0.44 0.00 0.00 0.00 178.15 179.26 3fsr h ASP 307 N 0.69 0.54 -0.51 1.72 3.32 -0.94 0.45 116.42 121.68 3fsr h ASP 307 Ca 0.25 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 57.21 3fsr h ASP 307 Cb 0.06 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.48 3fsr h ASP 307 CO -0.12 0.35 -0.01 -0.07 -1.72 0.00 0.00 179.24 177.67 3fsr h LEU 308 N 0.62 0.90 -0.06 1.55 3.38 -0.77 -0.12 115.31 120.81 3fsr h LEU 308 Ca 0.27 -0.31 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 3fsr h LEU 308 Cb 0.26 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 3fsr h LEU 308 CO -0.08 1.00 -0.02 0.58 0.09 0.00 0.00 178.44 180.01 3fsr h VAL 309 N 0.78 1.31 -0.17 1.22 2.07 -0.81 0.49 116.25 121.14 3fsr h VAL 309 Ca 0.14 -0.97 0.05 0.00 0.82 0.00 0.00 66.70 66.74 3fsr h VAL 309 Cb 0.54 1.85 -0.05 0.00 -1.52 0.00 0.00 31.29 32.11 3fsr h VAL 309 CO 0.03 0.27 -0.14 0.15 0.02 0.00 0.00 177.57 177.89 3fsr h PHE 310 N -0.25 -0.36 -0.16 1.57 3.57 0.08 -0.15 116.94 121.24 3fsr h PHE 310 Ca 0.01 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.54 3fsr h PHE 310 Cb 0.43 0.19 0.00 0.00 2.79 0.00 0.00 35.95 39.36 3fsr h PHE 310 CO 0.06 -0.21 0.00 0.66 -2.23 0.00 0.00 178.31 176.59 3fsr n TYR 311 N -5.30 0.22 -3.42 0.41 4.01 -0.07 -4.91 117.16 108.10 3fsr n TYR 311 Ca -0.02 -0.11 -0.20 0.00 -0.16 0.00 0.00 57.90 57.41 3fsr n TYR 311 Cb 0.21 -0.01 0.07 0.00 -0.31 0.00 0.00 39.34 39.31 3fsr n TYR 311 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 3fsr n LYS 312 N -0.03 -6.78 0.10 -0.72 5.02 -0.07 -4.90 118.16 110.79 3fsr n LYS 312 Ca 0.05 0.72 0.04 0.00 -2.02 0.00 0.00 58.31 57.11 3fsr n LYS 312 Cb 0.15 -5.44 -0.00 0.00 -0.02 0.00 0.00 35.03 29.71 3fsr n LYS 312 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3fsr h ARG 313 N -2.25 0.00 -3.98 1.97 2.47 -0.24 -3.46 114.38 108.89 3fsr h ARG 313 Ca -0.50 0.00 -0.20 0.00 -1.26 0.00 0.00 59.98 58.02 3fsr h ARG 313 Cb 1.32 0.00 -0.23 0.00 -1.65 0.00 0.00 29.97 29.41 3fsr h ARG 313 CO 0.48 0.30 -0.71 0.08 0.56 0.00 0.00 179.97 180.68 3fsr s VAL 314 N -3.03 0.13 -0.44 2.04 1.01 -1.15 -5.01 120.40 113.95 3fsr s VAL 314 Ca 0.01 -0.69 0.03 0.00 0.00 0.00 0.00 61.98 61.34 3fsr s VAL 314 Cb 0.08 -0.23 0.12 0.00 0.00 0.00 0.00 36.38 36.34 3fsr s VAL 314 CO 0.77 -0.35 0.18 -0.62 0.00 0.00 0.00 175.10 175.08 3fsr s ASP 315 N -1.08 4.34 0.00 3.32 2.15 -1.26 -4.45 116.67 119.69 3fsr s ASP 315 Ca -0.11 -2.59 0.27 0.00 0.43 0.00 0.00 52.55 50.54 3fsr s ASP 315 Cb -0.07 -1.49 1.20 0.00 -0.30 0.00 0.00 42.92 42.26 3fsr s ASP 315 CO -0.01 -0.30 1.88 -0.81 -0.17 0.00 0.00 175.17 175.77 3fsr n PRO 316 N 3.65 0.09 0.29 4.34 -0.04 -1.26 -3.60 135.00 138.48 3fsr n PRO 316 Ca 0.05 0.04 0.18 0.00 -0.04 0.00 0.00 63.50 63.72 3fsr n PRO 316 Cb 0.36 -1.50 0.99 0.00 -0.04 0.00 0.00 33.50 33.31 3fsr n PRO 316 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3fsr h SER 317 N 0.00 0.00 0.02 3.54 4.64 -1.88 0.28 113.55 120.15 3fsr h SER 317 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3fsr h SER 317 Cb 0.41 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.50 3fsr h SER 317 CO 0.00 0.00 -0.01 0.11 -0.87 0.00 0.00 176.83 176.06 3fsr h LYS 318 N 0.00 0.00 0.00 4.77 1.79 -1.98 -0.35 116.57 120.80 3fsr h LYS 318 Ca 0.02 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.49 3fsr h LYS 318 Cb 0.16 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.81 3fsr h LYS 318 CO -0.00 0.01 0.00 -0.07 -1.08 0.00 0.00 179.45 178.31 3fsr h LEU 319 N 0.00 0.00 -8.23 2.94 3.38 -1.23 -3.41 115.31 108.75 3fsr h LEU 319 Ca -0.00 0.00 -0.73 0.00 0.09 0.00 0.00 57.88 57.24 3fsr h LEU 319 Cb 0.02 0.00 -0.24 0.00 0.09 0.00 0.00 40.66 40.52 3fsr h LEU 319 CO 0.00 0.00 -0.38 -0.69 0.09 0.00 0.00 178.44 177.46 3fsr s VAL 320 N -3.37 4.87 -0.06 1.22 1.01 -0.14 -1.23 120.40 122.69 3fsr s VAL 320 Ca 0.04 -1.19 0.18 0.00 0.00 0.00 0.00 61.98 61.01 3fsr s VAL 320 Cb 0.09 -3.93 -0.27 0.00 0.00 0.00 0.00 36.38 32.27 3fsr s VAL 320 CO 0.44 -0.55 0.32 0.35 0.00 0.00 0.00 175.10 175.66 3fsr n THR 321 N 5.10 0.31 -4.27 3.92 -2.24 -0.83 -4.94 114.28 111.33 3fsr n THR 321 Ca -0.12 -0.51 -0.19 0.00 -2.27 0.00 0.00 64.05 60.96 3fsr n THR 321 Cb 0.43 -0.09 -0.15 0.00 -2.10 0.00 0.00 70.33 68.42 3fsr n THR 321 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 3fsr s HIS 322 N -3.07 0.76 -0.07 4.78 3.76 -1.22 -5.01 115.29 115.21 3fsr s HIS 322 Ca -0.07 -0.18 0.02 0.00 -0.15 0.00 0.00 55.06 54.67 3fsr s HIS 322 Cb 0.10 -0.57 0.02 0.00 1.11 0.00 0.00 32.58 33.24 3fsr s HIS 322 CO 0.76 -0.10 -0.10 0.08 -0.85 0.00 0.00 174.74 174.53 3fsr s VAL 323 N 0.29 1.04 0.39 -0.90 1.01 -1.26 -0.86 120.40 120.11 3fsr s VAL 323 Ca -0.04 -0.40 0.08 0.00 0.00 0.00 0.00 61.98 61.62 3fsr s VAL 323 Cb -0.08 -0.98 -0.06 0.00 0.00 0.00 0.00 36.38 35.26 3fsr s VAL 323 CO 0.00 0.34 0.07 -0.36 0.00 0.00 0.00 175.10 175.15 3fsr s PHE 324 N 0.86 2.55 -0.06 5.22 0.08 0.21 -4.97 117.98 121.86 3fsr s PHE 324 Ca -0.11 -0.57 0.01 0.00 0.12 0.00 0.00 56.93 56.38 3fsr s PHE 324 Cb -0.15 -1.76 0.02 0.00 -0.57 0.00 0.00 43.02 40.56 3fsr s PHE 324 CO 0.01 0.36 -0.08 1.03 -0.10 0.00 0.00 175.22 176.44 3fsr s ARG 325 N -3.78 1.32 0.00 0.44 1.81 -1.26 -0.96 118.95 116.52 3fsr s ARG 325 Ca 0.37 -0.26 0.00 0.00 -1.72 0.00 0.00 55.73 54.12 3fsr s ARG 325 Cb 0.05 -1.21 0.00 0.00 -0.45 0.00 0.00 34.95 33.34 3fsr s ARG 325 CO 0.20 -0.06 0.00 0.41 -0.68 0.00 0.00 175.30 175.17 3fsr n GLY 326 N 4.08 2.12 0.43 -3.53 0.00 -0.05 -4.58 105.19 103.66 3fsr n GLY 326 Ca -0.22 -1.55 0.34 0.00 0.00 0.00 0.00 46.02 44.59 3fsr n GLY 326 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3fsr h PHE 327 N 0.00 0.60 0.00 1.61 3.57 -1.96 -0.04 116.94 120.72 3fsr h PHE 327 Ca 0.00 0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.46 3fsr h PHE 327 Cb 0.00 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 38.58 3fsr h PHE 327 CO 0.00 -0.20 -0.31 -0.44 -2.23 0.00 0.00 178.31 175.12 3fsr h ASP 328 N 0.13 0.00 0.06 0.41 3.45 -1.99 -2.83 116.42 115.64 3fsr h ASP 328 Ca 0.80 0.00 0.00 0.00 0.43 0.00 0.00 57.03 58.26 3fsr h ASP 328 Cb 2.36 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 41.13 3fsr h ASP 328 CO -0.46 0.31 0.00 0.59 -1.57 0.00 0.00 179.24 178.12 3fsr n ASN 329 N -3.39 0.00 -0.09 6.45 3.02 -0.03 -3.04 115.26 118.18 3fsr n ASN 329 Ca 0.00 -0.63 -0.06 0.00 -0.03 0.00 0.00 54.58 53.86 3fsr n ASN 329 Cb 0.51 -0.04 0.00 0.00 -0.61 0.00 0.00 39.78 39.65 3fsr n ASN 329 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 3fsr h ILE 330 N 0.00 0.57 -0.86 2.41 2.04 -1.65 0.98 117.51 121.00 3fsr h ILE 330 Ca 0.00 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.91 3fsr h ILE 330 Cb 0.03 0.57 -0.06 0.00 -0.74 0.00 0.00 36.82 36.62 3fsr h ILE 330 CO 0.00 0.00 0.54 -0.08 0.00 0.00 0.00 178.15 178.61 3fsr h GLU 331 N -0.07 0.98 -0.71 2.37 4.81 -1.80 0.20 114.58 120.35 3fsr h GLU 331 Ca 0.16 -0.06 -0.07 0.00 -0.13 0.00 0.00 59.36 59.27 3fsr h GLU 331 Cb 0.32 -0.22 -0.03 0.00 0.63 0.00 0.00 28.75 29.45 3fsr h GLU 331 CO -0.38 0.65 0.17 -0.22 -0.73 0.00 0.00 179.01 178.50 3fsr h LYS 332 N 1.00 1.14 -0.22 1.92 3.64 -1.61 0.94 116.57 123.39 3fsr h LYS 332 Ca 0.36 -0.27 -0.17 0.00 -1.27 0.00 0.00 60.65 59.30 3fsr h LYS 332 Cb 0.11 -0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 31.78 3fsr h LYS 332 CO -0.15 1.00 -0.55 0.00 -2.27 0.00 0.00 179.45 177.48 3fsr h ALA 333 N 1.10 0.63 -0.24 5.00 0.00 0.44 0.41 119.26 126.61 3fsr h ALA 333 Ca 0.22 -0.51 -0.08 0.00 0.00 0.00 0.00 54.91 54.54 3fsr h ALA 333 Cb 0.38 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 3fsr h ALA 333 CO 0.00 0.69 -0.15 0.35 0.00 0.00 0.00 179.25 180.14 3fsr h PHE 334 N 0.50 0.61 -0.68 0.00 3.57 -0.44 -1.27 116.94 119.23 3fsr h PHE 334 Ca 0.01 -0.16 -0.02 0.00 3.53 0.00 0.00 57.97 61.33 3fsr h PHE 334 Cb 1.11 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 39.68 3fsr h PHE 334 CO 0.05 0.81 0.35 0.52 -2.23 0.00 0.00 178.31 177.81 3fsr h MET 335 N 0.24 0.96 -0.37 1.11 2.86 -0.79 -1.90 114.93 117.05 3fsr h MET 335 Ca 0.05 -0.13 0.06 0.00 -2.06 0.00 0.00 59.70 57.62 3fsr h MET 335 Cb 0.67 -0.18 -0.02 0.00 0.06 0.00 0.00 31.60 32.13 3fsr h MET 335 CO 0.04 0.74 0.25 1.25 1.06 0.00 0.00 176.91 180.26 3fsr h LEU 336 N 0.94 0.22 -0.30 1.22 5.85 -0.71 -0.21 115.31 122.32 3fsr h LEU 336 Ca 0.24 -0.00 -0.18 0.00 0.84 0.00 0.00 57.88 58.78 3fsr h LEU 336 Cb 0.08 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.04 3fsr h LEU 336 CO -0.03 0.15 -0.85 -0.03 -0.34 0.00 0.00 178.44 177.33 3fsr h MET 337 N 0.25 0.01 -0.34 1.25 4.05 -0.56 -3.33 114.93 116.26 3fsr h MET 337 Ca 0.16 -0.01 -0.16 0.00 -0.28 0.00 0.00 59.70 59.41 3fsr h MET 337 Cb 0.33 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 31.13 3fsr h MET 337 CO -0.03 0.86 -0.42 -0.22 0.23 0.00 0.00 176.91 177.33 3fsr h LYS 338 N 0.01 0.88 -2.48 0.39 3.64 -0.28 -3.30 116.57 115.43 3fsr h LYS 338 Ca -0.01 -0.50 -0.71 0.00 -1.27 0.00 0.00 60.65 58.16 3fsr h LYS 338 Cb 1.51 0.03 -0.34 0.00 -0.41 0.00 0.00 32.23 33.01 3fsr h LYS 338 CO 0.11 1.14 0.17 -0.40 -2.27 0.00 0.00 179.45 178.20 3fsr n ASP 339 N -4.08 5.44 -4.51 4.20 5.68 -1.04 -5.03 116.55 117.20 3fsr n ASP 339 Ca -0.03 -3.51 -0.39 0.00 -0.50 0.00 0.00 54.79 50.36 3fsr n ASP 339 Cb 0.56 -0.95 -0.13 0.00 -1.14 0.00 0.00 41.12 39.45 3fsr n ASP 339 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 3fsr n LYS 340 N 0.70 0.19 -0.76 0.11 5.02 -1.24 -4.93 118.16 117.25 3fsr n LYS 340 Ca 0.31 -0.01 -0.29 0.00 -2.02 0.00 0.00 58.31 56.30 3fsr n LYS 340 Cb 0.35 -1.84 0.21 0.00 -0.02 0.00 0.00 35.03 33.73 3fsr n LYS 340 CO 0.00 0.00 0.00 -2.14 -0.52 0.00 0.00 177.40 174.74 3fsr s PRO 341 N 8.78 -0.11 0.39 1.97 0.02 -1.26 -4.94 135.00 139.85 3fsr s PRO 341 Ca 1.29 0.90 0.25 0.00 0.02 0.00 0.00 61.00 63.46 3fsr s PRO 341 Cb -1.04 -1.64 0.61 0.00 0.02 0.00 0.00 34.50 32.46 3fsr s PRO 341 CO 0.45 -3.20 1.70 0.87 -0.33 0.00 0.00 177.00 176.49 3fsr h LYS 342 N -2.25 0.00 -0.03 5.54 1.57 -2.00 -3.09 116.57 116.30 3fsr h LYS 342 Ca -0.56 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.22 3fsr h LYS 342 Cb 1.32 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.63 3fsr h LYS 342 CO 0.51 0.00 0.00 -0.40 -0.57 0.00 0.00 179.45 178.99 3fsr n ASP 343 N -2.86 2.52 -4.74 0.86 5.75 -1.26 -4.49 116.55 112.32 3fsr n ASP 343 Ca 0.04 -1.84 -0.39 0.00 -0.01 0.00 0.00 54.79 52.59 3fsr n ASP 343 Cb 0.46 -0.01 -0.05 0.00 -1.03 0.00 0.00 41.12 40.49 3fsr n ASP 343 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 3fsr s LEU 344 N -1.99 4.38 0.01 -2.12 2.96 -1.17 -4.88 118.68 115.87 3fsr s LEU 344 Ca 0.31 1.17 -0.01 0.00 -0.22 0.00 0.00 54.13 55.39 3fsr s LEU 344 Cb 0.20 -2.98 -0.00 0.00 0.50 0.00 0.00 46.19 43.91 3fsr s LEU 344 CO 0.31 0.02 -0.01 -0.38 -1.32 0.00 0.00 176.35 174.97 3fsr n ILE 345 N 3.12 0.26 -3.77 6.68 5.41 -1.26 -4.91 119.36 124.87 3fsr n ILE 345 Ca -0.05 0.14 -0.17 0.00 1.00 0.00 0.00 62.75 63.67 3fsr n ILE 345 Cb 0.51 -1.21 -0.17 0.00 -0.71 0.00 0.00 39.64 38.07 3fsr n ILE 345 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 3fsr s LYS 346 N -1.23 0.03 0.01 0.38 2.47 -0.36 -4.80 119.74 116.24 3fsr s LYS 346 Ca -0.01 0.21 -0.09 0.00 -1.56 0.00 0.00 55.97 54.52 3fsr s LYS 346 Cb 0.00 -0.38 -0.05 0.00 -1.46 0.00 0.00 37.83 35.94 3fsr s LYS 346 CO 0.01 -0.21 0.32 -1.25 0.16 0.00 0.00 175.35 174.39 3fsr s PRO 347 N 1.37 3.68 0.00 4.03 0.05 -1.26 -1.96 135.00 140.91 3fsr s PRO 347 Ca -0.05 0.09 0.06 0.00 0.05 0.00 0.00 61.00 61.14 3fsr s PRO 347 Cb -0.13 -3.10 -0.02 0.00 0.05 0.00 0.00 34.50 31.31 3fsr s PRO 347 CO -0.03 0.65 -0.19 0.08 0.05 0.00 0.00 177.00 177.56 3fsr s VAL 348 N -1.25 1.51 -0.30 -0.36 1.01 -0.04 -3.96 120.40 117.01 3fsr s VAL 348 Ca 0.27 -0.92 -0.05 0.00 0.00 0.00 0.00 61.98 61.28 3fsr s VAL 348 Cb -0.14 -1.28 0.03 0.00 0.00 0.00 0.00 36.38 34.99 3fsr s VAL 348 CO 0.15 0.34 0.05 -0.69 0.00 0.00 0.00 175.10 174.94 3fsr s VAL 349 N -0.56 3.53 -0.20 2.92 1.01 0.83 -0.62 120.40 127.31 3fsr s VAL 349 Ca 0.07 -1.03 -0.19 0.00 0.00 0.00 0.00 61.98 60.82 3fsr s VAL 349 Cb -0.08 -2.92 -0.03 0.00 0.00 0.00 0.00 36.38 33.36 3fsr s VAL 349 CO 0.00 -0.03 0.57 -0.63 0.00 0.00 0.00 175.10 175.01 3fsr s ILE 350 N 1.39 5.07 0.22 2.22 1.01 -0.13 -1.58 121.20 129.39 3fsr s ILE 350 Ca -0.01 1.06 -0.15 0.00 0.00 0.00 0.00 60.65 61.55 3fsr s ILE 350 Cb -0.18 -3.89 -0.08 0.00 0.01 0.00 0.00 42.46 38.32 3fsr s ILE 350 CO 0.01 0.15 0.64 -0.76 0.00 0.00 0.00 174.94 174.97 3fsr s LEU 351 N 1.76 4.26 0.00 2.97 1.02 -0.55 -0.87 118.68 127.27 3fsr s LEU 351 Ca 0.26 1.20 0.17 0.00 0.02 0.00 0.00 54.13 55.78 3fsr s LEU 351 Cb -0.16 -3.58 1.03 0.00 0.02 0.00 0.00 46.19 43.50 3fsr s LEU 351 CO 0.10 -0.00 1.43 0.00 0.02 0.00 0.00 176.35 177.89