#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j21 s LYS 2 N 0.00 1.82 -0.06 2.12 1.02 -1.26 0.14 119.74 123.51 1j21 s LYS 2 Ca 0.00 -1.12 0.00 0.00 0.02 0.00 0.00 55.97 54.87 1j21 s LYS 2 Cb 0.00 -2.05 0.02 0.00 -0.52 0.00 0.00 37.83 35.28 1j21 s LYS 2 CO 0.00 0.51 -0.04 0.42 -0.92 0.00 0.00 175.35 175.32 1j21 s ILE 3 N -0.93 0.58 -0.41 2.17 1.01 -0.22 -3.37 121.20 120.03 1j21 s ILE 3 Ca 0.14 -0.09 -0.20 0.00 0.00 0.00 0.00 60.65 60.50 1j21 s ILE 3 Cb -0.10 -0.64 0.02 0.00 0.01 0.00 0.00 42.46 41.75 1j21 s ILE 3 CO 0.05 0.26 0.63 -0.69 0.00 0.00 0.00 174.94 175.18 1j21 s VAL 4 N 1.32 4.86 -0.17 2.92 1.01 -0.50 -1.06 120.40 128.78 1j21 s VAL 4 Ca -0.04 0.25 -0.09 0.00 0.00 0.00 0.00 61.98 62.10 1j21 s VAL 4 Cb -0.14 -4.15 -0.05 0.00 0.00 0.00 0.00 36.38 32.05 1j21 s VAL 4 CO -0.02 -0.49 0.12 -0.22 0.00 0.00 0.00 175.10 174.48 1j21 s LEU 5 N 2.74 4.16 -0.67 3.92 2.96 -0.25 -0.86 118.68 130.68 1j21 s LEU 5 Ca 0.23 0.26 -0.27 0.00 -0.22 0.00 0.00 54.13 54.12 1j21 s LEU 5 Cb -0.14 -2.05 0.02 0.00 0.50 0.00 0.00 46.19 44.51 1j21 s LEU 5 CO 0.17 0.24 1.38 0.00 -1.32 0.00 0.00 176.35 176.83 1j21 s ALA 6 N -0.01 2.70 -0.30 5.97 0.00 -0.36 -0.97 121.76 128.80 1j21 s ALA 6 Ca 0.09 -1.08 -0.09 0.00 0.00 0.00 0.00 51.96 50.89 1j21 s ALA 6 Cb -0.11 -4.21 -0.01 0.00 0.00 0.00 0.00 23.12 18.78 1j21 s ALA 6 CO -0.00 -3.25 0.12 -0.47 0.00 0.00 0.00 175.76 172.16 1j21 s TYR 7 N 6.21 3.15 -1.39 0.00 5.04 0.11 -4.55 117.35 125.93 1j21 s TYR 7 Ca 0.44 -0.64 0.24 0.00 -2.44 0.00 0.00 57.07 54.67 1j21 s TYR 7 Cb -0.09 -2.31 0.24 0.00 0.35 0.00 0.00 41.96 40.15 1j21 s TYR 7 CO 0.19 -0.47 1.23 -1.13 -1.34 0.00 0.00 175.55 174.03 1j21 n SER 8 N 4.95 1.09 0.00 4.32 3.41 -1.26 -3.80 113.62 122.33 1j21 n SER 8 Ca -0.14 -0.88 0.00 0.00 -0.26 0.00 0.00 58.87 57.58 1j21 n SER 8 Cb 0.49 0.49 0.00 0.00 -0.26 0.00 0.00 64.21 64.93 1j21 n SER 8 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1j21 n GLY 9 N 1.45 0.97 0.91 5.00 0.00 -1.26 -4.96 105.19 107.30 1j21 n GLY 9 Ca 0.07 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.02 1j21 n GLY 9 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j21 n GLY 10 N -2.00 -1.36 0.16 -0.02 0.00 -1.26 -4.86 105.19 95.85 1j21 n GLY 10 Ca 0.00 -1.66 -0.14 0.00 0.00 0.00 0.00 46.02 44.23 1j21 n GLY 10 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1j21 h LEU 11 N 0.00 -0.27 -0.04 0.99 5.85 -1.97 -2.71 115.31 117.15 1j21 h LEU 11 Ca -0.10 -0.11 0.02 0.00 0.84 0.00 0.00 57.88 58.53 1j21 h LEU 11 Cb 0.29 0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.36 1j21 h LEU 11 CO 0.07 -0.05 -0.07 0.44 -0.34 0.00 0.00 178.44 178.49 1j21 h ASP 12 N -0.49 -0.22 0.43 1.25 3.32 -1.98 0.63 116.42 119.36 1j21 h ASP 12 Ca -0.03 0.04 -0.03 0.00 0.02 0.00 0.00 57.03 57.02 1j21 h ASP 12 Cb 0.36 0.11 -0.00 0.00 0.22 0.00 0.00 39.33 40.01 1j21 h ASP 12 CO 0.05 -0.11 -0.16 0.71 -1.72 0.00 0.00 179.24 178.01 1j21 h THR 13 N -0.11 0.67 -0.13 0.35 1.35 -1.95 0.33 112.91 113.43 1j21 h THR 13 Ca 0.05 -0.69 -0.15 0.00 -0.55 0.00 0.00 66.41 65.06 1j21 h THR 13 Cb 0.17 1.43 0.01 0.00 -1.73 0.00 0.00 68.15 68.03 1j21 h THR 13 CO -0.11 0.16 -0.52 0.28 -0.25 0.00 0.00 175.52 175.08 1j21 h SER 14 N 0.00 0.68 -0.78 5.36 0.02 -1.05 0.02 113.55 117.79 1j21 h SER 14 Ca -0.00 -0.62 -0.05 0.00 -0.84 0.00 0.00 61.79 60.28 1j21 h SER 14 Cb 0.42 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.73 1j21 h SER 14 CO 0.02 1.19 0.31 0.40 -1.14 0.00 0.00 176.83 177.61 1j21 h ILE 15 N 0.21 1.26 -0.37 3.27 2.04 -0.27 -1.83 117.51 121.83 1j21 h ILE 15 Ca -0.03 -0.83 -0.05 0.00 1.00 0.00 0.00 64.86 64.95 1j21 h ILE 15 Cb 1.16 0.33 -0.02 0.00 -0.74 0.00 0.00 36.82 37.55 1j21 h ILE 15 CO 0.11 0.34 0.00 0.40 0.00 0.00 0.00 178.15 179.00 1j21 h ILE 16 N 1.14 1.21 -0.24 -0.67 2.04 -0.22 0.25 117.51 121.02 1j21 h ILE 16 Ca 0.26 -0.82 -0.01 0.00 1.00 0.00 0.00 64.86 65.28 1j21 h ILE 16 Cb 0.23 0.93 -0.01 0.00 -0.74 0.00 0.00 36.82 37.22 1j21 h ILE 16 CO -0.02 0.28 0.09 0.25 0.00 0.00 0.00 178.15 178.76 1j21 h LEU 17 N 0.55 0.33 -0.24 1.44 6.46 -0.17 -0.15 115.31 123.52 1j21 h LEU 17 Ca 0.12 -0.17 -0.01 0.00 -0.12 0.00 0.00 57.88 57.69 1j21 h LEU 17 Cb 0.35 -0.09 -0.01 0.00 -0.73 0.00 0.00 40.66 40.18 1j21 h LEU 17 CO 0.01 0.41 0.10 0.11 -0.62 0.00 0.00 178.44 178.45 1j21 h LYS 18 N 0.23 0.36 -0.53 1.25 1.79 -0.97 -2.76 116.57 115.94 1j21 h LYS 18 Ca 0.08 -0.06 0.08 0.00 -2.18 0.00 0.00 60.65 58.57 1j21 h LYS 18 Cb 0.18 -0.06 -0.07 0.00 -1.58 0.00 0.00 32.23 30.71 1j21 h LYS 18 CO -0.01 0.39 0.16 2.35 -1.08 0.00 0.00 179.45 181.27 1j21 h TRP 19 N 0.24 0.28 -0.76 -1.35 7.01 -0.77 -2.25 115.95 118.36 1j21 h TRP 19 Ca 0.08 0.03 -0.04 0.00 2.11 0.00 0.00 58.89 61.07 1j21 h TRP 19 Cb 0.17 -0.05 -0.03 0.00 -2.10 0.00 0.00 29.16 27.15 1j21 h TRP 19 CO -0.01 0.06 0.31 -0.07 -2.79 0.00 0.00 178.44 175.94 1j21 h LEU 20 N 0.33 1.03 0.15 0.65 3.38 -0.93 0.14 115.31 120.06 1j21 h LEU 20 Ca 0.26 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 1j21 h LEU 20 Cb 0.32 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.80 1j21 h LEU 20 CO -0.29 0.90 -0.07 0.11 0.09 0.00 0.00 178.44 179.18 1j21 h LYS 21 N 1.10 -0.19 -0.13 1.13 1.79 -1.13 -0.89 116.57 118.25 1j21 h LYS 21 Ca 0.26 0.01 -0.09 0.00 -2.18 0.00 0.00 60.65 58.65 1j21 h LYS 21 Cb 0.19 0.04 0.00 0.00 -1.58 0.00 0.00 32.23 30.88 1j21 h LYS 21 CO -0.02 -0.05 -0.28 1.49 -1.08 0.00 0.00 179.45 179.51 1j21 h GLU 22 N -0.30 0.42 -0.24 3.15 4.81 -1.35 0.49 114.58 121.56 1j21 h GLU 22 Ca -0.02 -0.28 -0.09 0.00 -0.13 0.00 0.00 59.36 58.84 1j21 h GLU 22 Cb 0.23 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.64 1j21 h GLU 22 CO 0.03 0.89 -0.24 1.15 -0.73 0.00 0.00 179.01 180.11 1j21 h THR 23 N 0.01 1.26 -0.01 0.32 2.02 -0.76 -3.22 112.91 112.53 1j21 h THR 23 Ca 0.00 -1.23 0.00 0.00 0.77 0.00 0.00 66.41 65.95 1j21 h THR 23 Cb 0.88 1.34 0.00 0.00 -1.74 0.00 0.00 68.15 68.64 1j21 h THR 23 CO 0.06 0.39 -0.09 -1.22 0.37 0.00 0.00 175.52 175.03 1j21 n TYR 24 N -4.13 0.00 -4.07 3.16 4.02 -0.34 -4.97 117.16 110.83 1j21 n TYR 24 Ca -0.00 0.00 -0.30 0.00 -0.01 0.00 0.00 57.90 57.58 1j21 n TYR 24 Cb 0.39 0.00 -0.02 0.00 -0.02 0.00 0.00 39.34 39.69 1j21 n TYR 24 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1j21 n ARG 25 N -0.03 -3.35 -4.32 -0.72 1.74 0.17 -4.91 116.66 105.24 1j21 n ARG 25 Ca 0.03 0.40 -0.25 0.00 -0.77 0.00 0.00 57.85 57.26 1j21 n ARG 25 Cb 0.16 -4.81 -0.09 0.00 -1.02 0.00 0.00 32.46 26.71 1j21 n ARG 25 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1j21 s ALA 26 N -3.65 3.00 -0.11 7.54 0.00 -1.14 -4.69 121.76 122.70 1j21 s ALA 26 Ca 0.36 -1.62 -0.26 0.00 0.00 0.00 0.00 51.96 50.44 1j21 s ALA 26 Cb -0.19 -0.67 -0.02 0.00 0.00 0.00 0.00 23.12 22.24 1j21 s ALA 26 CO 0.90 0.35 0.84 -2.00 0.00 0.00 0.00 175.76 175.86 1j21 s GLU 27 N -3.30 4.38 -0.24 0.00 2.12 0.12 -4.47 118.70 117.32 1j21 s GLU 27 Ca 0.28 1.09 -0.07 0.00 0.36 0.00 0.00 54.97 56.63 1j21 s GLU 27 Cb -0.07 -3.52 -0.03 0.00 0.26 0.00 0.00 34.13 30.76 1j21 s GLU 27 CO 0.17 -0.19 0.07 0.08 -0.54 0.00 0.00 175.26 174.85 1j21 s VAL 28 N 1.65 4.39 -0.38 3.70 1.01 -1.26 -1.06 120.40 128.45 1j21 s VAL 28 Ca 0.41 -0.15 -0.13 0.00 0.00 0.00 0.00 61.98 62.11 1j21 s VAL 28 Cb -0.18 -3.04 0.01 0.00 0.00 0.00 0.00 36.38 33.17 1j21 s VAL 28 CO 0.17 0.35 0.26 -0.63 0.00 0.00 0.00 175.10 175.25 1j21 s ILE 29 N 1.43 5.09 0.21 2.22 1.01 -0.22 -0.52 121.20 130.42 1j21 s ILE 29 Ca 0.06 -0.58 -0.26 0.00 0.00 0.00 0.00 60.65 59.87 1j21 s ILE 29 Cb -0.15 -3.77 -0.08 0.00 0.01 0.00 0.00 42.46 38.47 1j21 s ILE 29 CO 0.04 -0.20 0.83 0.00 0.00 0.00 0.00 174.94 175.61 1j21 s ALA 30 N 1.66 3.39 -0.07 9.38 0.00 0.18 -1.09 121.76 135.21 1j21 s ALA 30 Ca 0.05 0.43 0.01 0.00 0.00 0.00 0.00 51.96 52.44 1j21 s ALA 30 Cb -0.19 -3.03 0.02 0.00 0.00 0.00 0.00 23.12 19.92 1j21 s ALA 30 CO 0.09 0.26 -0.08 0.12 0.00 0.00 0.00 175.76 176.15 1j21 s PHE 31 N -1.25 1.24 -0.07 0.00 5.36 -0.15 -0.05 117.98 123.06 1j21 s PHE 31 Ca 0.40 -0.49 0.03 0.00 -0.96 0.00 0.00 56.93 55.90 1j21 s PHE 31 Cb -0.23 -1.00 0.01 0.00 -0.34 0.00 0.00 43.02 41.46 1j21 s PHE 31 CO 0.27 -0.33 -0.15 0.99 -1.46 0.00 0.00 175.22 174.55 1j21 s THR 32 N 1.10 1.32 -0.00 0.12 2.01 0.03 0.09 115.64 120.31 1j21 s THR 32 Ca -0.07 -0.59 0.03 0.00 0.31 0.00 0.00 61.69 61.37 1j21 s THR 32 Cb -0.14 -1.18 -0.03 0.00 0.01 0.00 0.00 72.50 71.15 1j21 s THR 32 CO -0.01 0.40 -0.08 0.00 -0.69 0.00 0.00 174.62 174.23 1j21 s ALA 33 N 0.57 2.95 -0.46 7.40 0.00 -1.26 -2.16 121.76 128.80 1j21 s ALA 33 Ca -0.15 -1.03 -0.16 0.00 0.00 0.00 0.00 51.96 50.63 1j21 s ALA 33 Cb -0.16 -1.09 0.06 0.00 0.00 0.00 0.00 23.12 21.93 1j21 s ALA 33 CO 0.05 0.60 0.39 0.34 0.00 0.00 0.00 175.76 177.14 1j21 s ASP 34 N -1.34 6.14 -0.15 0.00 -1.08 0.38 -4.86 116.67 115.76 1j21 s ASP 34 Ca 0.16 -1.20 0.16 0.00 -0.52 0.00 0.00 52.55 51.16 1j21 s ASP 34 Cb -0.11 -2.18 0.32 0.00 -1.46 0.00 0.00 42.92 39.49 1j21 s ASP 34 CO 0.06 -0.61 1.17 2.30 0.52 0.00 0.00 175.17 178.61 1j21 n ILE 35 N 5.22 1.91 -0.56 4.11 -5.35 -1.26 -0.88 119.36 122.55 1j21 n ILE 35 Ca -0.12 -2.47 0.00 0.00 -0.27 0.00 0.00 62.75 59.89 1j21 n ILE 35 Cb 0.45 -0.21 0.00 0.00 -1.74 0.00 0.00 39.64 38.14 1j21 n ILE 35 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1j21 n GLY 36 N -1.29 0.99 0.21 3.28 0.00 -1.26 -0.52 105.19 106.60 1j21 n GLY 36 Ca 0.16 -0.40 0.15 0.00 0.00 0.00 0.00 46.02 45.93 1j21 n GLY 36 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1j21 h GLN 37 N 0.00 0.00 0.00 1.61 7.50 -1.86 -3.20 115.11 119.16 1j21 h GLN 37 Ca 0.00 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.15 1j21 h GLN 37 Cb 0.16 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.69 1j21 h GLN 37 CO 0.00 0.00 0.00 0.41 -1.50 0.00 0.00 178.83 177.74 1j21 n GLY 38 N -0.07 0.57 3.51 3.46 0.00 -1.26 -4.80 105.19 106.59 1j21 n GLY 38 Ca 0.01 -0.82 -0.24 0.00 0.00 0.00 0.00 46.02 44.97 1j21 n GLY 38 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1j21 s GLU 39 N -2.02 1.78 -0.67 1.61 2.02 -1.26 -5.07 118.70 115.09 1j21 s GLU 39 Ca 0.00 -1.76 -0.24 0.00 0.02 0.00 0.00 54.97 52.99 1j21 s GLU 39 Cb 0.00 -1.81 0.06 0.00 0.10 0.00 0.00 34.13 32.48 1j21 s GLU 39 CO 0.00 0.30 1.05 -2.00 0.02 0.00 0.00 175.26 174.63 1j21 s GLU 40 N -3.55 3.16 0.42 1.61 2.56 -1.26 -4.87 118.70 116.78 1j21 s GLU 40 Ca 0.31 -0.59 0.15 0.00 0.00 0.00 0.00 54.97 54.84 1j21 s GLU 40 Cb -0.04 -4.19 1.03 0.00 2.00 0.00 0.00 34.13 32.93 1j21 s GLU 40 CO 0.16 -1.86 1.94 0.28 -0.56 0.00 0.00 175.26 175.21 1j21 h VAL 41 N 6.00 0.83 -0.14 3.70 2.07 -1.97 -0.26 116.25 126.48 1j21 h VAL 41 Ca -0.28 -0.15 -0.00 0.00 0.82 0.00 0.00 66.70 67.09 1j21 h VAL 41 Cb 1.07 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 31.19 1j21 h VAL 41 CO 1.20 0.08 0.07 -0.33 0.02 0.00 0.00 177.57 178.60 1j21 h GLU 42 N 0.43 0.18 0.00 1.57 4.39 -1.97 0.12 114.58 119.30 1j21 h GLU 42 Ca 0.35 -0.01 -0.06 0.00 0.34 0.00 0.00 59.36 59.97 1j21 h GLU 42 Cb 0.75 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.35 1j21 h GLU 42 CO -0.11 0.14 -0.30 0.93 -1.16 0.00 0.00 179.01 178.52 1j21 h GLU 43 N 0.19 0.00 0.04 2.33 5.08 -1.45 -1.97 114.58 118.80 1j21 h GLU 43 Ca 0.05 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.24 1j21 h GLU 43 Cb 0.02 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.28 1j21 h GLU 43 CO -0.01 0.30 -0.68 0.00 -1.00 0.00 0.00 179.01 177.62 1j21 h ALA 44 N 1.70 0.03 -0.44 3.43 0.00 -0.96 -2.40 119.26 120.62 1j21 h ALA 44 Ca -0.00 -0.61 0.02 0.00 0.00 0.00 0.00 54.91 54.31 1j21 h ALA 44 Cb 0.92 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.74 1j21 h ALA 44 CO 0.04 0.37 0.29 -0.09 0.00 0.00 0.00 179.25 179.86 1j21 h ARG 45 N -0.16 0.53 0.12 0.00 2.43 -0.90 -0.52 114.38 115.87 1j21 h ARG 45 Ca -0.10 -0.03 -0.28 0.00 -0.81 0.00 0.00 59.98 58.76 1j21 h ARG 45 Cb 1.43 -0.12 0.03 0.00 -0.42 0.00 0.00 29.97 30.88 1j21 h ARG 45 CO 0.13 0.35 -1.18 0.93 -1.51 0.00 0.00 179.97 178.70 1j21 h GLU 46 N 0.54 0.59 -0.58 0.20 5.08 -1.39 -3.09 114.58 115.93 1j21 h GLU 46 Ca 0.17 -0.79 -0.01 0.00 -1.00 0.00 0.00 59.36 57.73 1j21 h GLU 46 Cb 0.01 0.26 -0.03 0.00 0.50 0.00 0.00 28.75 29.50 1j21 h GLU 46 CO -0.04 1.36 0.34 -0.22 -1.00 0.00 0.00 179.01 179.44 1j21 h LYS 47 N 0.20 0.79 -0.74 2.33 3.64 -0.93 -0.78 116.57 121.08 1j21 h LYS 47 Ca -0.18 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 59.12 1j21 h LYS 47 Cb 1.86 -0.17 -0.04 0.00 -0.41 0.00 0.00 32.23 33.48 1j21 h LYS 47 CO 0.23 0.56 0.44 0.00 -2.27 0.00 0.00 179.45 178.41 1j21 h ALA 48 N 1.57 0.94 -0.55 5.00 0.00 -1.11 0.56 119.26 125.67 1j21 h ALA 48 Ca 0.21 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 1j21 h ALA 48 Cb -0.01 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.46 1j21 h ALA 48 CO -0.04 0.42 0.06 -0.07 0.00 0.00 0.00 179.25 179.62 1j21 h LEU 49 N 1.01 0.90 -0.99 0.00 3.38 -1.24 0.09 115.31 118.45 1j21 h LEU 49 Ca 0.26 -0.28 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 1j21 h LEU 49 Cb -0.02 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.46 1j21 h LEU 49 CO -0.05 0.95 0.25 0.03 0.09 0.00 0.00 178.44 179.70 1j21 h ARG 50 N 0.81 0.97 0.00 1.13 3.08 -0.39 -2.36 114.38 117.63 1j21 h ARG 50 Ca 0.16 -0.17 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1j21 h ARG 50 Cb 0.45 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.34 1j21 h ARG 50 CO 0.02 0.80 0.00 1.15 -1.07 0.00 0.00 179.97 180.87 1j21 h THR 51 N 0.95 0.00 0.00 2.04 2.02 0.50 -3.47 112.91 114.95 1j21 h THR 51 Ca 0.22 -0.45 0.00 0.00 0.77 0.00 0.00 66.41 66.95 1j21 h THR 51 Cb 0.21 1.35 0.00 0.00 -1.74 0.00 0.00 68.15 67.97 1j21 h THR 51 CO -0.02 0.00 0.00 0.61 0.37 0.00 0.00 175.52 176.48 1j21 n GLY 52 N 0.52 0.33 3.76 2.16 0.00 -0.53 -4.72 105.19 106.71 1j21 n GLY 52 Ca 0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.67 1j21 n GLY 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j21 s ALA 53 N -1.31 2.99 -0.85 4.61 0.00 -0.09 -4.76 121.76 122.34 1j21 s ALA 53 Ca 0.00 1.27 0.27 0.00 0.00 0.00 0.00 51.96 53.50 1j21 s ALA 53 Cb 0.00 -3.52 0.93 0.00 0.00 0.00 0.00 23.12 20.52 1j21 s ALA 53 CO 0.00 -1.12 1.78 -1.13 0.00 0.00 0.00 175.76 175.29 1j21 n SER 54 N -0.60 0.45 -3.60 0.00 3.41 0.32 -4.67 113.62 108.93 1j21 n SER 54 Ca 0.08 0.46 -0.10 0.00 -0.26 0.00 0.00 58.87 59.05 1j21 n SER 54 Cb 0.45 -0.53 -0.06 0.00 -0.26 0.00 0.00 64.21 63.81 1j21 n SER 54 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1j21 s LYS 55 N -3.06 0.55 -0.05 4.33 2.20 -1.24 -5.01 119.74 117.46 1j21 s LYS 55 Ca 0.12 0.32 0.02 0.00 -0.36 0.00 0.00 55.97 56.06 1j21 s LYS 55 Cb 0.15 0.26 0.02 0.00 -1.51 0.00 0.00 37.83 36.75 1j21 s LYS 55 CO 0.59 -0.13 -0.08 0.00 -0.36 0.00 0.00 175.35 175.37 1j21 s ALA 56 N -0.56 0.88 0.00 3.13 0.00 -1.26 -0.64 121.76 123.31 1j21 s ALA 56 Ca 0.00 -0.20 0.08 0.00 0.00 0.00 0.00 51.96 51.85 1j21 s ALA 56 Cb -0.02 -0.45 -0.02 0.00 0.00 0.00 0.00 23.12 22.62 1j21 s ALA 56 CO -0.02 0.05 -0.26 0.42 0.00 0.00 0.00 175.76 175.96 1j21 s ILE 57 N 0.74 2.12 -0.05 0.00 1.01 0.92 -4.96 121.20 120.98 1j21 s ILE 57 Ca -0.12 -1.21 -0.02 0.00 0.00 0.00 0.00 60.65 59.30 1j21 s ILE 57 Cb -0.14 -1.77 0.04 0.00 0.01 0.00 0.00 42.46 40.60 1j21 s ILE 57 CO 0.01 0.50 0.10 0.00 0.00 0.00 0.00 174.94 175.55 1j21 s ALA 58 N -0.69 -0.04 0.04 9.38 0.00 -1.26 -0.79 121.76 128.40 1j21 s ALA 58 Ca 0.11 0.45 0.05 0.00 0.00 0.00 0.00 51.96 52.56 1j21 s ALA 58 Cb -0.10 -0.50 -0.02 0.00 0.00 0.00 0.00 23.12 22.50 1j21 s ALA 58 CO 0.00 -0.29 -0.14 -0.51 0.00 0.00 0.00 175.76 174.82 1j21 s LEU 59 N 1.58 2.17 -0.52 0.00 1.43 -0.92 -5.00 118.68 117.42 1j21 s LEU 59 Ca -0.04 -0.46 -0.23 0.00 -1.03 0.00 0.00 54.13 52.37 1j21 s LEU 59 Cb -0.12 -0.60 0.04 0.00 0.03 0.00 0.00 46.19 45.54 1j21 s LEU 59 CO -0.04 0.03 0.85 -0.62 0.23 0.00 0.00 176.35 176.80 1j21 s ASP 60 N -1.15 6.34 -0.19 2.29 -1.08 -1.26 -0.47 116.67 121.14 1j21 s ASP 60 Ca 0.01 -0.37 0.15 0.00 -0.52 0.00 0.00 52.55 51.83 1j21 s ASP 60 Cb -0.08 -2.40 0.46 0.00 -1.46 0.00 0.00 42.92 39.44 1j21 s ASP 60 CO 0.01 -1.09 1.36 0.18 0.52 0.00 0.00 175.17 176.15 1j21 n LEU 61 N 7.06 3.52 -0.19 -1.34 4.77 -0.06 -4.74 117.00 126.02 1j21 n LEU 61 Ca 0.01 -3.24 -0.08 0.00 -0.03 0.00 0.00 56.01 52.66 1j21 n LEU 61 Cb 0.47 -0.54 0.01 0.00 -2.33 0.00 0.00 43.42 41.04 1j21 n LEU 61 CO 0.61 0.84 0.91 0.11 -1.33 0.00 0.00 177.39 178.54 1j21 h LYS 62 N 1.16 0.83 -0.11 3.23 1.57 -1.82 -0.54 116.57 120.89 1j21 h LYS 62 Ca 0.05 -0.19 -0.02 0.00 -1.87 0.00 0.00 60.65 58.62 1j21 h LYS 62 Cb 1.37 -0.12 -0.00 0.00 0.08 0.00 0.00 32.23 33.56 1j21 h LYS 62 CO 0.20 0.78 -0.03 0.93 -0.57 0.00 0.00 179.45 180.76 1j21 h GLU 63 N 0.74 0.21 -0.83 3.15 4.39 -1.91 -2.08 114.58 118.23 1j21 h GLU 63 Ca 0.17 -0.08 -0.02 0.00 0.34 0.00 0.00 59.36 59.77 1j21 h GLU 63 Cb 0.30 -0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 28.90 1j21 h GLU 63 CO -0.00 0.52 0.45 1.49 -1.16 0.00 0.00 179.01 180.31 1j21 h GLU 64 N -0.12 1.16 0.40 2.33 4.81 -1.89 -0.61 114.58 120.67 1j21 h GLU 64 Ca 0.03 -0.13 -0.01 0.00 -0.13 0.00 0.00 59.36 59.12 1j21 h GLU 64 Cb 0.44 -0.23 -0.02 0.00 0.63 0.00 0.00 28.75 29.57 1j21 h GLU 64 CO 0.01 0.85 -0.34 0.35 -0.73 0.00 0.00 179.01 179.15 1j21 h PHE 65 N 1.17 -0.92 -0.25 0.92 3.57 -0.97 0.19 116.94 120.65 1j21 h PHE 65 Ca 0.29 0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.72 1j21 h PHE 65 Cb 0.03 0.35 -0.01 0.00 2.79 0.00 0.00 35.95 39.11 1j21 h PHE 65 CO 0.01 -0.49 -0.13 0.28 -2.23 0.00 0.00 178.31 175.75 1j21 h VAL 66 N -0.75 1.30 -0.17 1.41 2.07 -1.26 -1.44 116.25 117.42 1j21 h VAL 66 Ca -0.03 -1.21 -0.05 0.00 0.82 0.00 0.00 66.70 66.22 1j21 h VAL 66 Cb 0.65 1.57 -0.00 0.00 -1.52 0.00 0.00 31.29 31.99 1j21 h VAL 66 CO -0.03 0.38 -0.09 -0.09 0.02 0.00 0.00 177.57 177.76 1j21 h ARG 67 N 0.24 0.36 -0.02 1.57 2.43 -1.11 0.28 114.38 118.14 1j21 h ARG 67 Ca 0.05 -0.16 0.00 0.00 -0.81 0.00 0.00 59.98 59.06 1j21 h ARG 67 Cb 0.63 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.18 1j21 h ARG 67 CO 0.04 0.68 -0.36 -0.25 -1.51 0.00 0.00 179.97 178.57 1j21 n ASP 68 N -4.60 1.87 0.06 -3.80 9.92 0.66 -4.41 116.55 116.24 1j21 n ASP 68 Ca -0.05 -1.42 0.00 0.00 -0.53 0.00 0.00 54.79 52.79 1j21 n ASP 68 Cb 0.32 0.33 0.00 0.00 -0.64 0.00 0.00 41.12 41.13 1j21 n ASP 68 CO 0.00 0.00 0.00 0.49 0.13 0.00 0.00 177.20 177.82 1j21 n PHE 69 N -0.03 -0.82 -0.04 1.24 3.01 -0.76 -4.75 117.46 115.30 1j21 n PHE 69 Ca 0.11 0.15 -0.12 0.00 1.01 0.00 0.00 57.45 58.60 1j21 n PHE 69 Cb 0.45 0.31 -0.06 0.00 -0.01 0.00 0.00 39.48 40.17 1j21 n PHE 69 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 1j21 h VAL 70 N 0.00 1.24 -0.23 -4.37 2.07 -1.23 -2.75 116.25 110.98 1j21 h VAL 70 Ca 0.00 -0.78 0.00 0.00 0.82 0.00 0.00 66.70 66.74 1j21 h VAL 70 Cb 0.20 1.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.44 1j21 h VAL 70 CO 0.00 0.23 0.15 -0.26 0.02 0.00 0.00 177.57 177.71 1j21 h PHE 71 N -0.00 0.30 -0.45 1.57 -1.00 -0.64 -0.51 116.94 116.21 1j21 h PHE 71 Ca 0.04 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 60.81 1j21 h PHE 71 Cb 0.34 -0.10 -0.02 0.00 3.61 0.00 0.00 35.95 39.78 1j21 h PHE 71 CO 0.03 0.21 0.20 -1.35 -1.61 0.00 0.00 178.31 175.78 1j21 h PRO 72 N 0.30 0.63 -0.33 1.51 0.11 -1.77 -1.12 132.00 131.33 1j21 h PRO 72 Ca 0.08 -0.08 -0.17 0.00 0.11 0.00 0.00 66.00 65.95 1j21 h PRO 72 Cb -0.01 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 30.97 1j21 h PRO 72 CO -0.02 0.51 -0.44 1.98 -0.21 0.00 0.00 178.00 179.82 1j21 h MET 73 N 0.63 0.86 -0.27 1.05 1.85 -1.17 -3.13 114.93 114.76 1j21 h MET 73 Ca 0.16 -0.48 -0.12 0.00 -0.61 0.00 0.00 59.70 58.64 1j21 h MET 73 Cb 0.10 0.03 -0.01 0.00 0.43 0.00 0.00 31.60 32.15 1j21 h MET 73 CO -0.02 1.13 -0.35 0.52 -0.40 0.00 0.00 176.91 177.79 1j21 h MET 74 N 0.69 0.60 -0.48 0.39 2.86 -0.64 -2.49 114.93 115.87 1j21 h MET 74 Ca 0.04 -0.28 0.12 0.00 -2.06 0.00 0.00 59.70 57.52 1j21 h MET 74 Cb 1.03 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.66 1j21 h MET 74 CO 0.10 0.86 0.34 0.00 1.06 0.00 0.00 176.91 179.27 1j21 h ARG 75 N 0.51 0.12 -0.00 1.72 3.08 -1.16 0.12 114.38 118.76 1j21 h ARG 75 Ca 0.05 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.10 1j21 h ARG 75 Cb 0.84 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.86 1j21 h ARG 75 CO 0.07 0.08 -0.03 0.00 -1.07 0.00 0.00 179.97 179.02 1j21 n ALA 76 N -2.59 2.46 -2.34 0.04 0.00 -0.94 -4.79 120.51 112.35 1j21 n ALA 76 Ca 0.08 -0.13 -0.15 0.00 0.00 0.00 0.00 53.44 53.24 1j21 n ALA 76 Cb 0.47 -1.45 -0.00 0.00 0.00 0.00 0.00 19.45 18.47 1j21 n ALA 76 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1j21 n GLY 77 N 1.43 -0.24 3.66 0.00 0.00 0.43 -4.57 105.19 105.91 1j21 n GLY 77 Ca 0.09 -0.25 -0.42 0.00 0.00 0.00 0.00 46.02 45.44 1j21 n GLY 77 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j21 s ALA 78 N -2.77 3.62 -0.05 4.61 0.00 -1.20 -4.86 121.76 121.11 1j21 s ALA 78 Ca 0.02 1.09 -0.02 0.00 0.00 0.00 0.00 51.96 53.05 1j21 s ALA 78 Cb -0.01 -3.77 0.03 0.00 0.00 0.00 0.00 23.12 19.38 1j21 s ALA 78 CO 0.03 -1.40 0.09 0.08 0.00 0.00 0.00 175.76 174.56 1j21 s VAL 79 N 3.94 -0.15 -0.05 0.00 1.01 -1.26 -4.79 120.40 119.10 1j21 s VAL 79 Ca 0.78 0.41 -0.24 0.00 0.00 0.00 0.00 61.98 62.93 1j21 s VAL 79 Cb -0.37 -0.19 -0.04 0.00 0.00 0.00 0.00 36.38 35.78 1j21 s VAL 79 CO 0.33 0.17 0.72 -0.47 0.00 0.00 0.00 175.10 175.85 1j21 s TYR 80 N 2.20 3.60 -1.55 5.22 5.04 0.15 -4.24 117.35 127.77 1j21 s TYR 80 Ca 0.04 1.29 -0.03 0.00 -2.44 0.00 0.00 57.07 55.94 1j21 s TYR 80 Cb -0.12 -2.81 0.03 0.00 0.35 0.00 0.00 41.96 39.41 1j21 s TYR 80 CO -0.04 0.12 0.19 0.39 -1.34 0.00 0.00 175.55 174.87 1j21 n GLU 81 N 3.62 -1.60 0.00 4.97 1.02 -1.26 -1.55 120.64 125.84 1j21 n GLU 81 Ca -0.01 0.18 0.00 0.00 -0.02 0.00 0.00 57.16 57.31 1j21 n GLU 81 Cb 0.51 -3.98 0.00 0.00 -0.02 0.00 0.00 31.44 27.95 1j21 n GLU 81 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1j21 n GLY 82 N -2.25 2.34 0.00 0.62 0.00 -1.26 -4.62 105.19 100.02 1j21 n GLY 82 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.75 1j21 n GLY 82 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1j21 n TYR 83 N -1.85 0.00 -1.99 1.61 4.02 -0.91 -5.07 117.16 112.97 1j21 n TYR 83 Ca 0.00 0.00 -0.43 0.00 -0.01 0.00 0.00 57.90 57.46 1j21 n TYR 83 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.29 1j21 n TYR 83 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 176.86 175.38 1j21 s TYR 84 N -1.00 1.86 -2.00 -0.72 5.04 -0.60 -4.82 117.35 115.11 1j21 s TYR 84 Ca 0.00 0.45 0.03 0.00 -2.44 0.00 0.00 57.07 55.11 1j21 s TYR 84 Cb 0.00 -4.03 0.12 0.00 0.35 0.00 0.00 41.96 38.40 1j21 s TYR 84 CO 0.00 -3.36 1.08 1.28 -1.34 0.00 0.00 175.55 173.21 1j21 n LEU 85 N 9.02 0.24 -2.96 6.97 4.77 -1.26 -0.68 117.00 133.09 1j21 n LEU 85 Ca 0.21 -0.12 -0.22 0.00 -0.03 0.00 0.00 56.01 55.85 1j21 n LEU 85 Cb 0.45 -0.03 0.04 0.00 -2.33 0.00 0.00 43.42 41.55 1j21 n LEU 85 CO 0.66 0.06 0.00 0.18 -1.33 0.00 0.00 177.39 176.96 1j21 n LEU 86 N -0.39 -2.69 -0.18 2.23 4.77 -1.26 -4.94 117.00 114.54 1j21 n LEU 86 Ca 0.02 -0.29 -0.01 0.00 -0.03 0.00 0.00 56.01 55.71 1j21 n LEU 86 Cb 0.04 -2.94 0.08 0.00 -2.33 0.00 0.00 43.42 38.27 1j21 n LEU 86 CO 0.02 0.24 0.88 1.23 -1.33 0.00 0.00 177.39 178.42 1j21 h GLY 87 N -1.39 0.63 1.40 -0.72 0.00 -1.93 -2.70 103.07 98.35 1j21 h GLY 87 Ca -0.52 0.02 -0.29 0.00 0.00 0.00 0.00 47.33 46.54 1j21 h GLY 87 CO 0.56 -0.13 -1.26 -0.84 0.00 0.00 0.00 176.54 174.87 1j21 h THR 88 N 0.18 1.36 -0.25 4.70 2.02 -1.94 -3.35 112.91 115.63 1j21 h THR 88 Ca 0.28 -2.69 0.06 0.00 0.77 0.00 0.00 66.41 64.83 1j21 h THR 88 Cb 0.42 2.81 -0.07 0.00 -1.74 0.00 0.00 68.15 69.57 1j21 h THR 88 CO -0.41 0.80 -0.23 0.28 0.37 0.00 0.00 175.52 176.33 1j21 h SER 89 N 0.18 -0.75 0.82 4.18 0.02 -1.84 -2.34 113.55 113.83 1j21 h SER 89 Ca -0.17 0.14 0.00 0.00 -0.84 0.00 0.00 61.79 60.91 1j21 h SER 89 Cb 1.95 0.36 0.00 0.00 0.14 0.00 0.00 62.40 64.85 1j21 h SER 89 CO 0.23 -0.27 0.00 2.30 -1.14 0.00 0.00 176.83 177.95 1j21 n ILE 90 N -5.37 0.49 0.11 3.27 -6.64 -1.06 -3.45 119.36 106.71 1j21 n ILE 90 Ca -0.01 0.09 -0.21 0.00 -1.77 0.00 0.00 62.75 60.86 1j21 n ILE 90 Cb 0.29 -0.75 -0.15 0.00 -1.44 0.00 0.00 39.64 37.59 1j21 n ILE 90 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 1j21 h ALA 91 N 2.72 0.03 -0.78 -1.28 0.00 -1.55 -3.38 119.26 115.01 1j21 h ALA 91 Ca 0.00 -0.95 0.09 0.00 0.00 0.00 0.00 54.91 54.05 1j21 h ALA 91 Cb 0.41 0.19 -0.07 0.00 0.00 0.00 0.00 17.79 18.32 1j21 h ALA 91 CO 0.00 0.89 0.43 0.00 0.00 0.00 0.00 179.25 180.58 1j21 h ARG 92 N 0.11 0.71 -0.67 0.00 2.47 -1.55 -2.45 114.38 113.01 1j21 h ARG 92 Ca -0.24 -0.04 0.03 0.00 -1.26 0.00 0.00 59.98 58.47 1j21 h ARG 92 Cb 2.08 -0.16 -0.04 0.00 -1.65 0.00 0.00 29.97 30.21 1j21 h ARG 92 CO 0.22 0.47 0.44 -1.35 0.56 0.00 0.00 179.97 180.32 1j21 h PRO 93 N 0.73 0.80 -0.43 0.04 0.11 -1.75 -2.21 132.00 129.30 1j21 h PRO 93 Ca 0.38 -0.05 -0.07 0.00 0.11 0.00 0.00 66.00 66.37 1j21 h PRO 93 Cb 0.35 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 31.26 1j21 h PRO 93 CO -0.25 0.53 0.00 1.25 -0.21 0.00 0.00 178.00 179.32 1j21 h LEU 94 N 0.82 0.74 0.42 2.35 7.12 -1.64 0.22 115.31 125.33 1j21 h LEU 94 Ca 0.26 -0.31 -0.02 0.00 0.13 0.00 0.00 57.88 57.94 1j21 h LEU 94 Cb 0.03 -0.20 0.00 0.00 -0.53 0.00 0.00 40.66 39.96 1j21 h LEU 94 CO -0.07 0.86 -0.20 0.40 -0.13 0.00 0.00 178.44 179.30 1j21 h ILE 95 N 0.59 0.59 -0.93 4.05 1.08 -1.31 -2.56 117.51 119.03 1j21 h ILE 95 Ca 0.12 -0.09 0.06 0.00 -0.39 0.00 0.00 64.86 64.56 1j21 h ILE 95 Cb 0.48 0.64 -0.06 0.00 -3.07 0.00 0.00 36.82 34.81 1j21 h ILE 95 CO 0.02 0.02 0.60 0.00 -0.69 0.00 0.00 178.15 178.10 1j21 h ALA 96 N -0.04 1.48 -0.68 1.87 0.00 -1.38 -1.03 119.26 119.48 1j21 h ALA 96 Ca -0.06 -0.03 0.09 0.00 0.00 0.00 0.00 54.91 54.91 1j21 h ALA 96 Cb 0.46 -0.28 -0.07 0.00 0.00 0.00 0.00 17.79 17.90 1j21 h ALA 96 CO 0.09 0.38 0.33 -0.22 0.00 0.00 0.00 179.25 179.84 1j21 h LYS 97 N 1.07 0.56 -0.04 0.00 3.64 -0.72 -1.83 116.57 119.25 1j21 h LYS 97 Ca 0.40 -0.03 -0.15 0.00 -1.27 0.00 0.00 60.65 59.59 1j21 h LYS 97 Cb 0.18 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.86 1j21 h LYS 97 CO -0.15 0.37 -0.65 0.45 -2.27 0.00 0.00 179.45 177.20 1j21 h HIS 98 N 0.57 0.23 -0.24 1.91 3.86 -0.82 -2.67 115.15 118.00 1j21 h HIS 98 Ca 0.33 -0.10 -0.00 0.00 -1.16 0.00 0.00 60.37 59.44 1j21 h HIS 98 Cb 0.34 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 28.76 1j21 h HIS 98 CO -0.11 0.77 0.14 -0.07 0.86 0.00 0.00 177.93 179.52 1j21 h LEU 99 N 0.13 0.29 -0.83 2.43 3.38 -0.49 0.55 115.31 120.76 1j21 h LEU 99 Ca -0.01 -0.06 -0.05 0.00 0.09 0.00 0.00 57.88 57.85 1j21 h LEU 99 Cb 1.17 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.81 1j21 h LEU 99 CO 0.10 0.26 0.24 0.58 0.09 0.00 0.00 178.44 179.71 1j21 h VAL 100 N 0.29 1.26 0.01 1.22 2.07 -1.39 0.12 116.25 119.83 1j21 h VAL 100 Ca 0.09 -0.87 -0.00 0.00 0.82 0.00 0.00 66.70 66.74 1j21 h VAL 100 Cb 0.03 0.43 0.00 0.00 -1.52 0.00 0.00 31.29 30.23 1j21 h VAL 100 CO -0.02 0.34 -0.00 -0.09 0.02 0.00 0.00 177.57 177.82 1j21 h ARG 101 N 1.08 -0.01 -0.63 1.57 2.43 -1.16 -0.96 114.38 116.69 1j21 h ARG 101 Ca 0.24 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.41 1j21 h ARG 101 Cb 0.28 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.80 1j21 h ARG 101 CO -0.01 0.25 0.39 0.82 -1.51 0.00 0.00 179.97 179.91 1j21 h ILE 102 N -0.28 1.18 -0.87 1.20 2.04 -0.75 -0.97 117.51 119.05 1j21 h ILE 102 Ca -0.00 -0.39 0.09 0.00 1.00 0.00 0.00 64.86 65.56 1j21 h ILE 102 Cb 0.27 0.30 -0.06 0.00 -0.74 0.00 0.00 36.82 36.59 1j21 h ILE 102 CO 0.00 0.18 0.57 0.00 0.00 0.00 0.00 178.15 178.90 1j21 h ALA 103 N 1.20 1.62 -0.52 1.87 0.00 -0.61 0.35 119.26 123.18 1j21 h ALA 103 Ca 0.23 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.06 1j21 h ALA 103 Cb -0.04 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 1j21 h ALA 103 CO -0.04 0.21 0.07 0.93 0.00 0.00 0.00 179.25 180.42 1j21 h GLU 104 N 0.90 0.87 -0.15 0.00 5.08 0.08 0.62 114.58 121.97 1j21 h GLU 104 Ca 0.40 -0.24 -0.18 0.00 -1.00 0.00 0.00 59.36 58.34 1j21 h GLU 104 Cb 0.35 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.50 1j21 h GLU 104 CO -0.16 0.86 -0.63 0.93 -1.00 0.00 0.00 179.01 179.01 1j21 h GLU 105 N 0.75 0.54 -0.01 2.33 5.08 -0.20 -3.23 114.58 119.84 1j21 h GLU 105 Ca 0.16 -0.38 0.00 0.00 -1.00 0.00 0.00 59.36 58.14 1j21 h GLU 105 Cb 0.42 0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.73 1j21 h GLU 105 CO 0.01 1.00 -0.24 0.39 -1.00 0.00 0.00 179.01 179.17 1j21 n GLU 106 N -3.92 0.72 -2.64 2.33 -0.58 0.01 -4.94 120.64 111.63 1j21 n GLU 106 Ca -0.04 -0.39 -0.09 0.00 -0.42 0.00 0.00 57.16 56.22 1j21 n GLU 106 Cb 0.65 -1.49 0.02 0.00 -0.57 0.00 0.00 31.44 30.05 1j21 n GLU 106 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1j21 n GLY 107 N 1.34 0.22 3.79 0.62 0.00 -0.79 -5.01 105.19 105.36 1j21 n GLY 107 Ca 0.12 -0.39 -0.37 0.00 0.00 0.00 0.00 46.02 45.38 1j21 n GLY 107 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j21 s ALA 108 N -2.86 3.65 -0.54 4.61 0.00 0.14 -4.72 121.76 122.05 1j21 s ALA 108 Ca 0.15 -0.34 0.24 0.00 0.00 0.00 0.00 51.96 52.01 1j21 s ALA 108 Cb -0.06 -2.38 0.35 0.00 0.00 0.00 0.00 23.12 21.03 1j21 s ALA 108 CO 0.18 0.31 1.39 1.05 0.00 0.00 0.00 175.76 178.68 1j21 h GLU 109 N 5.65 0.00 -4.59 0.00 4.11 -1.85 -3.42 114.58 114.48 1j21 h GLU 109 Ca -0.47 0.00 -0.23 0.00 0.07 0.00 0.00 59.36 58.72 1j21 h GLU 109 Cb 1.20 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 30.30 1j21 h GLU 109 CO 0.68 0.00 -0.65 0.00 0.07 0.00 0.00 179.01 179.10 1j21 s ALA 110 N -3.20 1.10 0.11 1.06 0.00 -1.23 -1.91 121.76 117.69 1j21 s ALA 110 Ca 0.06 -1.55 0.03 0.00 0.00 0.00 0.00 51.96 50.50 1j21 s ALA 110 Cb 0.11 0.78 -0.04 0.00 0.00 0.00 0.00 23.12 23.96 1j21 s ALA 110 CO 0.71 -0.43 -0.08 0.96 0.00 0.00 0.00 175.76 176.92 1j21 s ILE 111 N -3.89 0.86 0.05 0.00 -4.36 -0.23 -1.42 121.20 112.22 1j21 s ILE 111 Ca 0.25 -1.94 -0.04 0.00 -0.26 0.00 0.00 60.65 58.66 1j21 s ILE 111 Cb 0.07 -1.70 -0.02 0.00 1.25 0.00 0.00 42.46 42.06 1j21 s ILE 111 CO 0.04 -0.81 0.07 0.00 0.24 0.00 0.00 174.94 174.47 1j21 s ALA 112 N -3.42 0.10 0.11 2.27 0.00 -0.04 -0.96 121.76 119.82 1j21 s ALA 112 Ca 0.13 -0.78 -0.10 0.00 0.00 0.00 0.00 51.96 51.20 1j21 s ALA 112 Cb 0.04 0.30 0.00 0.00 0.00 0.00 0.00 23.12 23.46 1j21 s ALA 112 CO -0.03 -0.36 0.25 -3.38 0.00 0.00 0.00 175.76 172.24 1j21 s HIS 113 N -3.22 0.11 -0.38 0.00 -3.43 -1.15 -1.22 115.29 106.00 1j21 s HIS 113 Ca 0.00 -0.51 0.06 0.00 -0.80 0.00 0.00 55.06 53.81 1j21 s HIS 113 Cb 0.03 0.01 0.64 0.00 -1.43 0.00 0.00 32.58 31.82 1j21 s HIS 113 CO -0.07 -0.61 1.78 0.41 -2.00 0.00 0.00 174.74 174.25 1j21 n GLY 114 N -0.12 4.46 3.76 -1.38 0.00 -1.26 -4.24 105.19 106.41 1j21 n GLY 114 Ca -0.14 -1.11 -0.39 0.00 0.00 0.00 0.00 46.02 44.38 1j21 n GLY 114 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j21 s ALA 115 N -3.23 3.30 0.96 4.61 0.00 -1.26 -4.97 121.76 121.17 1j21 s ALA 115 Ca 0.53 0.62 -0.12 0.00 0.00 0.00 0.00 51.96 52.99 1j21 s ALA 115 Cb 0.45 -3.22 0.17 0.00 0.00 0.00 0.00 23.12 20.52 1j21 s ALA 115 CO 0.09 0.14 1.10 0.95 0.00 0.00 0.00 175.76 178.04 1j21 s THR 116 N -1.33 2.18 -2.13 0.00 -4.23 -1.26 -4.65 115.64 104.22 1j21 s THR 116 Ca 0.45 0.06 0.16 0.00 -1.18 0.00 0.00 61.69 61.17 1j21 s THR 116 Cb -0.24 -2.60 0.38 0.00 1.34 0.00 0.00 72.50 71.38 1j21 s THR 116 CO 0.30 -0.08 1.40 0.61 -0.54 0.00 0.00 174.62 176.31 1j21 n GLY 117 N -1.31 0.44 0.00 3.99 0.00 -1.26 -3.86 105.19 103.19 1j21 n GLY 117 Ca 0.06 -0.39 0.06 0.00 0.00 0.00 0.00 46.02 45.74 1j21 n GLY 117 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1j21 n LYS 118 N 0.41 2.52 -1.94 1.61 2.85 -1.26 -5.06 118.16 117.29 1j21 n LYS 118 Ca 0.14 -0.03 -0.05 0.00 -1.05 0.00 0.00 58.31 57.33 1j21 n LYS 118 Cb 0.31 -1.10 -0.00 0.00 -0.65 0.00 0.00 35.03 33.58 1j21 n LYS 118 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1j21 n GLY 119 N 1.40 3.09 0.12 2.58 0.00 -1.25 -4.87 105.19 106.25 1j21 n GLY 119 Ca 0.01 -2.20 -0.14 0.00 0.00 0.00 0.00 46.02 43.70 1j21 n GLY 119 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1j21 h ASN 120 N 0.12 0.41 -0.97 1.61 2.35 -1.96 -3.38 115.58 113.76 1j21 h ASN 120 Ca -0.06 -0.40 0.10 0.00 -0.55 0.00 0.00 56.30 55.38 1j21 h ASN 120 Cb 0.22 -0.13 -0.07 0.00 0.05 0.00 0.00 38.32 38.38 1j21 h ASN 120 CO 0.10 1.27 0.62 0.44 -1.65 0.00 0.00 177.43 178.20 1j21 h ASP 121 N 0.11 0.93 -0.85 5.81 3.32 -1.94 -1.74 116.42 122.06 1j21 h ASP 121 Ca -0.10 0.03 0.07 0.00 0.02 0.00 0.00 57.03 57.05 1j21 h ASP 121 Cb 1.81 -0.16 -0.07 0.00 0.22 0.00 0.00 39.33 41.13 1j21 h ASP 121 CO 0.18 0.54 0.52 0.06 -1.72 0.00 0.00 179.24 178.82 1j21 h GLN 122 N 1.02 0.89 -0.23 3.56 3.07 -1.79 -0.01 115.11 121.62 1j21 h GLN 122 Ca 0.45 -0.05 -0.01 0.00 0.09 0.00 0.00 58.65 59.13 1j21 h GLN 122 Cb 0.36 -0.20 -0.01 0.00 0.08 0.00 0.00 27.48 27.71 1j21 h GLN 122 CO -0.21 0.59 0.11 0.28 0.09 0.00 0.00 178.83 179.68 1j21 h VAL 123 N 0.92 1.15 0.17 1.86 2.07 -1.56 -1.55 116.25 119.31 1j21 h VAL 123 Ca 0.39 -0.44 0.00 0.00 0.82 0.00 0.00 66.70 67.47 1j21 h VAL 123 Cb 0.25 1.01 -0.01 0.00 -1.52 0.00 0.00 31.29 31.02 1j21 h VAL 123 CO -0.20 0.15 -0.16 0.03 0.02 0.00 0.00 177.57 177.41 1j21 h ARG 124 N 0.23 -0.35 -0.36 1.57 3.08 -1.02 0.23 114.38 117.78 1j21 h ARG 124 Ca 0.08 0.02 0.06 0.00 0.07 0.00 0.00 59.98 60.21 1j21 h ARG 124 Cb 0.14 0.08 -0.05 0.00 0.08 0.00 0.00 29.97 30.21 1j21 h ARG 124 CO -0.01 -0.23 0.04 0.74 -1.07 0.00 0.00 179.97 179.44 1j21 h PHE 125 N -0.36 0.06 0.03 3.04 0.05 -0.96 -2.64 116.94 116.17 1j21 h PHE 125 Ca -0.00 0.02 -0.27 0.00 3.82 0.00 0.00 57.97 61.54 1j21 h PHE 125 Cb 0.34 0.03 0.02 0.00 2.00 0.00 0.00 35.95 38.34 1j21 h PHE 125 CO -0.13 -0.02 -1.10 0.93 -0.18 0.00 0.00 178.31 177.81 1j21 h GLU 126 N 0.15 0.67 -0.90 1.51 5.08 -1.09 -2.00 114.58 118.00 1j21 h GLU 126 Ca 0.17 -0.76 0.03 0.00 -1.00 0.00 0.00 59.36 57.80 1j21 h GLU 126 Cb 0.22 0.23 -0.05 0.00 0.50 0.00 0.00 28.75 29.64 1j21 h GLU 126 CO -0.25 1.33 0.58 -0.07 -1.00 0.00 0.00 179.01 179.61 1j21 h LEU 127 N 0.36 0.98 -0.47 1.33 3.38 -0.52 0.18 115.31 120.54 1j21 h LEU 127 Ca -0.14 -0.01 -0.17 0.00 0.09 0.00 0.00 57.88 57.65 1j21 h LEU 127 Cb 1.75 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 42.27 1j21 h LEU 127 CO 0.21 0.68 -0.57 0.00 0.09 0.00 0.00 178.44 178.85 1j21 h THR 128 N 1.15 1.32 -0.15 0.22 1.03 -1.47 -1.60 112.91 113.40 1j21 h THR 128 Ca 0.35 -1.82 -0.01 0.00 -0.01 0.00 0.00 66.41 64.92 1j21 h THR 128 Cb -0.02 1.78 -0.01 0.00 -1.07 0.00 0.00 68.15 68.83 1j21 h THR 128 CO -0.11 0.57 0.06 0.00 -0.01 0.00 0.00 175.52 176.03 1j21 h ALA 129 N 0.92 0.19 -0.50 0.00 0.00 -0.66 -1.45 119.26 117.76 1j21 h ALA 129 Ca 0.00 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.74 1j21 h ALA 129 Cb 1.13 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 1j21 h ALA 129 CO 0.11 -0.21 0.04 1.88 0.00 0.00 0.00 179.25 181.07 1j21 h TYR 130 N 0.08 0.86 -0.24 0.00 0.99 -0.67 -0.76 116.97 117.23 1j21 h TYR 130 Ca 0.05 -0.11 -0.13 0.00 2.00 0.00 0.00 58.73 60.54 1j21 h TYR 130 Cb 0.18 -0.24 -0.01 0.00 1.00 0.00 0.00 36.73 37.66 1j21 h TYR 130 CO -0.01 0.77 -0.39 0.00 -0.00 0.00 0.00 178.16 178.53 1j21 h ALA 131 N 1.27 0.89 0.17 3.88 0.00 -1.12 -2.18 119.26 122.17 1j21 h ALA 131 Ca 0.16 -0.43 -0.32 0.00 0.00 0.00 0.00 54.91 54.31 1j21 h ALA 131 Cb 0.41 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.10 1j21 h ALA 131 CO 0.01 0.63 -1.55 -0.07 0.00 0.00 0.00 179.25 178.28 1j21 h LEU 132 N 0.45 0.57 -6.59 0.00 3.38 -1.17 -3.42 115.31 108.53 1j21 h LEU 132 Ca 0.04 -0.73 -0.54 0.00 0.09 0.00 0.00 57.88 56.75 1j21 h LEU 132 Cb 0.87 -0.18 -0.38 0.00 0.09 0.00 0.00 40.66 41.06 1j21 h LEU 132 CO 0.07 1.59 -0.81 -0.75 0.09 0.00 0.00 178.44 178.64 1j21 s LYS 133 N -2.61 0.48 0.52 1.13 2.20 -0.30 -5.03 119.74 116.13 1j21 s LYS 133 Ca -0.10 -1.09 0.28 0.00 -0.36 0.00 0.00 55.97 54.69 1j21 s LYS 133 Cb 0.06 -1.18 1.41 0.00 -1.51 0.00 0.00 37.83 36.61 1j21 s LYS 133 CO 0.88 -1.17 1.92 -1.00 -0.36 0.00 0.00 175.35 175.62 1j21 h PRO 134 N 7.30 0.04 -0.68 4.03 0.13 -1.59 -2.41 132.00 138.81 1j21 h PRO 134 Ca 0.01 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 1j21 h PRO 134 Cb 0.99 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.11 1j21 h PRO 134 CO 0.29 0.03 0.00 -0.40 -0.23 0.00 0.00 178.00 177.68 1j21 n ASP 135 N -4.33 3.85 -4.75 1.44 3.85 -1.26 -4.95 116.55 110.40 1j21 n ASP 135 Ca 0.16 -2.01 -0.33 0.00 -0.71 0.00 0.00 54.79 51.90 1j21 n ASP 135 Cb 0.81 -0.46 0.07 0.00 -1.35 0.00 0.00 41.12 40.20 1j21 n ASP 135 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.20 175.68 1j21 s ILE 136 N -1.02 2.99 -0.08 2.12 1.10 -0.91 -5.02 121.20 120.38 1j21 s ILE 136 Ca 0.46 0.43 -0.01 0.00 -0.51 0.00 0.00 60.65 61.02 1j21 s ILE 136 Cb 0.24 -2.92 -0.03 0.00 0.15 0.00 0.00 42.46 39.90 1j21 s ILE 136 CO 0.31 -0.31 -0.03 -0.54 -2.11 0.00 0.00 174.94 172.26 1j21 s LYS 137 N -4.23 2.89 -0.00 3.50 3.01 -0.80 -5.00 119.74 119.11 1j21 s LYS 137 Ca 0.67 -0.47 0.06 0.00 -1.01 0.00 0.00 55.97 55.23 1j21 s LYS 137 Cb -0.22 -2.71 -0.03 0.00 -1.01 0.00 0.00 37.83 33.87 1j21 s LYS 137 CO 0.46 0.68 -0.19 0.08 0.51 0.00 0.00 175.35 176.89 1j21 s VAL 138 N -0.84 2.68 -0.17 3.17 1.01 -1.26 -1.06 120.40 123.94 1j21 s VAL 138 Ca 0.13 -1.03 -0.01 0.00 0.00 0.00 0.00 61.98 61.06 1j21 s VAL 138 Cb -0.11 -2.06 0.04 0.00 0.00 0.00 0.00 36.38 34.25 1j21 s VAL 138 CO 0.02 0.47 -0.04 -0.63 0.00 0.00 0.00 175.10 174.92 1j21 s ILE 139 N -0.79 1.02 -0.54 2.22 1.01 -0.14 -4.94 121.20 119.05 1j21 s ILE 139 Ca 0.12 -0.62 -0.02 0.00 0.00 0.00 0.00 60.65 60.13 1j21 s ILE 139 Cb -0.10 -1.25 0.14 0.00 0.01 0.00 0.00 42.46 41.26 1j21 s ILE 139 CO 0.02 0.07 0.34 0.00 0.00 0.00 0.00 174.94 175.37 1j21 s ALA 140 N 1.66 3.40 0.40 9.38 0.00 -1.26 -2.94 121.76 132.41 1j21 s ALA 140 Ca 0.00 -3.03 0.19 0.00 0.00 0.00 0.00 51.96 49.12 1j21 s ALA 140 Cb -0.16 -2.51 1.11 0.00 0.00 0.00 0.00 23.12 21.57 1j21 s ALA 140 CO -0.07 -1.99 1.77 -1.35 0.00 0.00 0.00 175.76 174.11 1j21 h PRO 141 N 7.27 0.37 0.00 0.00 0.11 -1.91 0.61 132.00 138.46 1j21 h PRO 141 Ca -0.06 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 66.03 1j21 h PRO 141 Cb 0.97 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.00 1j21 h PRO 141 CO 0.70 0.25 -0.01 -1.49 -0.21 0.00 0.00 178.00 177.24 1j21 h TRP 142 N 0.38 0.00 -0.00 0.65 4.06 -1.86 0.88 115.95 120.06 1j21 h TRP 142 Ca 0.60 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.55 1j21 h TRP 142 Cb 1.54 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.70 1j21 h TRP 142 CO -0.00 0.01 -0.92 0.54 -3.56 0.00 0.00 178.44 174.51 1j21 n ARG 143 N -3.48 0.06 -0.03 0.49 1.74 0.19 -4.59 116.66 111.06 1j21 n ARG 143 Ca -0.03 -0.05 0.00 0.00 -0.77 0.00 0.00 57.85 57.00 1j21 n ARG 143 Cb 0.09 -1.50 -0.07 0.00 -1.02 0.00 0.00 32.46 29.96 1j21 n ARG 143 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1j21 n GLU 144 N -1.42 1.41 -2.55 5.56 1.02 -0.11 -5.05 120.64 119.49 1j21 n GLU 144 Ca 0.04 -0.05 -0.24 0.00 -0.02 0.00 0.00 57.16 56.89 1j21 n GLU 144 Cb 0.34 -1.24 0.13 0.00 -0.02 0.00 0.00 31.44 30.65 1j21 n GLU 144 CO 0.00 0.00 0.00 1.67 1.18 0.00 0.00 177.13 179.98 1j21 s TRP 145 N -2.45 1.21 -0.08 -0.32 -2.14 0.12 -5.05 118.94 110.22 1j21 s TRP 145 Ca -0.04 -0.34 0.13 0.00 2.66 0.00 0.00 56.10 58.51 1j21 s TRP 145 Cb 0.05 -3.11 0.26 0.00 -3.10 0.00 0.00 33.47 27.56 1j21 s TRP 145 CO 0.39 -1.98 1.12 0.43 -2.66 0.00 0.00 176.95 174.26 1j21 n SER 146 N -3.00 1.27 -4.57 -2.66 7.64 -1.26 -4.98 113.62 106.06 1j21 n SER 146 Ca 0.17 -2.73 -0.46 0.00 1.01 0.00 0.00 58.87 56.87 1j21 n SER 146 Cb 0.61 -0.36 -0.02 0.00 -1.01 0.00 0.00 64.21 63.43 1j21 n SER 146 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 1j21 n PHE 147 N -0.58 1.11 -1.25 1.43 3.01 -1.26 -4.86 117.46 115.06 1j21 n PHE 147 Ca 0.10 0.72 -0.17 0.00 1.01 0.00 0.00 57.45 59.11 1j21 n PHE 147 Cb 0.76 -2.23 0.20 0.00 -0.01 0.00 0.00 39.48 38.21 1j21 n PHE 147 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 1j21 n GLN 148 N 0.95 2.35 0.00 -1.08 1.13 -1.26 -5.01 117.38 114.46 1j21 n GLN 148 Ca 0.11 -3.06 0.00 0.00 -1.94 0.00 0.00 57.00 52.11 1j21 n GLN 148 Cb 0.30 -2.10 0.00 0.00 0.11 0.00 0.00 30.24 28.55 1j21 n GLN 148 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1j21 n GLY 149 N -1.01 3.87 0.16 1.08 0.00 -1.26 -4.87 105.19 103.15 1j21 n GLY 149 Ca 0.51 -1.62 -0.05 0.00 0.00 0.00 0.00 46.02 44.86 1j21 n GLY 149 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1j21 h ARG 150 N 0.00 0.02 -0.97 1.61 9.65 -1.98 -1.62 114.38 121.09 1j21 h ARG 150 Ca 0.00 -0.00 0.10 0.00 -1.10 0.00 0.00 59.98 58.98 1j21 h ARG 150 Cb 0.00 -0.00 -0.12 0.00 -1.39 0.00 0.00 29.97 28.45 1j21 h ARG 150 CO 0.00 0.01 -0.54 1.63 2.80 0.00 0.00 179.97 183.88 1j21 n LYS 151 N -5.27 -0.39 0.05 0.20 4.01 -1.26 0.77 118.16 116.28 1j21 n LYS 151 Ca 0.02 1.47 0.02 0.00 -0.51 0.00 0.00 58.31 59.31 1j21 n LYS 151 Cb 0.20 -2.16 0.39 0.00 -0.51 0.00 0.00 35.03 32.95 1j21 n LYS 151 CO 0.00 0.00 0.00 1.49 -1.11 0.00 0.00 177.40 177.78 1j21 h GLU 152 N 0.00 0.41 -0.27 1.97 4.81 -1.73 -2.09 114.58 117.68 1j21 h GLU 152 Ca 0.19 -0.06 -0.19 0.00 -0.13 0.00 0.00 59.36 59.17 1j21 h GLU 152 Cb 0.43 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.74 1j21 h GLU 152 CO -0.92 0.40 -0.57 0.52 -0.73 0.00 0.00 179.01 177.71 1j21 h MET 153 N 0.40 0.86 -0.16 1.92 2.86 0.13 -1.27 114.93 119.67 1j21 h MET 153 Ca 0.09 -0.57 0.00 0.00 -2.06 0.00 0.00 59.70 57.17 1j21 h MET 153 Cb 0.20 0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.92 1j21 h MET 153 CO 0.00 1.20 0.10 0.82 1.06 0.00 0.00 176.91 180.08 1j21 h ILE 154 N 0.64 1.03 -0.65 -1.22 5.03 0.41 -0.33 117.51 122.41 1j21 h ILE 154 Ca 0.01 -0.07 0.07 0.00 -0.12 0.00 0.00 64.86 64.74 1j21 h ILE 154 Cb 1.18 0.81 -0.06 0.00 -3.03 0.00 0.00 36.82 35.72 1j21 h ILE 154 CO 0.13 0.04 0.34 0.00 -0.68 0.00 0.00 178.15 177.97 1j21 h ALA 155 N 1.07 0.87 -0.48 1.87 0.00 -1.32 0.39 119.26 121.65 1j21 h ALA 155 Ca 0.06 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 1j21 h ALA 155 Cb -0.01 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1j21 h ALA 155 CO -0.02 -0.01 0.28 -0.92 0.00 0.00 0.00 179.25 178.58 1j21 h TYR 156 N 0.62 0.65 -0.19 0.00 3.20 -0.68 0.11 116.97 120.67 1j21 h TYR 156 Ca 0.30 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.14 1j21 h TYR 156 Cb 0.24 -0.21 -0.01 0.00 1.54 0.00 0.00 36.73 38.29 1j21 h TYR 156 CO -0.10 0.46 0.01 0.00 -1.64 0.00 0.00 178.16 176.90 1j21 h ALA 157 N 1.13 0.25 -0.38 1.82 0.00 -0.21 -2.34 119.26 119.52 1j21 h ALA 157 Ca 0.17 -0.19 0.07 0.00 0.00 0.00 0.00 54.91 54.96 1j21 h ALA 157 Cb 0.01 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 17.67 1j21 h ALA 157 CO -0.03 -0.05 -0.01 0.93 0.00 0.00 0.00 179.25 180.09 1j21 h GLU 158 N 0.09 0.09 -0.93 0.00 5.08 -0.05 0.26 114.58 119.13 1j21 h GLU 158 Ca 0.06 -0.01 0.19 0.00 -1.00 0.00 0.00 59.36 58.60 1j21 h GLU 158 Cb 0.35 -0.02 -0.11 0.00 0.50 0.00 0.00 28.75 29.47 1j21 h GLU 158 CO 0.01 0.06 0.50 0.00 -1.00 0.00 0.00 179.01 178.58 1j21 h ALA 159 N 1.34 1.50 -0.16 3.43 0.00 -0.79 0.29 119.26 124.87 1j21 h ALA 159 Ca 0.19 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.21 1j21 h ALA 159 Cb 0.27 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1j21 h ALA 159 CO -0.32 -0.17 0.00 0.72 0.00 0.00 0.00 179.25 179.48 1j21 n HIS 160 N -4.89 0.20 -2.02 0.00 8.25 -0.07 -4.91 115.22 111.79 1j21 n HIS 160 Ca 0.22 -0.10 -0.06 0.00 -0.26 0.00 0.00 57.72 57.51 1j21 n HIS 160 Cb 0.57 0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.68 1j21 n HIS 160 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1j21 n GLY 161 N 1.08 0.20 3.51 -1.41 0.00 0.10 -4.99 105.19 103.67 1j21 n GLY 161 Ca 0.15 -0.66 -0.43 0.00 0.00 0.00 0.00 46.02 45.09 1j21 n GLY 161 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1j21 s ILE 162 N -2.28 4.89 0.19 -0.61 1.01 0.73 -4.99 121.20 120.14 1j21 s ILE 162 Ca 0.00 0.02 -0.32 0.00 0.00 0.00 0.00 60.65 60.35 1j21 s ILE 162 Cb 0.00 -4.16 -0.15 0.00 0.01 0.00 0.00 42.46 38.16 1j21 s ILE 162 CO 0.00 -0.55 1.14 -0.81 0.00 0.00 0.00 174.94 174.72 1j21 n PRO 163 N 6.10 1.21 -4.05 2.79 -0.04 -1.26 -4.13 135.00 135.61 1j21 n PRO 163 Ca -0.03 0.43 -0.33 0.00 -0.04 0.00 0.00 63.50 63.53 1j21 n PRO 163 Cb 0.48 -1.91 -0.15 0.00 -0.04 0.00 0.00 33.50 31.88 1j21 n PRO 163 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1j21 s VAL 164 N -0.33 2.42 0.00 0.52 1.01 -1.26 -4.87 120.40 117.89 1j21 s VAL 164 Ca 0.71 -0.97 0.00 0.00 0.00 0.00 0.00 61.98 61.71 1j21 s VAL 164 Cb -0.82 -2.12 0.00 0.00 0.00 0.00 0.00 36.38 33.44 1j21 s VAL 164 CO 0.53 0.39 0.00 -2.65 0.00 0.00 0.00 175.10 173.37 1j21 n PRO 165 N 4.63 0.00 0.00 2.72 -0.02 -1.26 -5.18 135.00 135.89 1j21 n PRO 165 Ca -0.19 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.29 1j21 n PRO 165 Cb 0.49 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.97 1j21 n PRO 165 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1j21 n PRO 171 N 0.00 0.00 -3.56 0.52 -0.04 -1.26 -5.25 135.00 125.42 1j21 n PRO 171 Ca 0.00 0.00 -0.07 0.00 -0.04 0.00 0.00 63.50 63.39 1j21 n PRO 171 Cb 0.00 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 33.44 1j21 n PRO 171 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 1j21 s TYR 172 N -0.01 -0.27 0.23 0.54 -0.85 -1.26 -0.41 117.35 115.32 1j21 s TYR 172 Ca 0.00 0.12 -0.02 0.00 -0.52 0.00 0.00 57.07 56.65 1j21 s TYR 172 Cb 0.00 0.55 -0.05 0.00 0.38 0.00 0.00 41.96 42.84 1j21 s TYR 172 CO 0.00 -0.53 0.45 0.45 -1.52 0.00 0.00 175.55 174.40 1j21 s SER 173 N -2.53 6.41 0.02 -0.18 0.15 0.23 -4.92 113.70 112.88 1j21 s SER 173 Ca 0.07 0.52 -0.02 0.00 0.70 0.00 0.00 55.95 57.23 1j21 s SER 173 Cb -0.01 -2.06 -0.02 0.00 -1.71 0.00 0.00 66.02 62.22 1j21 s SER 173 CO -0.06 -0.09 0.00 -0.04 1.20 0.00 0.00 173.24 174.25 1j21 s MET 174 N -3.37 0.39 -0.08 5.44 -1.94 -1.26 -1.85 119.30 116.63 1j21 s MET 174 Ca 0.41 -0.65 -0.03 0.00 -1.71 0.00 0.00 55.69 53.70 1j21 s MET 174 Cb -0.11 0.14 0.04 0.00 2.01 0.00 0.00 34.83 36.92 1j21 s MET 174 CO 0.29 -0.07 0.17 0.34 -0.01 0.00 0.00 175.02 175.74 1j21 s ASP 175 N -1.66 0.13 -0.01 3.03 3.68 -0.69 -4.96 116.67 116.19 1j21 s ASP 175 Ca -0.13 0.37 0.03 0.00 2.13 0.00 0.00 52.55 54.95 1j21 s ASP 175 Cb -0.07 0.29 -0.01 0.00 -1.45 0.00 0.00 42.92 41.68 1j21 s ASP 175 CO -0.02 -0.18 -0.09 0.00 0.13 0.00 0.00 175.17 175.01 1j21 s ALA 176 N 1.59 0.71 0.34 3.66 0.00 -1.26 0.16 121.76 126.95 1j21 s ALA 176 Ca -0.05 -0.37 -0.12 0.00 0.00 0.00 0.00 51.96 51.42 1j21 s ALA 176 Cb -0.12 -0.18 0.03 0.00 0.00 0.00 0.00 23.12 22.85 1j21 s ALA 176 CO -0.07 0.17 0.64 0.54 0.00 0.00 0.00 175.76 177.05 1j21 s ASN 177 N -0.22 0.23 0.60 0.00 2.20 -0.65 -3.71 114.94 113.39 1j21 s ASN 177 Ca 0.03 -1.15 0.29 0.00 -0.94 0.00 0.00 52.86 51.09 1j21 s ASN 177 Cb -0.03 0.74 1.48 0.00 -2.00 0.00 0.00 41.25 41.44 1j21 s ASN 177 CO -0.00 -1.45 1.89 -0.07 -2.94 0.00 0.00 177.10 174.53 1j21 h LEU 178 N 2.07 0.00 0.17 3.54 3.38 -0.79 -2.64 115.31 121.03 1j21 h LEU 178 Ca -0.28 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 57.37 1j21 h LEU 178 Cb 1.25 0.00 0.01 0.00 0.09 0.00 0.00 40.66 42.01 1j21 h LEU 178 CO 0.37 0.00 -1.59 0.25 0.09 0.00 0.00 178.44 177.56 1j21 h LEU 179 N 0.00 0.56 0.00 1.67 6.46 -1.90 -3.46 115.31 118.65 1j21 h LEU 179 Ca 0.20 -0.92 0.05 0.00 -0.12 0.00 0.00 57.88 57.09 1j21 h LEU 179 Cb 1.14 -0.18 -0.01 0.00 -0.73 0.00 0.00 40.66 40.88 1j21 h LEU 179 CO -0.00 1.72 0.24 0.00 -0.62 0.00 0.00 178.44 179.77 1j21 n HIS 180 N -3.73 -1.16 -4.18 1.25 1.44 -1.00 -4.57 115.22 103.27 1j21 n HIS 180 Ca -0.24 -0.69 -0.20 0.00 -2.01 0.00 0.00 57.72 54.58 1j21 n HIS 180 Cb 1.01 0.34 -0.16 0.00 0.12 0.00 0.00 29.99 31.30 1j21 n HIS 180 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 1j21 s ILE 181 N -2.40 0.56 -0.10 0.61 1.01 -0.87 -1.63 121.20 118.37 1j21 s ILE 181 Ca 0.10 -0.14 -0.02 0.00 0.00 0.00 0.00 60.65 60.60 1j21 s ILE 181 Cb -0.02 -0.58 -0.03 0.00 0.01 0.00 0.00 42.46 41.84 1j21 s ILE 181 CO 0.04 0.23 -0.03 -0.55 0.00 0.00 0.00 174.94 174.63 1j21 s SER 182 N 0.90 4.97 -0.07 3.58 0.15 0.12 -2.33 113.70 121.03 1j21 s SER 182 Ca -0.11 0.03 0.02 0.00 0.70 0.00 0.00 55.95 56.59 1j21 s SER 182 Cb -0.14 -1.47 0.01 0.00 -1.71 0.00 0.00 66.02 62.71 1j21 s SER 182 CO 0.00 0.32 -0.12 -0.31 1.20 0.00 0.00 173.24 174.34 1j21 s TYR 183 N -0.53 1.44 0.07 3.44 1.51 -0.06 -1.71 117.35 121.52 1j21 s TYR 183 Ca 0.09 -0.55 -0.26 0.00 -1.01 0.00 0.00 57.07 55.33 1j21 s TYR 183 Cb -0.12 -1.08 0.09 0.00 -0.11 0.00 0.00 41.96 40.74 1j21 s TYR 183 CO 0.02 -0.30 0.76 -1.83 -1.11 0.00 0.00 175.55 173.08 1j21 s GLU 184 N 0.79 1.03 0.00 -0.62 -1.05 -0.77 -1.30 118.70 116.77 1j21 s GLU 184 Ca -0.12 -0.37 0.00 0.00 -0.15 0.00 0.00 54.97 54.32 1j21 s GLU 184 Cb -0.15 0.48 0.00 0.00 -0.44 0.00 0.00 34.13 34.01 1j21 s GLU 184 CO 0.02 -0.45 0.00 0.41 0.95 0.00 0.00 175.26 176.19 1j21 n GLY 185 N -0.30 0.25 7.00 -3.83 0.00 -1.26 0.74 105.19 107.80 1j21 n GLY 185 Ca -0.13 -2.00 0.00 0.00 0.00 0.00 0.00 46.02 43.89 1j21 n GLY 185 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j21 n GLY 186 N 0.08 2.98 0.42 -0.02 0.00 -1.25 -1.11 105.19 106.29 1j21 n GLY 186 Ca 0.00 0.08 0.24 0.00 0.00 0.00 0.00 46.02 46.33 1j21 n GLY 186 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1j21 h VAL 187 N 0.00 0.64 0.00 1.61 2.07 -1.13 -2.00 116.25 117.44 1j21 h VAL 187 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1j21 h VAL 187 Cb 0.00 0.66 0.00 0.00 -1.52 0.00 0.00 31.29 30.43 1j21 h VAL 187 CO 0.00 0.00 0.00 0.18 0.02 0.00 0.00 177.57 177.77 1j21 n LEU 188 N -4.30 0.13 0.22 2.57 4.32 -0.27 -3.84 117.00 115.83 1j21 n LEU 188 Ca 0.13 0.52 0.07 0.00 -0.02 0.00 0.00 56.01 56.71 1j21 n LEU 188 Cb 0.76 -0.48 0.53 0.00 -1.62 0.00 0.00 43.42 42.60 1j21 n LEU 188 CO 0.37 -0.11 0.87 -0.33 -1.22 0.00 0.00 177.39 176.98 1j21 h GLU 189 N 0.00 0.00 -6.33 3.23 5.08 -1.44 -3.38 114.58 111.73 1j21 h GLU 189 Ca 0.00 0.00 -0.56 0.00 -1.00 0.00 0.00 59.36 57.80 1j21 h GLU 189 Cb 0.46 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.62 1j21 h GLU 189 CO 0.00 0.21 0.93 0.34 -1.00 0.00 0.00 179.01 179.49 1j21 s ASP 190 N -6.74 6.31 0.02 1.42 3.68 -1.25 -4.84 116.67 115.27 1j21 s ASP 190 Ca -0.03 -0.23 0.02 0.00 2.13 0.00 0.00 52.55 54.44 1j21 s ASP 190 Cb 0.15 -2.53 0.10 0.00 -1.45 0.00 0.00 42.92 39.18 1j21 s ASP 190 CO 0.67 -1.58 1.06 -0.81 0.13 0.00 0.00 175.17 174.64 1j21 n PRO 191 N 8.62 0.01 0.00 4.34 -0.04 -1.26 -1.28 135.00 145.39 1j21 n PRO 191 Ca 0.05 0.49 0.12 0.00 -0.04 0.00 0.00 63.50 64.12 1j21 n PRO 191 Cb 0.49 -1.52 0.16 0.00 -0.04 0.00 0.00 33.50 32.58 1j21 n PRO 191 CO 0.00 0.00 0.00 1.87 -0.04 0.00 0.00 175.50 177.33 1j21 n TRP 192 N -1.54 0.00 -3.61 0.54 -0.00 -1.26 -4.88 117.44 106.69 1j21 n TRP 192 Ca 0.00 0.00 -0.37 0.00 -0.00 0.00 0.00 57.50 57.14 1j21 n TRP 192 Cb 0.01 -0.10 -0.09 0.00 -0.00 0.00 0.00 31.31 31.13 1j21 n TRP 192 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 1j21 s ALA 193 N -2.71 3.61 0.52 5.87 0.00 -0.40 -5.07 121.76 123.57 1j21 s ALA 193 Ca 0.17 -0.77 -0.21 0.00 0.00 0.00 0.00 51.96 51.14 1j21 s ALA 193 Cb 0.18 -2.37 -0.06 0.00 0.00 0.00 0.00 23.12 20.87 1j21 s ALA 193 CO 0.64 -0.16 1.22 -2.00 0.00 0.00 0.00 175.76 175.47 1j21 s GLU 194 N 1.00 3.37 0.51 0.00 2.12 -1.26 -4.94 118.70 119.50 1j21 s GLU 194 Ca 0.10 1.89 -0.23 0.00 0.36 0.00 0.00 54.97 57.10 1j21 s GLU 194 Cb -0.13 -2.22 -0.07 0.00 0.26 0.00 0.00 34.13 31.97 1j21 s GLU 194 CO 0.04 -0.90 1.30 -2.30 -0.54 0.00 0.00 175.26 172.86 1j21 n PRO 195 N -0.96 1.72 -1.71 4.30 -0.02 -1.26 -4.93 135.00 132.14 1j21 n PRO 195 Ca 0.10 0.63 -0.35 0.00 -2.02 0.00 0.00 63.50 61.85 1j21 n PRO 195 Cb 0.48 -2.48 0.07 0.00 -0.02 0.00 0.00 33.50 31.54 1j21 n PRO 195 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1j21 s PRO 196 N -2.63 2.54 0.37 0.52 0.04 -1.26 -4.95 135.00 129.63 1j21 s PRO 196 Ca 0.68 1.84 -0.27 0.00 0.04 0.00 0.00 61.00 63.29 1j21 s PRO 196 Cb -0.45 -1.87 -0.09 0.00 0.04 0.00 0.00 34.50 32.13 1j21 s PRO 196 CO 0.52 -1.55 1.26 -1.59 0.04 0.00 0.00 177.00 175.69 1j21 s LYS 197 N -3.60 4.14 0.00 4.56 -2.85 -1.26 -2.89 119.74 117.85 1j21 s LYS 197 Ca 0.77 2.07 0.00 0.00 -1.00 0.00 0.00 55.97 57.81 1j21 s LYS 197 Cb -0.31 -2.86 0.00 0.00 -2.06 0.00 0.00 37.83 32.60 1j21 s LYS 197 CO 0.40 -0.32 0.00 0.41 0.10 0.00 0.00 175.35 175.94 1j21 n GLY 198 N 0.73 0.99 0.16 0.59 0.00 -1.26 -4.93 105.19 101.47 1j21 n GLY 198 Ca 0.02 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.94 1j21 n GLY 198 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1j21 h MET 199 N 3.45 0.47 -6.97 1.61 4.05 -1.91 -3.44 114.93 112.19 1j21 h MET 199 Ca 0.00 -0.13 -0.54 0.00 -0.28 0.00 0.00 59.70 58.75 1j21 h MET 199 Cb 0.00 -0.06 0.11 0.00 -0.80 0.00 0.00 31.60 30.86 1j21 h MET 199 CO 0.00 0.58 0.74 -0.06 0.23 0.00 0.00 176.91 178.41 1j21 s PHE 200 N -5.18 2.50 0.00 1.39 0.40 -1.26 -4.94 117.98 110.89 1j21 s PHE 200 Ca -0.13 1.21 0.00 0.00 -0.60 0.00 0.00 56.93 57.40 1j21 s PHE 200 Cb 0.08 -3.98 0.00 0.00 0.51 0.00 0.00 43.02 39.63 1j21 s PHE 200 CO 0.75 -3.01 0.00 0.54 0.70 0.00 0.00 175.22 174.20 1j21 n ARG 201 N 0.11 0.00 0.20 0.44 1.74 -1.26 -4.80 116.66 113.09 1j21 n ARG 201 Ca 0.03 0.00 0.10 0.00 -0.77 0.00 0.00 57.85 57.21 1j21 n ARG 201 Cb 0.40 -0.89 0.18 0.00 -1.02 0.00 0.00 32.46 31.14 1j21 n ARG 201 CO 0.00 0.00 0.00 1.98 -1.52 0.00 0.00 177.63 178.09 1j21 h MET 202 N 0.00 0.00 -5.93 5.56 4.05 -1.96 -3.45 114.93 113.20 1j21 h MET 202 Ca 0.00 0.00 -0.57 0.00 -0.28 0.00 0.00 59.70 58.85 1j21 h MET 202 Cb 0.79 0.00 -0.27 0.00 -0.80 0.00 0.00 31.60 31.32 1j21 h MET 202 CO 0.00 0.13 -0.84 0.95 0.23 0.00 0.00 176.91 177.38 1j21 s THR 203 N -3.20 1.56 0.43 -0.77 -4.23 -1.26 -4.61 115.64 103.57 1j21 s THR 203 Ca 0.06 -1.03 -0.23 0.00 -1.18 0.00 0.00 61.69 59.30 1j21 s THR 203 Cb 0.06 -1.34 -0.08 0.00 1.34 0.00 0.00 72.50 72.48 1j21 s THR 203 CO 0.68 0.28 1.13 -1.58 -0.54 0.00 0.00 174.62 174.59 1j21 s GLN 204 N -0.89 3.91 0.06 3.99 2.00 0.41 -4.88 119.66 124.27 1j21 s GLN 204 Ca 0.07 1.70 -0.30 0.00 -2.00 0.00 0.00 55.36 54.83 1j21 s GLN 204 Cb -0.08 -2.48 -0.09 0.00 0.80 0.00 0.00 33.01 31.16 1j21 s GLN 204 CO 0.01 -0.40 1.80 0.34 -0.50 0.00 0.00 175.29 176.53 1j21 s ASP 205 N -1.39 6.51 0.34 6.67 3.68 -1.26 -3.26 116.67 127.95 1j21 s ASP 205 Ca 0.61 2.59 0.12 0.00 2.13 0.00 0.00 52.55 58.01 1j21 s ASP 205 Cb -0.27 -2.55 0.99 0.00 -1.45 0.00 0.00 42.92 39.64 1j21 s ASP 205 CO 0.33 -0.98 1.71 -0.65 0.13 0.00 0.00 175.17 175.71 1j21 h PRO 206 N 9.19 0.45 0.00 4.34 0.11 -1.84 1.13 132.00 145.38 1j21 h PRO 206 Ca -0.45 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1j21 h PRO 206 Cb 1.21 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1j21 h PRO 206 CO 0.94 0.30 0.00 0.39 -0.21 0.00 0.00 178.00 179.42 1j21 n GLU 207 N -4.92 0.16 -0.09 1.05 1.02 -1.26 -1.61 120.64 114.99 1j21 n GLU 207 Ca 0.29 0.55 0.04 0.00 -0.02 0.00 0.00 57.16 58.02 1j21 n GLU 207 Cb 0.86 -1.92 0.09 0.00 -0.02 0.00 0.00 31.44 30.45 1j21 n GLU 207 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1j21 n GLU 208 N -2.25 2.01 -1.52 3.49 -0.58 0.38 -5.04 120.64 117.13 1j21 n GLU 208 Ca 0.00 -1.63 -0.31 0.00 -0.42 0.00 0.00 57.16 54.81 1j21 n GLU 208 Cb 0.12 -1.20 0.07 0.00 -0.57 0.00 0.00 31.44 29.86 1j21 n GLU 208 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1j21 s ALA 209 N -0.91 2.43 0.32 0.62 0.00 -0.63 -4.87 121.76 118.72 1j21 s ALA 209 Ca 0.15 -0.02 -0.27 0.00 0.00 0.00 0.00 51.96 51.82 1j21 s ALA 209 Cb 0.09 -3.16 -0.14 0.00 0.00 0.00 0.00 23.12 19.91 1j21 s ALA 209 CO 0.12 -1.51 0.94 -2.30 0.00 0.00 0.00 175.76 173.01 1j21 n PRO 210 N -3.31 1.21 0.12 0.00 -0.02 -1.26 -4.87 135.00 126.86 1j21 n PRO 210 Ca 0.07 0.43 0.12 0.00 -2.02 0.00 0.00 63.50 62.10 1j21 n PRO 210 Cb 0.55 -1.80 0.46 0.00 -0.02 0.00 0.00 33.50 32.69 1j21 n PRO 210 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1j21 n ASP 211 N 1.16 0.70 -4.58 2.55 8.00 -1.26 -4.62 116.55 118.51 1j21 n ASP 211 Ca 0.10 0.63 -0.34 0.00 0.71 0.00 0.00 54.79 55.89 1j21 n ASP 211 Cb 0.33 -0.80 -0.11 0.00 -0.02 0.00 0.00 41.12 40.53 1j21 n ASP 211 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1j21 s ALA 212 N -3.23 2.98 0.69 2.24 0.00 -1.26 -5.09 121.76 118.09 1j21 s ALA 212 Ca 0.07 -0.89 -0.12 0.00 0.00 0.00 0.00 51.96 51.02 1j21 s ALA 212 Cb 0.10 -1.24 0.01 0.00 0.00 0.00 0.00 23.12 21.99 1j21 s ALA 212 CO 0.46 0.56 1.06 -1.25 0.00 0.00 0.00 175.76 176.60 1j21 s PRO 213 N -0.76 2.89 -0.08 0.00 0.04 -1.26 -4.95 135.00 130.89 1j21 s PRO 213 Ca 0.12 1.04 0.03 0.00 0.04 0.00 0.00 61.00 62.22 1j21 s PRO 213 Cb -0.11 -1.98 0.01 0.00 0.04 0.00 0.00 34.50 32.45 1j21 s PRO 213 CO 0.02 -1.14 -0.17 -2.00 0.04 0.00 0.00 177.00 173.75 1j21 s GLU 214 N -4.85 2.23 0.17 4.56 2.12 -0.45 -4.92 118.70 117.56 1j21 s GLU 214 Ca 0.60 -0.60 -0.13 0.00 0.36 0.00 0.00 54.97 55.19 1j21 s GLU 214 Cb -0.15 -1.76 -0.07 0.00 0.26 0.00 0.00 34.13 32.41 1j21 s GLU 214 CO 0.52 0.09 0.55 0.71 -0.54 0.00 0.00 175.26 176.59 1j21 s TYR 215 N 0.52 3.56 -0.05 5.30 1.51 -1.26 0.03 117.35 126.96 1j21 s TYR 215 Ca -0.16 1.01 -0.07 0.00 -1.01 0.00 0.00 57.07 56.84 1j21 s TYR 215 Cb -0.17 -2.34 0.01 0.00 -0.11 0.00 0.00 41.96 39.36 1j21 s TYR 215 CO 0.06 0.39 0.18 0.08 -1.11 0.00 0.00 175.55 175.14 1j21 s VAL 216 N -1.56 0.03 -0.05 0.71 1.01 -0.04 -4.97 120.40 115.52 1j21 s VAL 216 Ca 0.40 -0.23 0.07 0.00 0.00 0.00 0.00 61.98 62.22 1j21 s VAL 216 Cb -0.14 -0.34 -0.01 0.00 0.00 0.00 0.00 36.38 35.89 1j21 s VAL 216 CO 0.20 -0.12 -0.25 -1.61 0.00 0.00 0.00 175.10 173.31 1j21 s GLU 217 N -0.40 2.41 -0.10 2.72 2.02 -1.26 -0.29 118.70 123.79 1j21 s GLU 217 Ca -0.05 -0.90 0.01 0.00 0.02 0.00 0.00 54.97 54.05 1j21 s GLU 217 Cb -0.03 -2.11 0.02 0.00 0.10 0.00 0.00 34.13 32.11 1j21 s GLU 217 CO 0.01 0.42 -0.13 0.08 0.02 0.00 0.00 175.26 175.66 1j21 s VAL 218 N -0.27 1.33 -0.11 2.63 1.01 0.45 -0.50 120.40 124.93 1j21 s VAL 218 Ca -0.00 -0.54 -0.11 0.00 0.00 0.00 0.00 61.98 61.33 1j21 s VAL 218 Cb -0.13 -1.23 -0.05 0.00 0.00 0.00 0.00 36.38 34.98 1j21 s VAL 218 CO 0.02 0.41 0.23 -0.70 0.00 0.00 0.00 175.10 175.06 1j21 s GLU 219 N 1.03 3.81 -0.02 2.72 2.12 -0.60 -0.72 118.70 127.05 1j21 s GLU 219 Ca -0.06 0.03 0.06 0.00 0.36 0.00 0.00 54.97 55.35 1j21 s GLU 219 Cb -0.15 -3.27 -0.03 0.00 0.26 0.00 0.00 34.13 30.94 1j21 s GLU 219 CO -0.01 0.59 -0.19 -0.06 -0.54 0.00 0.00 175.26 175.05 1j21 s PHE 220 N -0.57 2.56 0.00 5.30 0.40 0.28 -0.50 117.98 125.44 1j21 s PHE 220 Ca 0.16 -0.26 0.00 0.00 -0.60 0.00 0.00 56.93 56.23 1j21 s PHE 220 Cb -0.13 -1.55 0.00 0.00 0.51 0.00 0.00 43.02 41.84 1j21 s PHE 220 CO 0.05 0.13 0.00 0.34 0.70 0.00 0.00 175.22 176.45 1j21 n PHE 221 N 2.19 0.00 -2.70 0.36 7.35 0.02 -1.82 117.46 122.86 1j21 n PHE 221 Ca -0.17 0.00 -0.26 0.00 -0.76 0.00 0.00 57.45 56.26 1j21 n PHE 221 Cb 0.52 0.00 -0.02 0.00 0.35 0.00 0.00 39.48 40.33 1j21 n PHE 221 CO 0.00 0.00 0.00 0.39 -0.76 0.00 0.00 176.76 176.39 1j21 n GLU 222 N -1.54 3.18 0.00 -4.13 1.02 -1.25 -3.31 120.64 114.61 1j21 n GLU 222 Ca 0.00 -4.57 0.00 0.00 -0.02 0.00 0.00 57.16 52.57 1j21 n GLU 222 Cb 0.00 -2.19 0.00 0.00 -0.02 0.00 0.00 31.44 29.23 1j21 n GLU 222 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1j21 n GLY 223 N -0.35 1.83 3.38 0.62 0.00 -0.77 -3.99 105.19 105.92 1j21 n GLY 223 Ca 0.34 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 46.05 1j21 n GLY 223 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1j21 s ASP 224 N -1.65 3.44 0.06 1.61 1.01 -1.26 -4.67 116.67 115.21 1j21 s ASP 224 Ca 0.00 -0.44 -0.31 0.00 0.71 0.00 0.00 52.55 52.51 1j21 s ASP 224 Cb 0.00 -0.48 -0.06 0.00 1.01 0.00 0.00 42.92 43.38 1j21 s ASP 224 CO 0.00 0.29 1.30 -2.16 0.21 0.00 0.00 175.17 174.82 1j21 s PRO 225 N -1.00 4.36 0.00 8.23 0.04 -1.26 -0.80 135.00 144.57 1j21 s PRO 225 Ca 0.12 1.91 0.02 0.00 0.04 0.00 0.00 61.00 63.09 1j21 s PRO 225 Cb -0.10 -3.36 -0.02 0.00 0.04 0.00 0.00 34.50 31.05 1j21 s PRO 225 CO 0.02 -0.39 0.12 1.33 0.04 0.00 0.00 177.00 178.11 1j21 n VAL 226 N 4.11 0.00 -3.59 -0.36 0.24 0.34 -4.85 118.33 114.22 1j21 n VAL 226 Ca 0.11 -0.45 -0.14 0.00 -2.04 0.00 0.00 64.34 61.82 1j21 n VAL 226 Cb 0.44 1.00 -0.06 0.00 -1.47 0.00 0.00 33.84 33.76 1j21 n VAL 226 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1j21 s ALA 227 N -1.16 -1.30 -0.10 2.33 0.00 -1.19 -1.99 121.76 118.36 1j21 s ALA 227 Ca 0.01 0.59 -0.01 0.00 0.00 0.00 0.00 51.96 52.56 1j21 s ALA 227 Cb 0.02 0.35 0.03 0.00 0.00 0.00 0.00 23.12 23.51 1j21 s ALA 227 CO 0.09 -0.48 -0.05 0.08 0.00 0.00 0.00 175.76 175.40 1j21 s VAL 228 N -2.34 0.79 -1.46 0.00 1.01 -0.64 -1.55 120.40 116.21 1j21 s VAL 228 Ca -0.06 -0.14 -0.11 0.00 0.00 0.00 0.00 61.98 61.67 1j21 s VAL 228 Cb -0.01 -0.86 0.06 0.00 0.00 0.00 0.00 36.38 35.57 1j21 s VAL 228 CO -0.01 0.33 0.98 0.59 0.00 0.00 0.00 175.10 176.99 1j21 n ASN 229 N 4.98 -4.49 0.00 3.32 3.02 0.35 -1.39 115.26 121.05 1j21 n ASN 229 Ca -0.11 -0.74 0.00 0.00 -0.03 0.00 0.00 54.58 53.70 1j21 n ASN 229 Cb 0.50 -4.13 0.00 0.00 -0.61 0.00 0.00 39.78 35.54 1j21 n ASN 229 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1j21 n GLY 230 N -1.72 1.42 3.56 7.41 0.00 -1.26 -5.01 105.19 109.60 1j21 n GLY 230 Ca -0.02 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.62 1j21 n GLY 230 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1j21 s GLU 231 N -0.01 3.87 0.18 1.61 2.12 -0.48 -5.05 118.70 120.94 1j21 s GLU 231 Ca 0.00 -0.37 -0.31 0.00 0.36 0.00 0.00 54.97 54.65 1j21 s GLU 231 Cb 0.00 -3.62 -0.09 0.00 0.26 0.00 0.00 34.13 30.68 1j21 s GLU 231 CO 0.00 -0.20 1.39 1.03 -0.54 0.00 0.00 175.26 176.94 1j21 s ARG 232 N 1.73 4.32 0.01 4.30 0.52 -1.26 -1.61 118.95 126.95 1j21 s ARG 232 Ca 0.07 2.16 0.00 0.00 -0.52 0.00 0.00 55.73 57.44 1j21 s ARG 232 Cb -0.16 -3.18 -0.01 0.00 0.52 0.00 0.00 34.95 32.12 1j21 s ARG 232 CO 0.10 -0.39 -0.01 -0.51 0.02 0.00 0.00 175.30 174.51 1j21 s LEU 233 N 0.31 2.06 0.81 2.53 1.43 -0.84 -4.96 118.68 120.02 1j21 s LEU 233 Ca 0.61 -0.13 -0.11 0.00 -1.03 0.00 0.00 54.13 53.47 1j21 s LEU 233 Cb -0.39 -0.01 0.08 0.00 0.03 0.00 0.00 46.19 45.91 1j21 s LEU 233 CO 0.36 -0.07 1.12 -0.94 0.23 0.00 0.00 176.35 177.05 1j21 s SER 234 N -0.37 4.03 0.17 2.29 1.04 -1.26 -4.58 113.70 115.03 1j21 s SER 234 Ca -0.04 1.98 -0.27 0.00 0.48 0.00 0.00 55.95 58.10 1j21 s SER 234 Cb -0.03 -2.54 0.02 0.00 0.10 0.00 0.00 66.02 63.57 1j21 s SER 234 CO -0.00 -2.36 1.56 -0.65 0.98 0.00 0.00 173.24 172.77 1j21 h PRO 235 N -1.24 -0.16 -0.35 4.02 0.11 -1.92 0.43 132.00 132.89 1j21 h PRO 235 Ca -0.44 0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.68 1j21 h PRO 235 Cb 1.25 0.04 -0.02 0.00 0.11 0.00 0.00 31.00 32.38 1j21 h PRO 235 CO 0.48 -0.11 0.20 0.00 -0.21 0.00 0.00 178.00 178.37 1j21 h ALA 236 N 0.60 0.45 0.00 -0.75 0.00 -1.83 -2.16 119.26 115.56 1j21 h ALA 236 Ca 0.18 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.96 1j21 h ALA 236 Cb 0.54 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1j21 h ALA 236 CO -0.78 -0.04 -0.34 0.00 0.00 0.00 0.00 179.25 178.09 1j21 h ALA 237 N 1.08 1.38 -0.28 0.00 0.00 -1.75 -2.29 119.26 117.40 1j21 h ALA 237 Ca 0.13 -0.31 -0.19 0.00 0.00 0.00 0.00 54.91 54.54 1j21 h ALA 237 Cb 0.03 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1j21 h ALA 237 CO -0.02 0.42 -0.56 1.25 0.00 0.00 0.00 179.25 180.34 1j21 h LEU 238 N 0.00 0.95 -0.66 0.00 6.46 0.23 -1.77 115.31 120.53 1j21 h LEU 238 Ca -0.00 -0.51 -0.11 0.00 -0.12 0.00 0.00 57.88 57.13 1j21 h LEU 238 Cb 0.62 -0.27 -0.02 0.00 -0.73 0.00 0.00 40.66 40.26 1j21 h LEU 238 CO 0.04 1.31 -0.16 0.25 -0.62 0.00 0.00 178.44 179.27 1j21 h LEU 239 N 0.65 0.89 -0.26 2.25 6.46 -1.21 -2.40 115.31 121.68 1j21 h LEU 239 Ca 0.01 -0.30 -0.01 0.00 -0.12 0.00 0.00 57.88 57.46 1j21 h LEU 239 Cb 1.16 -0.24 -0.01 0.00 -0.73 0.00 0.00 40.66 40.84 1j21 h LEU 239 CO 0.12 1.04 0.13 -0.61 -0.62 0.00 0.00 178.44 178.50 1j21 h GLN 240 N 0.78 0.36 -0.30 1.25 5.75 -1.34 0.09 115.11 121.71 1j21 h GLN 240 Ca 0.12 -0.05 0.00 0.00 -0.15 0.00 0.00 58.65 58.57 1j21 h GLN 240 Cb 0.69 -0.07 -0.02 0.00 1.07 0.00 0.00 27.48 29.15 1j21 h GLN 240 CO 0.05 0.34 0.20 -0.09 -2.65 0.00 0.00 178.83 176.68 1j21 h ARG 241 N 0.29 0.39 0.00 1.69 9.65 -1.22 -1.39 114.38 123.80 1j21 h ARG 241 Ca 0.09 -0.02 -0.04 0.00 -1.10 0.00 0.00 59.98 58.90 1j21 h ARG 241 Cb 0.09 -0.09 -0.01 0.00 -1.39 0.00 0.00 29.97 28.58 1j21 h ARG 241 CO -0.01 0.26 -0.21 -0.07 2.80 0.00 0.00 179.97 182.74 1j21 h LEU 242 N 0.40 0.00 -0.44 3.80 3.38 -1.28 -1.15 115.31 120.03 1j21 h LEU 242 Ca 0.11 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.91 1j21 h LEU 242 Cb -0.04 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 1j21 h LEU 242 CO -0.03 0.21 -0.62 0.78 0.09 0.00 0.00 178.44 178.87 1j21 h ASN 243 N 0.00 0.63 0.39 -0.43 2.35 -0.22 0.25 115.58 118.55 1j21 h ASN 243 Ca -0.00 -0.36 -0.02 0.00 -0.55 0.00 0.00 56.30 55.36 1j21 h ASN 243 Cb 0.58 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 38.77 1j21 h ASN 243 CO 0.03 1.10 -0.19 -0.33 -1.65 0.00 0.00 177.43 176.39 1j21 h GLU 244 N 0.41 -0.50 -0.28 0.81 5.08 -0.64 0.56 114.58 120.02 1j21 h GLU 244 Ca -0.01 0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 1j21 h GLU 244 Cb 1.18 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.53 1j21 h GLU 244 CO 0.12 -0.19 0.15 0.82 -1.00 0.00 0.00 179.01 178.91 1j21 h ILE 245 N -0.83 1.12 -0.29 3.13 2.04 -1.28 -1.22 117.51 120.18 1j21 h ILE 245 Ca -0.05 -0.32 -0.18 0.00 1.00 0.00 0.00 64.86 65.31 1j21 h ILE 245 Cb 0.54 0.84 0.00 0.00 -0.74 0.00 0.00 36.82 37.45 1j21 h ILE 245 CO 0.09 0.12 -0.51 1.23 0.00 0.00 0.00 178.15 179.08 1j21 h GLY 246 N 0.33 0.94 0.91 5.37 0.00 -1.01 -3.26 103.07 106.36 1j21 h GLY 246 Ca 0.10 -1.09 0.02 0.00 0.00 0.00 0.00 47.33 46.36 1j21 h GLY 246 CO -0.02 0.98 0.29 -1.33 0.00 0.00 0.00 176.54 176.46 1j21 h GLY 247 N 0.65 0.67 1.23 4.60 0.00 0.27 -1.85 103.07 108.62 1j21 h GLY 247 Ca 0.02 -0.22 0.10 0.00 0.00 0.00 0.00 47.33 47.23 1j21 h GLY 247 CO 0.12 0.19 0.29 0.07 0.00 0.00 0.00 176.54 177.21 1j21 h ARG 248 N 0.58 0.00 -0.31 4.80 0.11 -1.27 0.17 114.38 118.47 1j21 h ARG 248 Ca 0.19 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.27 1j21 h ARG 248 Cb -0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 1j21 h ARG 248 CO -0.08 0.00 0.00 0.72 0.10 0.00 0.00 179.97 180.71 1j21 n HIS 249 N -4.12 0.39 -1.43 4.08 8.25 -0.73 -4.41 115.22 117.24 1j21 n HIS 249 Ca 0.05 -0.19 -0.09 0.00 -0.26 0.00 0.00 57.72 57.23 1j21 n HIS 249 Cb 0.46 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.54 1j21 n HIS 249 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1j21 n GLY 250 N 1.39 0.86 3.82 -1.41 0.00 -0.18 0.24 105.19 109.91 1j21 n GLY 250 Ca 0.18 -0.61 -0.33 0.00 0.00 0.00 0.00 46.02 45.26 1j21 n GLY 250 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1j21 s VAL 251 N -2.35 4.31 0.00 1.61 1.01 -0.99 -4.17 120.40 119.82 1j21 s VAL 251 Ca 0.00 1.30 0.00 0.00 0.00 0.00 0.00 61.98 63.28 1j21 s VAL 251 Cb 0.00 -3.60 0.00 0.00 0.00 0.00 0.00 36.38 32.78 1j21 s VAL 251 CO 0.00 -0.45 0.00 0.61 0.00 0.00 0.00 175.10 175.26 1j21 n GLY 252 N -0.94 0.70 3.72 4.51 0.00 -1.26 -3.54 105.19 108.38 1j21 n GLY 252 Ca 0.07 -0.68 -0.38 0.00 0.00 0.00 0.00 46.02 45.04 1j21 n GLY 252 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1j21 s ARG 253 N -1.81 4.33 -0.01 1.61 0.52 -1.26 -0.61 118.95 121.71 1j21 s ARG 253 Ca 0.00 0.45 0.03 0.00 -0.52 0.00 0.00 55.73 55.69 1j21 s ARG 253 Cb 0.00 -3.45 -0.00 0.00 0.52 0.00 0.00 34.95 32.02 1j21 s ARG 253 CO 0.00 0.13 -0.10 0.08 0.02 0.00 0.00 175.30 175.44 1j21 s VAL 254 N 0.70 0.80 -0.27 3.52 1.01 0.14 -4.99 120.40 121.31 1j21 s VAL 254 Ca 0.26 -0.41 0.00 0.00 0.00 0.00 0.00 61.98 61.83 1j21 s VAL 254 Cb -0.15 -0.68 0.08 0.00 0.00 0.00 0.00 36.38 35.63 1j21 s VAL 254 CO 0.10 0.23 0.02 -0.62 0.00 0.00 0.00 175.10 174.83 1j21 s ASP 255 N -0.09 3.93 0.07 3.32 -1.08 -1.26 -0.28 116.67 121.27 1j21 s ASP 255 Ca 0.02 -1.42 0.00 0.00 -0.52 0.00 0.00 52.55 50.62 1j21 s ASP 255 Cb -0.05 -1.08 -0.04 0.00 -1.46 0.00 0.00 42.92 40.28 1j21 s ASP 255 CO -0.00 -0.32 -0.04 0.27 0.52 0.00 0.00 175.17 175.60 1j21 s ILE 256 N 1.44 0.39 -0.30 4.11 -4.36 0.25 -5.00 121.20 117.74 1j21 s ILE 256 Ca 0.02 -1.82 -0.07 0.00 -0.26 0.00 0.00 60.65 58.52 1j21 s ILE 256 Cb -0.18 -1.53 0.01 0.00 1.25 0.00 0.00 42.46 42.01 1j21 s ILE 256 CO -0.12 -0.93 0.09 -0.69 0.24 0.00 0.00 174.94 173.53 1j21 s VAL 257 N -3.70 4.05 0.28 8.37 1.01 -1.26 0.71 120.40 129.87 1j21 s VAL 257 Ca 0.08 -0.65 0.08 0.00 0.00 0.00 0.00 61.98 61.49 1j21 s VAL 257 Cb 0.06 -3.08 -0.04 0.00 0.00 0.00 0.00 36.38 33.32 1j21 s VAL 257 CO -0.08 0.08 0.19 -1.83 0.00 0.00 0.00 175.10 173.46 1j21 s GLU 258 N 1.52 2.73 -0.27 2.72 -1.05 0.24 -4.86 118.70 119.72 1j21 s GLU 258 Ca 0.03 -1.22 -0.14 0.00 -0.15 0.00 0.00 54.97 53.49 1j21 s GLU 258 Cb -0.17 -2.45 -0.04 0.00 -0.44 0.00 0.00 34.13 31.03 1j21 s GLU 258 CO 0.03 0.29 0.33 -0.80 0.95 0.00 0.00 175.26 176.05 1j21 s ASN 259 N -3.86 6.19 0.67 0.83 0.01 -1.26 -0.50 114.94 117.03 1j21 s ASN 259 Ca 0.35 0.21 -0.11 0.00 -0.71 0.00 0.00 52.86 52.60 1j21 s ASN 259 Cb -0.07 -2.19 -0.01 0.00 0.41 0.00 0.00 41.25 39.40 1j21 s ASN 259 CO 0.24 -0.15 1.06 -0.13 -1.51 0.00 0.00 177.10 176.62 1j21 s ARG 260 N 1.98 3.17 0.19 -0.60 0.52 -0.19 -4.98 118.95 119.05 1j21 s ARG 260 Ca 0.13 0.70 0.09 0.00 -0.52 0.00 0.00 55.73 56.13 1j21 s ARG 260 Cb -0.16 -2.04 0.04 0.00 0.52 0.00 0.00 34.95 33.32 1j21 s ARG 260 CO 0.10 -0.86 1.42 0.35 0.02 0.00 0.00 175.30 176.33 1j21 h PHE 261 N -0.53 0.00 0.00 -0.53 3.57 -1.91 -3.04 116.94 114.49 1j21 h PHE 261 Ca -0.44 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.06 1j21 h PHE 261 Cb 1.22 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.96 1j21 h PHE 261 CO 0.60 0.81 0.00 1.33 -2.23 0.00 0.00 178.31 178.81 1j21 n VAL 262 N -3.50 0.86 0.00 1.41 0.24 -1.26 -4.89 118.33 111.19 1j21 n VAL 262 Ca -0.00 0.22 0.00 0.00 -2.04 0.00 0.00 64.34 62.52 1j21 n VAL 262 Cb 0.80 -1.10 0.00 0.00 -1.47 0.00 0.00 33.84 32.07 1j21 n VAL 262 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1j21 n GLY 263 N 0.04 1.12 0.00 7.63 0.00 -1.15 -5.14 105.19 107.69 1j21 n GLY 263 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1j21 n GLY 263 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1j21 n MET 264 N 0.00 2.65 -4.59 1.61 2.81 -1.26 -4.91 117.12 113.42 1j21 n MET 264 Ca 0.00 0.00 -0.30 0.00 -1.81 0.00 0.00 57.70 55.59 1j21 n MET 264 Cb 0.00 0.00 -0.13 0.00 -0.71 0.00 0.00 33.22 32.38 1j21 n MET 264 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 1j21 s LYS 265 N -0.07 1.62 0.01 0.03 1.02 -1.26 -1.02 119.74 120.06 1j21 s LYS 265 Ca 0.00 -1.23 0.00 0.00 0.02 0.00 0.00 55.97 54.77 1j21 s LYS 265 Cb 0.00 -1.96 -0.01 0.00 -0.52 0.00 0.00 37.83 35.34 1j21 s LYS 265 CO 0.00 0.48 -0.02 0.45 -0.92 0.00 0.00 175.35 175.34 1j21 s SER 266 N -1.73 0.25 -0.27 2.83 0.15 0.35 -4.92 113.70 110.37 1j21 s SER 266 Ca 0.13 -0.21 -0.16 0.00 0.70 0.00 0.00 55.95 56.41 1j21 s SER 266 Cb -0.10 0.02 -0.03 0.00 -1.71 0.00 0.00 66.02 64.20 1j21 s SER 266 CO 0.05 -0.09 0.42 -0.60 1.20 0.00 0.00 173.24 174.21 1j21 s ARG 267 N -0.59 4.04 0.03 5.44 3.00 -1.26 0.79 118.95 130.39 1j21 s ARG 267 Ca -0.05 0.14 0.05 0.00 -1.00 0.00 0.00 55.73 54.87 1j21 s ARG 267 Cb -0.04 -3.65 -0.02 0.00 0.00 0.00 0.00 34.95 31.23 1j21 s ARG 267 CO -0.00 -0.30 -0.15 0.20 0.00 0.00 0.00 175.30 175.05 1j21 s GLY 268 N 1.60 0.81 -0.10 8.12 0.00 0.22 -4.45 107.32 113.52 1j21 s GLY 268 Ca 0.17 -0.82 0.04 0.00 0.00 0.00 0.00 44.72 44.11 1j21 s GLY 268 CO 0.10 -0.78 -0.22 0.14 0.00 0.00 0.00 173.10 172.34 1j21 s VAL 269 N -0.79 1.91 0.00 1.40 1.01 -0.42 -0.58 120.40 122.93 1j21 s VAL 269 Ca 0.02 -0.93 0.02 0.00 0.00 0.00 0.00 61.98 61.10 1j21 s VAL 269 Cb -0.08 -1.67 -0.01 0.00 0.00 0.00 0.00 36.38 34.63 1j21 s VAL 269 CO 0.01 0.53 -0.07 -0.31 0.00 0.00 0.00 175.10 175.26 1j21 s TYR 270 N 0.46 0.63 -0.15 5.22 1.51 0.62 -0.88 117.35 124.75 1j21 s TYR 270 Ca -0.17 -0.18 0.01 0.00 -1.01 0.00 0.00 57.07 55.73 1j21 s TYR 270 Cb -0.17 -0.40 0.02 0.00 -0.11 0.00 0.00 41.96 41.30 1j21 s TYR 270 CO 0.07 -0.02 -0.19 -1.83 -1.11 0.00 0.00 175.55 172.47 1j21 s GLU 271 N -0.41 2.72 -0.44 -0.62 -1.05 -0.98 0.23 118.70 118.15 1j21 s GLU 271 Ca 0.01 -0.73 0.08 0.00 -0.15 0.00 0.00 54.97 54.18 1j21 s GLU 271 Cb -0.04 -2.31 0.27 0.00 -0.44 0.00 0.00 34.13 31.61 1j21 s GLU 271 CO -0.00 -0.13 0.62 2.41 0.95 0.00 0.00 175.26 179.11 1j21 n THR 272 N 4.42 0.10 0.10 1.83 -1.04 0.22 -2.05 114.28 117.85 1j21 n THR 272 Ca -0.19 -4.40 -0.13 0.00 -2.04 0.00 0.00 64.05 57.28 1j21 n THR 272 Cb 0.51 -1.62 -0.08 0.00 -1.82 0.00 0.00 70.33 67.32 1j21 n THR 272 CO 0.00 0.00 0.00 1.55 -0.64 0.00 0.00 175.07 175.98 1j21 h PRO 273 N 3.78 -0.58 -0.53 -2.82 0.13 -1.77 -0.68 132.00 129.51 1j21 h PRO 273 Ca 0.10 0.04 -0.01 0.00 -0.87 0.00 0.00 66.00 65.26 1j21 h PRO 273 Cb 0.84 0.13 -0.03 0.00 0.13 0.00 0.00 31.00 32.08 1j21 h PRO 273 CO 0.55 -0.39 0.30 0.78 -0.23 0.00 0.00 178.00 179.01 1j21 h GLY 274 N -0.61 0.79 1.91 1.56 0.00 -1.83 -2.50 103.07 102.41 1j21 h GLY 274 Ca -0.01 -0.35 -0.06 0.00 0.00 0.00 0.00 47.33 46.91 1j21 h GLY 274 CO -0.21 0.34 -0.24 -1.33 0.00 0.00 0.00 176.54 175.10 1j21 h GLY 275 N 0.71 0.11 1.37 4.60 0.00 -1.79 -1.16 103.07 106.91 1j21 h GLY 275 Ca 0.19 -0.08 -0.18 0.00 0.00 0.00 0.00 47.33 47.26 1j21 h GLY 275 CO -0.03 0.07 -0.60 -0.84 0.00 0.00 0.00 176.54 175.14 1j21 h THR 276 N 0.10 1.31 -0.39 4.70 2.02 -0.89 0.41 112.91 120.17 1j21 h THR 276 Ca 0.02 -1.85 -0.06 0.00 0.77 0.00 0.00 66.41 65.28 1j21 h THR 276 Cb 0.49 1.81 -0.01 0.00 -1.74 0.00 0.00 68.15 68.69 1j21 h THR 276 CO 0.03 0.58 -0.00 0.40 0.37 0.00 0.00 175.52 176.90 1j21 h ILE 277 N 0.49 1.26 -0.81 3.11 2.04 -1.11 -2.93 117.51 119.55 1j21 h ILE 277 Ca -0.00 -1.00 -0.04 0.00 1.00 0.00 0.00 64.86 64.81 1j21 h ILE 277 Cb 1.18 1.14 -0.04 0.00 -0.74 0.00 0.00 36.82 38.37 1j21 h ILE 277 CO 0.12 0.34 0.36 -0.07 0.00 0.00 0.00 178.15 178.90 1j21 h LEU 278 N 0.51 1.09 -0.30 1.44 3.38 -1.04 -0.67 115.31 119.71 1j21 h LEU 278 Ca 0.11 -0.15 0.04 0.00 0.09 0.00 0.00 57.88 57.98 1j21 h LEU 278 Cb 0.47 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.90 1j21 h LEU 278 CO 0.02 0.94 0.05 0.22 0.09 0.00 0.00 178.44 179.76 1j21 h TYR 279 N 1.17 0.08 0.00 1.13 3.20 -0.75 0.11 116.97 121.91 1j21 h TYR 279 Ca 0.28 0.02 -0.17 0.00 3.14 0.00 0.00 58.73 61.99 1j21 h TYR 279 Cb 0.16 0.01 -0.02 0.00 1.54 0.00 0.00 36.73 38.42 1j21 h TYR 279 CO 0.02 0.01 -0.82 0.45 -1.64 0.00 0.00 178.16 176.18 1j21 h HIS 280 N 0.16 0.03 -0.41 -3.82 3.86 -1.37 -2.88 115.15 110.72 1j21 h HIS 280 Ca 0.14 -0.02 -0.13 0.00 -1.16 0.00 0.00 60.37 59.21 1j21 h HIS 280 Cb 0.16 -0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.61 1j21 h HIS 280 CO -0.18 0.83 -0.23 0.00 0.86 0.00 0.00 177.93 179.20 1j21 h ALA 281 N 1.17 0.58 -0.06 2.45 0.00 -0.78 -1.89 119.26 120.73 1j21 h ALA 281 Ca -0.01 -0.39 -0.00 0.00 0.00 0.00 0.00 54.91 54.51 1j21 h ALA 281 Cb 1.44 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 19.09 1j21 h ALA 281 CO 0.11 0.57 0.03 -0.09 0.00 0.00 0.00 179.25 179.87 1j21 h ARG 282 N 0.70 0.09 0.00 0.00 2.43 -0.81 -2.10 114.38 114.70 1j21 h ARG 282 Ca 0.09 -0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.20 1j21 h ARG 282 Cb 0.81 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.33 1j21 h ARG 282 CO 0.07 0.18 -0.21 0.00 -1.51 0.00 0.00 179.97 178.50 1j21 h ARG 283 N -0.02 0.00 -0.45 0.20 3.08 -1.49 0.16 114.38 115.87 1j21 h ARG 283 Ca 0.02 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 59.99 1j21 h ARG 283 Cb 0.12 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.15 1j21 h ARG 283 CO -0.00 0.21 -0.04 0.00 -1.07 0.00 0.00 179.97 179.06 1j21 h ALA 284 N 1.79 0.61 -0.15 0.04 0.00 -1.05 -0.54 119.26 119.96 1j21 h ALA 284 Ca -0.00 -0.30 -0.18 0.00 0.00 0.00 0.00 54.91 54.43 1j21 h ALA 284 Cb 0.38 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 1j21 h ALA 284 CO 0.03 0.45 -0.63 0.28 0.00 0.00 0.00 179.25 179.37 1j21 h VAL 285 N 0.67 1.33 -0.16 0.00 2.07 -0.83 -2.96 116.25 116.37 1j21 h VAL 285 Ca 0.12 -1.92 -0.03 0.00 0.82 0.00 0.00 66.70 65.69 1j21 h VAL 285 Cb 0.56 1.90 -0.01 0.00 -1.52 0.00 0.00 31.29 32.22 1j21 h VAL 285 CO 0.03 0.59 -0.05 -0.33 0.02 0.00 0.00 177.57 177.83 1j21 h GLU 286 N 0.40 0.23 0.00 1.57 5.08 -0.76 -2.35 114.58 118.76 1j21 h GLU 286 Ca -0.01 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1j21 h GLU 286 Cb 1.20 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.41 1j21 h GLU 286 CO 0.12 0.30 0.00 -1.13 -1.00 0.00 0.00 179.01 177.30 1j21 n SER 287 N -4.35 0.62 -0.02 1.42 3.41 -0.23 -0.74 113.62 113.73 1j21 n SER 287 Ca -0.01 0.74 -0.00 0.00 -0.26 0.00 0.00 58.87 59.35 1j21 n SER 287 Cb 0.21 -0.84 -0.07 0.00 -0.26 0.00 0.00 64.21 63.25 1j21 n SER 287 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1j21 n LEU 288 N -2.29 0.00 -0.01 1.04 4.77 -0.98 -4.78 117.00 114.76 1j21 n LEU 288 Ca -0.00 0.00 0.09 0.00 -0.03 0.00 0.00 56.01 56.07 1j21 n LEU 288 Cb 0.10 0.11 -0.14 0.00 -2.33 0.00 0.00 43.42 41.15 1j21 n LEU 288 CO 0.13 0.11 -0.71 0.35 -1.33 0.00 0.00 177.39 175.94 1j21 n THR 289 N -2.07 0.00 -3.80 -5.08 -2.24 -0.92 0.37 114.28 100.54 1j21 n THR 289 Ca -0.08 -0.42 -0.35 0.00 -2.27 0.00 0.00 64.05 60.94 1j21 n THR 289 Cb 0.51 0.09 -0.05 0.00 -2.10 0.00 0.00 70.33 68.78 1j21 n THR 289 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1j21 s LEU 290 N -4.26 4.38 0.42 3.22 1.43 0.08 -4.88 118.68 119.07 1j21 s LEU 290 Ca -0.07 0.51 -0.24 0.00 -1.03 0.00 0.00 54.13 53.30 1j21 s LEU 290 Cb 0.12 -2.56 -0.08 0.00 0.03 0.00 0.00 46.19 43.70 1j21 s LEU 290 CO 0.76 0.28 1.13 -0.62 0.23 0.00 0.00 176.35 178.14 1j21 s ASP 291 N -1.63 6.45 0.15 2.29 -1.08 -1.26 -4.87 116.67 116.73 1j21 s ASP 291 Ca 0.25 2.23 -0.23 0.00 -0.52 0.00 0.00 52.55 54.28 1j21 s ASP 291 Cb -0.13 -2.60 0.02 0.00 -1.46 0.00 0.00 42.92 38.75 1j21 s ASP 291 CO 0.15 -0.71 1.62 -0.09 0.52 0.00 0.00 175.17 176.65 1j21 h ARG 292 N 2.35 -0.28 -0.32 4.34 2.43 -1.98 0.34 114.38 121.27 1j21 h ARG 292 Ca -0.49 0.02 -0.09 0.00 -0.81 0.00 0.00 59.98 58.61 1j21 h ARG 292 Cb 1.23 0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.83 1j21 h ARG 292 CO 0.61 -0.18 -0.17 0.93 -1.51 0.00 0.00 179.97 179.65 1j21 h GLU 293 N -0.29 0.58 0.06 0.20 4.39 -1.99 -1.49 114.58 116.04 1j21 h GLU 293 Ca 0.13 -0.20 -0.00 0.00 0.34 0.00 0.00 59.36 59.64 1j21 h GLU 293 Cb 0.50 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.10 1j21 h GLU 293 CO -0.41 0.73 -0.03 0.28 -1.16 0.00 0.00 179.01 178.42 1j21 h VAL 294 N 0.53 1.04 -0.47 3.13 2.07 -1.83 -2.02 116.25 118.70 1j21 h VAL 294 Ca 0.09 -0.31 0.06 0.00 0.82 0.00 0.00 66.70 67.35 1j21 h VAL 294 Cb 0.59 1.25 -0.05 0.00 -1.52 0.00 0.00 31.29 31.56 1j21 h VAL 294 CO 0.04 0.08 0.18 0.25 0.02 0.00 0.00 177.57 178.14 1j21 h LEU 295 N -0.22 0.20 -1.14 2.57 5.85 -0.74 -0.32 115.31 121.51 1j21 h LEU 295 Ca -0.01 0.05 -0.04 0.00 0.84 0.00 0.00 57.88 58.73 1j21 h LEU 295 Cb 0.19 0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.22 1j21 h LEU 295 CO 0.01 0.14 0.16 0.45 -0.34 0.00 0.00 178.44 178.87 1j21 h HIS 296 N 0.36 0.78 -0.17 1.25 3.86 -1.16 -0.66 115.15 119.41 1j21 h HIS 296 Ca 0.22 -0.05 -0.18 0.00 -1.16 0.00 0.00 60.37 59.20 1j21 h HIS 296 Cb 0.22 -0.24 0.01 0.00 1.06 0.00 0.00 27.41 28.46 1j21 h HIS 296 CO -0.15 0.64 -0.58 0.37 0.86 0.00 0.00 177.93 179.06 1j21 h GLN 297 N 0.75 0.69 0.08 2.45 5.75 -0.91 -3.06 115.11 120.86 1j21 h GLN 297 Ca 0.17 -0.52 0.01 0.00 -0.15 0.00 0.00 58.65 58.16 1j21 h GLN 297 Cb 0.22 0.09 -0.02 0.00 1.07 0.00 0.00 27.48 28.85 1j21 h GLN 297 CO -0.01 1.14 -0.12 -0.09 -2.65 0.00 0.00 178.83 177.10 1j21 h ARG 298 N 0.38 -0.24 0.00 1.69 1.12 -0.75 -2.35 114.38 114.23 1j21 h ARG 298 Ca -0.03 0.02 -0.00 0.00 -1.11 0.00 0.00 59.98 58.86 1j21 h ARG 298 Cb 1.21 0.05 -0.00 0.00 -0.01 0.00 0.00 29.97 31.22 1j21 h ARG 298 CO 0.12 -0.16 -0.02 -0.44 -3.11 0.00 0.00 179.97 176.36 1j21 h ASP 299 N -0.25 0.00 1.03 -3.80 3.32 -1.18 -0.40 116.42 115.14 1j21 h ASP 299 Ca 0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.07 1j21 h ASP 299 Cb 0.26 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.81 1j21 h ASP 299 CO -0.07 0.02 -0.14 0.23 -1.72 0.00 0.00 179.24 177.56 1j21 n MET 300 N -3.81 0.10 -0.06 3.56 2.81 -0.91 -3.59 117.12 115.22 1j21 n MET 300 Ca -0.03 0.06 -0.02 0.00 -1.81 0.00 0.00 57.70 55.91 1j21 n MET 300 Cb 0.11 -1.60 -0.16 0.00 -0.71 0.00 0.00 33.22 30.86 1j21 n MET 300 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 1j21 n LEU 301 N -1.76 0.06 -0.18 4.03 4.77 -0.26 -4.57 117.00 119.09 1j21 n LEU 301 Ca 0.06 0.03 -0.05 0.00 -0.03 0.00 0.00 56.01 56.02 1j21 n LEU 301 Cb 0.37 0.28 0.02 0.00 -2.33 0.00 0.00 43.42 41.76 1j21 n LEU 301 CO 0.30 0.29 0.67 0.28 -1.33 0.00 0.00 177.39 177.60 1j21 h SER 302 N 0.00 -0.95 -1.01 -1.43 0.02 -1.33 -1.93 113.55 106.92 1j21 h SER 302 Ca -0.32 0.20 0.15 0.00 -0.84 0.00 0.00 61.79 60.98 1j21 h SER 302 Cb 1.74 0.49 -0.09 0.00 0.14 0.00 0.00 62.40 64.68 1j21 h SER 302 CO 0.02 -0.28 0.63 -0.65 -1.14 0.00 0.00 176.83 175.41 1j21 h PRO 303 N -0.14 0.89 -0.52 3.45 0.11 -1.81 0.23 132.00 134.21 1j21 h PRO 303 Ca 0.23 -0.05 -0.04 0.00 0.11 0.00 0.00 66.00 66.25 1j21 h PRO 303 Cb 0.52 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 31.41 1j21 h PRO 303 CO -0.62 0.59 0.17 -0.22 -0.21 0.00 0.00 178.00 177.71 1j21 h LYS 304 N 0.92 0.80 -0.56 1.05 1.63 -1.64 -2.08 116.57 116.69 1j21 h LYS 304 Ca 0.53 -0.17 -0.02 0.00 -0.85 0.00 0.00 60.65 60.15 1j21 h LYS 304 Cb 0.64 -0.12 -0.03 0.00 -0.60 0.00 0.00 32.23 32.12 1j21 h LYS 304 CO -0.31 0.73 0.29 -0.92 -3.45 0.00 0.00 179.45 175.79 1j21 h TYR 305 N 0.71 0.79 -0.70 1.91 3.20 -0.78 -2.22 116.97 119.89 1j21 h TYR 305 Ca 0.17 -0.03 0.03 0.00 3.14 0.00 0.00 58.73 62.04 1j21 h TYR 305 Cb 0.26 -0.25 -0.04 0.00 1.54 0.00 0.00 36.73 38.23 1j21 h TYR 305 CO 0.01 0.60 0.44 0.00 -1.64 0.00 0.00 178.16 177.57 1j21 h ALA 306 N 1.12 0.91 0.00 1.82 0.00 -0.72 -1.30 119.26 121.09 1j21 h ALA 306 Ca 0.19 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 55.00 1j21 h ALA 306 Cb 0.09 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1j21 h ALA 306 CO -0.03 0.21 -0.38 1.05 0.00 0.00 0.00 179.25 180.11 1j21 h GLU 307 N 0.86 0.00 -0.32 0.00 4.11 -1.18 0.91 114.58 118.96 1j21 h GLU 307 Ca 0.28 0.00 -0.07 0.00 0.07 0.00 0.00 59.36 59.64 1j21 h GLU 307 Cb 0.02 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 1j21 h GLU 307 CO -0.11 0.38 -0.08 -0.07 0.07 0.00 0.00 179.01 179.20 1j21 h LEU 308 N 0.00 0.62 -0.13 3.06 3.38 -0.68 0.85 115.31 122.41 1j21 h LEU 308 Ca -0.00 -0.37 -0.01 0.00 0.09 0.00 0.00 57.88 57.59 1j21 h LEU 308 Cb 0.78 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 1j21 h LEU 308 CO 0.05 0.85 0.05 0.58 0.09 0.00 0.00 178.44 180.06 1j21 h VAL 309 N 0.39 1.15 -0.87 1.22 2.07 -0.86 -0.70 116.25 118.65 1j21 h VAL 309 Ca 0.08 -0.44 0.04 0.00 0.82 0.00 0.00 66.70 67.20 1j21 h VAL 309 Cb 0.58 1.19 -0.05 0.00 -1.52 0.00 0.00 31.29 31.49 1j21 h VAL 309 CO 0.03 0.13 0.56 0.22 0.02 0.00 0.00 177.57 178.54 1j21 h TYR 310 N 0.06 1.05 0.00 1.57 3.20 -0.69 -2.62 116.97 119.53 1j21 h TYR 310 Ca 0.04 0.03 -0.10 0.00 3.14 0.00 0.00 58.73 61.84 1j21 h TYR 310 Cb 0.16 -0.35 -0.01 0.00 1.54 0.00 0.00 36.73 38.07 1j21 h TYR 310 CO -0.02 0.60 -0.47 1.88 -1.64 0.00 0.00 178.16 178.51 1j21 h TYR 311 N 1.08 0.00 0.00 -3.82 0.05 -0.70 -3.48 116.97 110.11 1j21 h TYR 311 Ca 0.35 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.13 1j21 h TYR 311 Cb 0.02 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.76 1j21 h TYR 311 CO -0.02 0.47 0.00 0.41 -1.05 0.00 0.00 178.16 177.97 1j21 n GLY 312 N 0.33 0.94 2.68 3.88 0.00 -0.76 -4.30 105.19 107.96 1j21 n GLY 312 Ca -0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 1j21 n GLY 312 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1j21 n PHE 313 N -0.47 2.99 -0.09 1.61 3.01 -0.34 -4.51 117.46 119.65 1j21 n PHE 313 Ca 0.00 -2.90 -0.18 0.00 1.01 0.00 0.00 57.45 55.38 1j21 n PHE 313 Cb 0.00 -2.20 -0.11 0.00 -0.01 0.00 0.00 39.48 37.16 1j21 n PHE 313 CO 0.00 0.00 0.00 2.35 1.01 0.00 0.00 176.76 180.12 1j21 h TRP 314 N 5.53 0.00 -1.78 1.38 2.91 -1.89 -3.38 115.95 118.72 1j21 h TRP 314 Ca 0.57 0.00 -0.77 0.00 1.13 0.00 0.00 58.89 59.82 1j21 h TRP 314 Cb 0.53 0.00 -0.19 0.00 -0.51 0.00 0.00 29.16 28.99 1j21 h TRP 314 CO 1.47 1.21 1.71 0.66 -1.03 0.00 0.00 178.44 182.46 1j21 n TYR 315 N -4.50 2.69 -4.09 2.65 4.02 -1.26 -4.60 117.16 112.06 1j21 n TYR 315 Ca -0.24 -2.72 -0.14 0.00 -0.01 0.00 0.00 57.90 54.78 1j21 n TYR 315 Cb 0.58 -1.72 -0.13 0.00 -0.02 0.00 0.00 39.34 38.05 1j21 n TYR 315 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1j21 s ALA 316 N -0.85 0.41 0.35 -0.72 0.00 -1.26 -4.85 121.76 114.84 1j21 s ALA 316 Ca 0.39 -0.36 0.08 0.00 0.00 0.00 0.00 51.96 52.07 1j21 s ALA 316 Cb 0.10 -0.05 0.80 0.00 0.00 0.00 0.00 23.12 23.98 1j21 s ALA 316 CO 0.01 0.05 1.87 -1.00 0.00 0.00 0.00 175.76 176.69 1j21 h PRO 317 N 5.56 0.69 -0.35 0.00 0.13 -1.93 -2.02 132.00 134.08 1j21 h PRO 317 Ca -0.30 -0.04 -0.01 0.00 -0.87 0.00 0.00 66.00 64.78 1j21 h PRO 317 Cb 1.20 -0.16 -0.02 0.00 0.13 0.00 0.00 31.00 32.16 1j21 h PRO 317 CO 0.47 0.46 0.18 0.93 -0.23 0.00 0.00 178.00 179.81 1j21 h GLU 318 N 0.71 0.49 -0.51 0.86 3.07 -1.96 -0.53 114.58 116.70 1j21 h GLU 318 Ca 0.44 -0.06 -0.08 0.00 -0.50 0.00 0.00 59.36 59.16 1j21 h GLU 318 Cb 0.69 -0.09 -0.02 0.00 -0.84 0.00 0.00 28.75 28.49 1j21 h GLU 318 CO -0.20 0.42 -0.00 -0.09 -1.40 0.00 0.00 179.01 177.74 1j21 h ARG 319 N 0.43 0.90 -0.47 2.33 1.12 -1.69 -1.59 114.38 115.42 1j21 h ARG 319 Ca 0.12 -0.29 -0.04 0.00 -1.11 0.00 0.00 59.98 58.66 1j21 h ARG 319 Cb 0.08 -0.08 -0.02 0.00 -0.01 0.00 0.00 29.97 29.94 1j21 h ARG 319 CO -0.02 0.93 0.11 0.93 -3.11 0.00 0.00 179.97 178.82 1j21 h GLU 320 N 0.77 0.70 0.19 0.20 5.08 -1.18 -0.46 114.58 119.88 1j21 h GLU 320 Ca 0.14 -0.13 -0.01 0.00 -1.00 0.00 0.00 59.36 58.37 1j21 h GLU 320 Cb 0.53 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.67 1j21 h GLU 320 CO 0.03 0.63 -0.09 0.00 -1.00 0.00 0.00 179.01 178.58 1j21 h ALA 321 N 1.45 -0.26 -0.58 3.43 0.00 -0.86 -2.47 119.26 119.97 1j21 h ALA 321 Ca 0.15 -0.18 0.07 0.00 0.00 0.00 0.00 54.91 54.95 1j21 h ALA 321 Cb 0.25 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 1j21 h ALA 321 CO -0.00 -0.46 0.39 -0.07 0.00 0.00 0.00 179.25 179.10 1j21 h LEU 322 N -0.62 0.44 -1.25 0.00 3.38 -1.18 -0.75 115.31 115.34 1j21 h LEU 322 Ca -0.03 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 1j21 h LEU 322 Cb 0.45 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.08 1j21 h LEU 322 CO 0.04 0.28 0.33 -0.61 0.09 0.00 0.00 178.44 178.58 1j21 h GLN 323 N 0.50 0.85 -0.68 1.13 5.75 -0.83 -0.23 115.11 121.61 1j21 h GLN 323 Ca 0.26 -0.09 -0.01 0.00 -0.15 0.00 0.00 58.65 58.65 1j21 h GLN 323 Cb 0.37 -0.17 -0.03 0.00 1.07 0.00 0.00 27.48 28.71 1j21 h GLN 323 CO -0.07 0.63 0.36 0.00 -2.65 0.00 0.00 178.83 177.10 1j21 h ALA 324 N 1.51 1.37 0.22 3.38 0.00 -0.67 0.19 119.26 125.26 1j21 h ALA 324 Ca 0.22 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1j21 h ALA 324 Cb 0.03 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.55 1j21 h ALA 324 CO -0.04 0.51 -0.11 -0.92 0.00 0.00 0.00 179.25 178.70 1j21 h TYR 325 N 0.94 -0.28 -0.68 0.00 3.20 -1.21 -2.48 116.97 116.47 1j21 h TYR 325 Ca 0.24 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.16 1j21 h TYR 325 Cb 0.03 0.09 -0.05 0.00 1.54 0.00 0.00 36.73 38.34 1j21 h TYR 325 CO 0.01 0.11 0.39 0.74 -1.64 0.00 0.00 178.16 177.76 1j21 h PHE 326 N -0.82 0.71 -0.58 -3.82 0.05 -0.86 -1.53 116.94 110.09 1j21 h PHE 326 Ca -0.03 0.02 -0.02 0.00 3.82 0.00 0.00 57.97 61.76 1j21 h PHE 326 Cb 0.51 -0.22 -0.03 0.00 2.00 0.00 0.00 35.95 38.22 1j21 h PHE 326 CO 0.06 0.35 0.28 -0.44 -0.18 0.00 0.00 178.31 178.38 1j21 h ASP 327 N 0.72 0.76 -0.33 2.17 3.45 -0.71 0.22 116.42 122.69 1j21 h ASP 327 Ca 0.30 -0.13 0.05 0.00 0.43 0.00 0.00 57.03 57.68 1j21 h ASP 327 Cb 0.16 -0.19 -0.05 0.00 -0.56 0.00 0.00 39.33 38.68 1j21 h ASP 327 CO -0.17 0.67 0.03 -0.74 -1.57 0.00 0.00 179.24 177.46 1j21 h HIS 328 N 0.79 0.04 -0.27 4.55 2.76 -0.91 -1.80 115.15 120.30 1j21 h HIS 328 Ca 0.20 0.02 -0.04 0.00 -2.20 0.00 0.00 60.37 58.35 1j21 h HIS 328 Cb 0.12 0.03 -0.01 0.00 1.55 0.00 0.00 27.41 29.10 1j21 h HIS 328 CO -0.00 -0.02 -0.00 0.28 -1.30 0.00 0.00 177.93 176.88 1j21 h VAL 329 N 0.13 1.26 0.00 5.26 2.07 -0.89 -3.09 116.25 121.00 1j21 h VAL 329 Ca 0.16 -0.93 -0.00 0.00 0.82 0.00 0.00 66.70 66.75 1j21 h VAL 329 Cb 0.20 1.34 -0.00 0.00 -1.52 0.00 0.00 31.29 31.31 1j21 h VAL 329 CO -0.24 0.29 -0.02 0.00 0.02 0.00 0.00 177.57 177.63 1j21 h ALA 330 N 0.82 1.19 -0.00 1.67 0.00 -0.31 -2.63 119.26 120.00 1j21 h ALA 330 Ca 0.07 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1j21 h ALA 330 Cb 0.43 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 1j21 h ALA 330 CO 0.01 0.02 0.00 -0.09 0.00 0.00 0.00 179.25 179.20 1j21 h ARG 331 N 0.00 0.00 0.00 0.00 2.43 -1.24 -0.20 114.38 115.36 1j21 h ARG 331 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1j21 h ARG 331 Cb 0.09 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.64 1j21 h ARG 331 CO 0.00 0.00 -0.39 0.43 -1.51 0.00 0.00 179.97 178.51 1j21 n SER 332 N -3.38 0.46 -4.57 -3.80 7.64 -0.99 -4.60 113.62 104.38 1j21 n SER 332 Ca -0.03 0.07 -0.40 0.00 1.01 0.00 0.00 58.87 59.52 1j21 n SER 332 Cb 0.08 -0.01 -0.02 0.00 -1.01 0.00 0.00 64.21 63.24 1j21 n SER 332 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1j21 s VAL 333 N -3.05 3.93 -0.09 0.44 1.01 -0.15 -4.84 120.40 117.64 1j21 s VAL 333 Ca 0.10 -1.05 0.00 0.00 0.00 0.00 0.00 61.98 61.04 1j21 s VAL 333 Cb 0.16 -5.01 0.02 0.00 0.00 0.00 0.00 36.38 31.56 1j21 s VAL 333 CO 0.66 -1.87 -0.08 -0.89 0.00 0.00 0.00 175.10 172.93 1j21 s THR 334 N 5.32 0.94 -5.00 3.92 2.01 -1.21 -1.84 115.64 119.78 1j21 s THR 334 Ca 0.50 -0.28 0.00 0.00 0.31 0.00 0.00 61.69 62.22 1j21 s THR 334 Cb 0.01 -0.94 0.00 0.00 0.01 0.00 0.00 72.50 71.57 1j21 s THR 334 CO -0.04 0.34 0.00 0.61 -0.69 0.00 0.00 174.62 174.84 1j21 n GLY 335 N 4.58 -1.03 3.16 4.40 0.00 -0.76 -4.28 105.19 111.26 1j21 n GLY 335 Ca -0.16 -1.30 -0.27 0.00 0.00 0.00 0.00 46.02 44.28 1j21 n GLY 335 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1j21 s VAL 336 N -2.89 1.56 -0.09 1.61 1.01 0.11 -0.56 120.40 121.15 1j21 s VAL 336 Ca 0.00 -0.78 -0.02 0.00 0.00 0.00 0.00 61.98 61.18 1j21 s VAL 336 Cb 0.00 -1.34 -0.03 0.00 0.00 0.00 0.00 36.38 35.00 1j21 s VAL 336 CO 0.00 0.45 -0.00 0.00 0.00 0.00 0.00 175.10 175.55 1j21 s ALA 337 N 0.07 3.27 -0.16 5.51 0.00 0.10 -1.62 121.76 128.93 1j21 s ALA 337 Ca -0.06 -0.81 0.02 0.00 0.00 0.00 0.00 51.96 51.11 1j21 s ALA 337 Cb -0.13 -1.49 0.02 0.00 0.00 0.00 0.00 23.12 21.52 1j21 s ALA 337 CO 0.03 0.56 -0.20 0.50 0.00 0.00 0.00 175.76 176.64 1j21 s ARG 338 N -0.77 2.91 0.22 0.00 3.52 0.26 -0.41 118.95 124.67 1j21 s ARG 338 Ca 0.12 -0.81 0.11 0.00 -0.13 0.00 0.00 55.73 55.03 1j21 s ARG 338 Cb -0.11 -2.45 -0.05 0.00 -1.56 0.00 0.00 34.95 30.78 1j21 s ARG 338 CO 0.02 -0.13 -0.22 -0.51 -0.81 0.00 0.00 175.30 173.66 1j21 s LEU 339 N 1.11 2.50 -0.20 -0.88 1.02 0.60 -0.68 118.68 122.15 1j21 s LEU 339 Ca -0.00 -0.93 -0.01 0.00 0.02 0.00 0.00 54.13 53.21 1j21 s LEU 339 Cb -0.14 -1.09 0.01 0.00 0.02 0.00 0.00 46.19 44.99 1j21 s LEU 339 CO -0.08 0.07 -0.14 -0.75 0.02 0.00 0.00 176.35 175.47 1j21 s LYS 340 N -3.03 3.14 -0.25 1.70 2.20 0.11 -0.86 119.74 122.75 1j21 s LYS 340 Ca 0.24 -0.75 -0.09 0.00 -0.36 0.00 0.00 55.97 55.00 1j21 s LYS 340 Cb -0.06 -2.75 -0.04 0.00 -1.51 0.00 0.00 37.83 33.46 1j21 s LYS 340 CO 0.11 -0.21 0.14 -0.51 -0.36 0.00 0.00 175.35 174.52 1j21 s LEU 341 N 1.37 3.89 -0.13 5.43 1.43 0.10 -0.95 118.68 129.82 1j21 s LEU 341 Ca 0.05 -0.01 -0.05 0.00 -1.03 0.00 0.00 54.13 53.09 1j21 s LEU 341 Cb -0.14 -2.05 0.06 0.00 0.03 0.00 0.00 46.19 44.10 1j21 s LEU 341 CO -0.09 0.02 0.28 -0.47 0.23 0.00 0.00 176.35 176.32 1j21 s TYR 342 N 1.32 -0.45 -0.32 0.29 5.04 -0.73 -1.34 117.35 121.15 1j21 s TYR 342 Ca 0.06 1.01 -0.01 0.00 -2.44 0.00 0.00 57.07 55.70 1j21 s TYR 342 Cb -0.15 0.04 0.00 0.00 0.35 0.00 0.00 41.96 42.20 1j21 s TYR 342 CO 0.06 -0.34 0.23 1.63 -1.34 0.00 0.00 175.55 175.79 1j21 n LYS 343 N 5.03 -0.59 0.00 4.97 5.02 -1.26 -0.62 118.16 130.72 1j21 n LYS 343 Ca -0.12 0.26 0.00 0.00 -2.02 0.00 0.00 58.31 56.43 1j21 n LYS 343 Cb 0.51 -0.81 0.00 0.00 -0.02 0.00 0.00 35.03 34.70 1j21 n LYS 343 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1j21 n GLY 344 N -0.95 3.17 3.87 0.72 0.00 0.14 -4.90 105.19 107.23 1j21 n GLY 344 Ca -0.12 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.63 1j21 n GLY 344 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1j21 s ASN 345 N -0.72 5.95 -0.15 1.61 3.84 0.21 -4.30 114.94 121.38 1j21 s ASN 345 Ca 0.00 0.05 0.01 0.00 0.21 0.00 0.00 52.86 53.14 1j21 s ASN 345 Cb 0.00 -1.70 0.02 0.00 -0.55 0.00 0.00 41.25 39.02 1j21 s ASN 345 CO 0.00 0.09 -0.19 -0.69 -2.79 0.00 0.00 177.10 173.52 1j21 s VAL 346 N -1.67 1.90 -0.16 -5.21 1.01 -1.26 -1.78 120.40 113.22 1j21 s VAL 346 Ca 0.33 -0.86 0.01 0.00 0.00 0.00 0.00 61.98 61.46 1j21 s VAL 346 Cb -0.11 -1.72 0.02 0.00 0.00 0.00 0.00 36.38 34.57 1j21 s VAL 346 CO 0.26 0.52 -0.20 -0.31 0.00 0.00 0.00 175.10 175.36 1j21 s TYR 347 N 1.15 2.70 0.16 5.22 1.51 -0.12 -4.96 117.35 123.01 1j21 s TYR 347 Ca 0.00 -1.52 -0.30 0.00 -1.01 0.00 0.00 57.07 54.23 1j21 s TYR 347 Cb -0.14 -1.86 -0.08 0.00 -0.11 0.00 0.00 41.96 39.77 1j21 s TYR 347 CO -0.08 -0.74 1.32 0.08 -1.11 0.00 0.00 175.55 175.03 1j21 s VAL 348 N 1.14 3.30 0.00 0.71 1.01 -1.26 0.06 120.40 125.36 1j21 s VAL 348 Ca 0.01 1.02 0.00 0.00 0.00 0.00 0.00 61.98 63.01 1j21 s VAL 348 Cb -0.14 -3.65 0.00 0.00 0.00 0.00 0.00 36.38 32.59 1j21 s VAL 348 CO -0.09 0.12 0.04 0.55 0.00 0.00 0.00 175.10 175.72 1j21 n VAL 349 N 3.12 0.00 -3.57 2.92 3.14 0.15 -4.88 118.33 119.21 1j21 n VAL 349 Ca 0.08 -0.29 -0.06 0.00 -2.96 0.00 0.00 64.34 61.11 1j21 n VAL 349 Cb 0.43 1.05 -0.02 0.00 -1.06 0.00 0.00 33.84 34.24 1j21 n VAL 349 CO 0.00 0.00 0.00 -0.83 -6.46 0.00 0.00 176.83 169.54 1j21 s GLY 350 N -0.50 -0.31 -0.09 7.55 0.00 -0.87 -5.00 107.32 108.10 1j21 s GLY 350 Ca 0.00 1.58 -0.30 0.00 0.00 0.00 0.00 44.72 46.00 1j21 s GLY 350 CO 0.00 0.57 0.72 1.09 0.00 0.00 0.00 173.10 175.48 1j21 s ARG 351 N -2.37 0.98 0.08 2.90 3.03 -1.26 -0.57 118.95 121.74 1j21 s ARG 351 Ca 0.07 0.32 -0.14 0.00 2.03 0.00 0.00 55.73 58.01 1j21 s ARG 351 Cb -0.01 0.47 0.02 0.00 -1.03 0.00 0.00 34.95 34.40 1j21 s ARG 351 CO -0.05 -0.29 0.32 -1.59 -1.13 0.00 0.00 175.30 172.56 1j21 s LYS 352 N -1.01 0.91 -0.14 3.89 -2.85 -0.64 -5.00 119.74 114.89 1j21 s LYS 352 Ca -0.09 -0.64 -0.26 0.00 -1.00 0.00 0.00 55.97 53.98 1j21 s LYS 352 Cb -0.01 0.39 0.06 0.00 -2.06 0.00 0.00 37.83 36.22 1j21 s LYS 352 CO 0.08 -0.32 0.65 0.00 0.10 0.00 0.00 175.35 175.86 1j21 s ALA 353 N -3.21 -1.64 0.24 0.59 0.00 -1.26 -0.72 121.76 115.76 1j21 s ALA 353 Ca -0.00 1.52 -0.06 0.00 0.00 0.00 0.00 51.96 53.41 1j21 s ALA 353 Cb 0.01 -0.52 0.28 0.00 0.00 0.00 0.00 23.12 22.90 1j21 s ALA 353 CO -0.08 -0.34 1.88 -1.35 0.00 0.00 0.00 175.76 175.88 1j21 h PRO 354 N 4.06 1.08 -1.20 0.00 0.11 -1.99 -2.76 132.00 131.30 1j21 h PRO 354 Ca -0.28 -0.06 -0.63 0.00 0.11 0.00 0.00 66.00 65.14 1j21 h PRO 354 Cb 1.15 -0.24 -0.37 0.00 0.11 0.00 0.00 31.00 31.66 1j21 h PRO 354 CO 0.24 0.71 -0.06 1.63 -0.21 0.00 0.00 178.00 180.32 1j21 n LYS 355 N -4.53 3.20 -1.70 1.05 5.02 -1.26 -5.05 118.16 114.89 1j21 n LYS 355 Ca 0.12 -3.92 -0.39 0.00 -2.02 0.00 0.00 58.31 52.09 1j21 n LYS 355 Cb 0.10 -2.27 0.03 0.00 -0.02 0.00 0.00 35.03 32.87 1j21 n LYS 355 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1j21 n SER 356 N -0.68 2.27 -1.03 4.39 2.88 -1.05 -4.71 113.62 115.70 1j21 n SER 356 Ca 0.49 1.00 0.11 0.00 -1.33 0.00 0.00 58.87 59.14 1j21 n SER 356 Cb 0.70 -1.51 0.17 0.00 -0.75 0.00 0.00 64.21 62.82 1j21 n SER 356 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1j21 n LEU 357 N -0.49 3.22 -4.58 2.46 4.77 0.16 -4.87 117.00 117.66 1j21 n LEU 357 Ca 0.10 -1.39 -0.42 0.00 -0.03 0.00 0.00 56.01 54.26 1j21 n LEU 357 Cb 0.43 -0.18 -0.02 0.00 -2.33 0.00 0.00 43.42 41.32 1j21 n LEU 357 CO 0.55 0.67 1.10 -0.47 -1.33 0.00 0.00 177.39 177.90 1j21 s TYR 358 N -1.50 2.60 0.17 -1.77 5.04 -1.26 -5.10 117.35 115.54 1j21 s TYR 358 Ca 0.33 0.47 0.00 0.00 -2.44 0.00 0.00 57.07 55.44 1j21 s TYR 358 Cb 0.20 -4.49 0.00 0.00 0.35 0.00 0.00 41.96 38.02 1j21 s TYR 358 CO 0.29 -1.59 0.00 0.54 -1.34 0.00 0.00 175.55 173.45 1j21 n ARG 359 N 8.37 -3.40 0.00 4.97 1.74 -1.26 -5.20 116.66 121.88 1j21 n ARG 359 Ca 0.10 2.41 0.00 0.00 -0.77 0.00 0.00 57.85 59.59 1j21 n ARG 359 Cb 0.49 -2.83 0.00 0.00 -1.02 0.00 0.00 32.46 29.10 1j21 n ARG 359 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1j21 n GLY 370 N 1.31 0.00 3.59 -0.13 0.00 -1.26 -5.02 105.19 103.67 1j21 n GLY 370 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.98 1j21 n GLY 370 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1j21 s TYR 371 N 0.00 -0.17 0.43 1.61 -0.85 -1.26 -5.16 117.35 111.95 1j21 s TYR 371 Ca 0.00 0.07 0.03 0.00 -0.52 0.00 0.00 57.07 56.66 1j21 s TYR 371 Cb 0.00 0.53 -0.04 0.00 0.38 0.00 0.00 41.96 42.84 1j21 s TYR 371 CO 0.00 -0.34 0.06 0.16 -1.52 0.00 0.00 175.55 173.91 1j21 s ASP 372 N -2.42 3.32 0.24 -0.18 3.84 -1.26 -5.03 116.67 115.17 1j21 s ASP 372 Ca 0.09 -1.57 -0.05 0.00 -0.00 0.00 0.00 52.55 51.02 1j21 s ASP 372 Cb -0.00 0.27 0.41 0.00 -1.38 0.00 0.00 42.92 42.22 1j21 s ASP 372 CO -0.05 -0.78 1.74 0.06 -0.00 0.00 0.00 175.17 176.15 1j21 h GLN 373 N 1.70 0.47 -0.62 2.11 -0.00 -2.03 -1.35 115.11 115.39 1j21 h GLN 373 Ca -0.40 -0.03 0.09 0.00 -0.00 0.00 0.00 58.65 58.31 1j21 h GLN 373 Cb 1.28 -0.11 -0.04 0.00 -0.00 0.00 0.00 27.48 28.61 1j21 h GLN 373 CO 0.68 0.31 0.42 -0.22 -0.00 0.00 0.00 178.83 180.02 1j21 h LYS 374 N 0.48 0.46 -0.66 0.06 1.63 -2.01 -1.11 116.57 115.41 1j21 h LYS 374 Ca 0.39 -0.03 -0.07 0.00 -0.85 0.00 0.00 60.65 60.09 1j21 h LYS 374 Cb 0.54 -0.10 -0.03 0.00 -0.60 0.00 0.00 32.23 32.04 1j21 h LYS 374 CO -0.36 0.30 0.15 -0.44 -3.45 0.00 0.00 179.45 175.65 1j21 h ASP 375 N 0.47 1.02 -0.64 4.20 3.45 -1.65 -2.93 116.42 120.33 1j21 h ASP 375 Ca 0.29 -0.24 -0.01 0.00 0.43 0.00 0.00 57.03 57.50 1j21 h ASP 375 Cb 0.50 -0.27 -0.03 0.00 -0.56 0.00 0.00 39.33 38.97 1j21 h ASP 375 CO -0.08 0.99 0.37 0.00 -1.57 0.00 0.00 179.24 178.95 1j21 h ALA 376 N 1.06 1.42 -0.65 3.45 0.00 -1.16 -1.45 119.26 121.93 1j21 h ALA 376 Ca 0.21 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 1j21 h ALA 376 Cb 0.38 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 1j21 h ALA 376 CO 0.00 0.49 0.12 1.49 0.00 0.00 0.00 179.25 181.35 1j21 h GLU 377 N 0.91 1.07 -0.40 0.00 4.81 -1.34 -0.67 114.58 118.96 1j21 h GLU 377 Ca 0.23 -0.28 -0.03 0.00 -0.13 0.00 0.00 59.36 59.16 1j21 h GLU 377 Cb 0.00 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.24 1j21 h GLU 377 CO -0.04 0.98 0.14 0.78 -0.73 0.00 0.00 179.01 180.14 1j21 h GLY 378 N 0.99 0.66 0.63 1.92 0.00 -1.26 0.23 103.07 106.24 1j21 h GLY 378 Ca 0.20 -0.38 0.04 0.00 0.00 0.00 0.00 47.33 47.20 1j21 h GLY 378 CO 0.01 0.35 0.06 -2.75 0.00 0.00 0.00 176.54 174.21 1j21 h PHE 379 N 0.51 0.10 -0.03 5.60 3.57 -1.05 -1.84 116.94 123.80 1j21 h PHE 379 Ca 0.13 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.65 1j21 h PHE 379 Cb 0.23 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 38.97 1j21 h PHE 379 CO 0.01 0.02 0.02 0.82 -2.23 0.00 0.00 178.31 176.94 1j21 h ILE 380 N 0.17 1.03 -0.70 1.41 2.04 -0.79 -1.49 117.51 119.19 1j21 h ILE 380 Ca 0.14 -0.08 0.09 0.00 1.00 0.00 0.00 64.86 66.01 1j21 h ILE 380 Cb 0.16 1.04 -0.07 0.00 -0.74 0.00 0.00 36.82 37.20 1j21 h ILE 380 CO -0.19 0.03 0.34 0.11 0.00 0.00 0.00 178.15 178.43 1j21 h LYS 381 N 0.01 0.56 -0.43 2.37 1.79 -0.63 -0.38 116.57 119.86 1j21 h LYS 381 Ca 0.01 -0.03 -0.14 0.00 -2.18 0.00 0.00 60.65 58.31 1j21 h LYS 381 Cb 0.03 -0.13 -0.01 0.00 -1.58 0.00 0.00 32.23 30.54 1j21 h LYS 381 CO -0.00 0.37 -0.28 0.82 -1.08 0.00 0.00 179.45 179.28 1j21 h ILE 382 N 0.58 1.27 0.00 1.86 1.08 -1.17 -2.40 117.51 118.72 1j21 h ILE 382 Ca 0.34 -1.45 -0.08 0.00 -0.39 0.00 0.00 64.86 63.28 1j21 h ILE 382 Cb 0.37 1.26 -0.01 0.00 -3.07 0.00 0.00 36.82 35.37 1j21 h ILE 382 CO -0.27 0.49 -0.40 1.56 -0.69 0.00 0.00 178.15 178.84 1j21 h GLN 383 N 0.78 0.00 0.00 2.37 1.08 -0.82 -3.12 115.11 115.40 1j21 h GLN 383 Ca 0.09 0.00 -0.11 0.00 -1.45 0.00 0.00 58.65 57.17 1j21 h GLN 383 Cb 0.86 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.28 1j21 h GLN 383 CO 0.08 0.40 -0.53 0.00 -0.95 0.00 0.00 178.83 177.82 1j21 h ALA 384 N 1.60 0.66 -0.76 3.87 0.00 -0.90 -3.40 119.26 120.33 1j21 h ALA 384 Ca -0.00 -0.49 0.08 0.00 0.00 0.00 0.00 54.91 54.50 1j21 h ALA 384 Cb 0.72 -0.09 -0.11 0.00 0.00 0.00 0.00 17.79 18.32 1j21 h ALA 384 CO 0.05 0.67 -0.55 1.25 0.00 0.00 0.00 179.25 180.67 1j21 h LEU 385 N 0.00 -1.96 -1.58 0.00 5.85 -1.37 0.92 115.31 117.17 1j21 h LEU 385 Ca -0.01 0.29 0.04 0.00 0.84 0.00 0.00 57.88 59.05 1j21 h LEU 385 Cb 1.41 0.86 -0.03 0.00 0.37 0.00 0.00 40.66 43.26 1j21 h LEU 385 CO 0.07 -0.30 0.35 0.08 -0.34 0.00 0.00 178.44 178.29 1j21 h ARG 386 N -0.16 0.52 -0.41 1.25 0.11 -1.80 -0.41 114.38 113.49 1j21 h ARG 386 Ca 0.14 -0.03 -0.13 0.00 0.10 0.00 0.00 59.98 60.07 1j21 h ARG 386 Cb 0.50 -0.12 -0.01 0.00 1.11 0.00 0.00 29.97 31.45 1j21 h ARG 386 CO -0.80 0.35 -0.25 -0.07 0.10 0.00 0.00 179.97 179.30 1j21 h LEU 387 N 0.54 0.86 -0.30 0.08 3.38 -1.15 -1.70 115.31 117.02 1j21 h LEU 387 Ca 0.22 -0.33 -0.08 0.00 0.09 0.00 0.00 57.88 57.78 1j21 h LEU 387 Cb 0.19 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1j21 h LEU 387 CO -0.06 1.07 -0.13 0.03 0.09 0.00 0.00 178.44 179.44 1j21 h ARG 388 N 0.73 0.61 -0.40 1.13 3.08 0.14 -2.31 114.38 117.35 1j21 h ARG 388 Ca 0.09 -0.26 0.01 0.00 0.07 0.00 0.00 59.98 59.90 1j21 h ARG 388 Cb 0.78 -0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.79 1j21 h ARG 388 CO 0.06 0.84 0.24 0.28 -1.07 0.00 0.00 179.97 180.32 1j21 h VAL 389 N 0.37 1.05 -0.64 2.04 2.07 -1.07 0.78 116.25 120.86 1j21 h VAL 389 Ca 0.07 -0.17 0.08 0.00 0.82 0.00 0.00 66.70 67.51 1j21 h VAL 389 Cb 0.65 0.52 -0.07 0.00 -1.52 0.00 0.00 31.29 30.87 1j21 h VAL 389 CO 0.04 0.09 0.29 -0.09 0.02 0.00 0.00 177.57 177.92 1j21 h ARG 390 N 0.49 0.50 -0.48 1.57 2.43 -1.24 0.76 114.38 118.40 1j21 h ARG 390 Ca 0.16 -0.03 -0.13 0.00 -0.81 0.00 0.00 59.98 59.16 1j21 h ARG 390 Cb -0.01 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.42 1j21 h ARG 390 CO -0.07 0.33 -0.23 0.00 -1.51 0.00 0.00 179.97 178.49 1j21 h ALA 391 N 1.40 0.69 -0.46 2.80 0.00 -0.82 -1.38 119.26 121.48 1j21 h ALA 391 Ca 0.31 -0.40 -0.06 0.00 0.00 0.00 0.00 54.91 54.76 1j21 h ALA 391 Cb 0.33 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1j21 h ALA 391 CO -0.26 0.68 0.05 -0.07 0.00 0.00 0.00 179.25 179.64 1j21 h LEU 392 N 0.86 0.76 -1.30 0.00 3.38 -0.26 -1.45 115.31 117.30 1j21 h LEU 392 Ca 0.11 -0.28 -0.05 0.00 0.09 0.00 0.00 57.88 57.75 1j21 h LEU 392 Cb 0.81 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.34 1j21 h LEU 392 CO 0.07 0.85 -0.03 0.58 0.09 0.00 0.00 178.44 180.00 1j21 h VAL 393 N 0.64 1.19 0.00 1.22 2.07 -0.76 0.24 116.25 120.84 1j21 h VAL 393 Ca 0.14 -0.75 -0.02 0.00 0.82 0.00 0.00 66.70 66.88 1j21 h VAL 393 Cb 0.43 1.00 -0.00 0.00 -1.52 0.00 0.00 31.29 31.20 1j21 h VAL 393 CO 0.01 0.25 -0.11 -0.33 0.02 0.00 0.00 177.57 177.41 1j21 h GLU 394 N 0.42 0.00 0.00 1.57 4.39 -0.72 -3.51 114.58 116.73 1j21 h GLU 394 Ca 0.09 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.79 1j21 h GLU 394 Cb 0.32 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.97 1j21 h GLU 394 CO 0.01 0.11 0.00 0.54 -1.16 0.00 0.00 179.01 178.52