#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nji s ARG 2 N 0.00 2.24 0.45 1.61 0.52 -0.12 -5.05 118.95 118.60 1nji s ARG 2 Ca 0.00 -1.52 -0.25 0.00 -0.52 0.00 0.00 55.73 53.44 1nji s ARG 2 Cb 0.00 -2.10 -0.08 0.00 0.52 0.00 0.00 34.95 33.28 1nji s ARG 2 CO 0.00 0.28 1.41 1.03 0.02 0.00 0.00 175.30 178.03 1nji s ARG 3 N -3.71 3.71 0.60 3.54 1.81 -1.26 -4.77 118.95 118.87 1nji s ARG 3 Ca 0.33 2.38 -0.07 0.00 -1.72 0.00 0.00 55.73 56.65 1nji s ARG 3 Cb -0.05 -2.66 0.00 0.00 -0.45 0.00 0.00 34.95 31.80 1nji s ARG 3 CO 0.20 -0.78 0.93 0.96 -0.68 0.00 0.00 175.30 175.93 1nji s ILE 4 N -1.21 3.82 0.22 1.52 -4.36 -1.26 -4.89 121.20 115.04 1nji s ILE 4 Ca 0.61 0.16 -0.10 0.00 -0.26 0.00 0.00 60.65 61.06 1nji s ILE 4 Cb -0.43 -3.53 0.21 0.00 1.25 0.00 0.00 42.46 39.97 1nji s ILE 4 CO 0.55 -0.58 1.66 -0.61 0.24 0.00 0.00 174.94 176.20 1nji h GLN 5 N -0.23 0.12 0.00 0.37 4.15 -1.94 0.80 115.11 118.37 1nji h GLN 5 Ca -0.45 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 58.96 1nji h GLN 5 Cb 1.25 -0.03 0.00 0.00 0.21 0.00 0.00 27.48 28.91 1nji h GLN 5 CO 0.61 0.08 0.33 0.78 -1.93 0.00 0.00 178.83 178.70 1nji h GLY 6 N 0.12 0.00 0.86 2.39 0.00 -1.99 0.20 103.07 104.65 1nji h GLY 6 Ca 0.34 0.00 -0.31 0.00 0.00 0.00 0.00 47.33 47.36 1nji h GLY 6 CO -0.55 0.00 -1.80 -1.06 0.00 0.00 0.00 176.54 173.13 1nji n GLN 7 N -2.57 0.65 0.01 4.80 6.02 0.26 -3.83 117.38 122.72 1nji n GLN 7 Ca -0.02 0.27 -0.03 0.00 -0.01 0.00 0.00 57.00 57.22 1nji n GLN 7 Cb 0.36 -1.76 0.21 0.00 1.02 0.00 0.00 30.24 30.07 1nji n GLN 7 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1nji h ARG 8 N 0.01 0.50 -0.23 -1.09 -0.00 -0.47 -3.17 114.38 109.93 1nji h ARG 8 Ca -0.32 -0.18 0.06 0.00 -0.50 0.00 0.00 59.98 59.04 1nji h ARG 8 Cb 2.03 -0.04 -0.07 0.00 0.00 0.00 0.00 29.97 31.89 1nji h ARG 8 CO 0.08 0.69 -0.32 0.00 0.00 0.00 0.00 179.97 180.41 1nji h ARG 9 N 0.45 -0.33 -0.97 0.04 3.08 -1.47 -2.70 114.38 112.48 1nji h ARG 9 Ca 0.07 0.02 0.22 0.00 0.07 0.00 0.00 59.98 60.37 1nji h ARG 9 Cb 0.62 0.08 -0.08 0.00 0.08 0.00 0.00 29.97 30.67 1nji h ARG 9 CO 0.04 -0.22 0.63 0.78 -1.07 0.00 0.00 179.97 180.13 1nji h GLY 10 N -0.34 1.10 1.62 0.04 0.00 -1.68 -1.73 103.07 102.08 1nji h GLY 10 Ca 0.12 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 47.23 1nji h GLY 10 CO -0.42 -0.05 0.11 0.54 0.00 0.00 0.00 176.54 176.72 1nji n ARG 11 N -4.58 0.04 -3.35 4.80 1.74 -1.02 -4.82 116.66 109.48 1nji n ARG 11 Ca 0.22 0.47 -0.21 0.00 -0.77 0.00 0.00 57.85 57.56 1nji n ARG 11 Cb 0.75 -1.73 0.06 0.00 -1.02 0.00 0.00 32.46 30.52 1nji n ARG 11 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1nji n GLY 12 N -1.37 -0.41 3.91 -0.13 0.00 -0.65 -5.01 105.19 101.54 1nji n GLY 12 Ca -0.00 0.14 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 1nji n GLY 12 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1nji s THR 13 N -3.25 2.00 0.17 2.61 -4.23 -1.26 -4.79 115.64 106.89 1nji s THR 13 Ca 0.46 0.00 -0.22 0.00 -1.18 0.00 0.00 61.69 60.76 1nji s THR 13 Cb -0.20 -3.00 0.08 0.00 1.34 0.00 0.00 72.50 70.72 1nji s THR 13 CO 0.58 0.00 1.60 -1.28 -0.54 0.00 0.00 174.62 174.98 1nji h SER 14 N -1.28 -1.03 -0.71 3.99 0.87 -1.95 -0.49 113.55 112.96 1nji h SER 14 Ca -0.45 0.19 0.20 0.00 -1.23 0.00 0.00 61.79 60.50 1nji h SER 14 Cb 1.29 0.50 -0.03 0.00 -0.44 0.00 0.00 62.40 63.72 1nji h SER 14 CO 0.56 -0.31 0.61 0.74 -0.53 0.00 0.00 176.83 177.90 1nji h THR 15 N -0.22 0.43 -0.01 2.23 2.02 -2.00 -1.86 112.91 113.51 1nji h THR 15 Ca 0.19 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.37 1nji h THR 15 Cb 0.53 0.55 0.00 0.00 -1.74 0.00 0.00 68.15 67.49 1nji h THR 15 CO -0.55 0.00 -0.30 0.49 0.37 0.00 0.00 175.52 175.53 1nji n PHE 16 N -3.95 0.00 -2.03 3.16 3.01 -0.25 -4.39 117.46 113.01 1nji n PHE 16 Ca 0.14 0.00 -0.30 0.00 1.01 0.00 0.00 57.45 58.30 1nji n PHE 16 Cb 0.87 0.00 0.01 0.00 -0.01 0.00 0.00 39.48 40.34 1nji n PHE 16 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 1nji s ARG 17 N -1.79 3.61 0.17 -1.08 0.52 -0.70 -4.11 118.95 115.57 1nji s ARG 17 Ca 0.13 0.66 -0.17 0.00 -0.52 0.00 0.00 55.73 55.83 1nji s ARG 17 Cb 0.12 -2.13 -0.07 0.00 0.52 0.00 0.00 34.95 33.38 1nji s ARG 17 CO 0.37 -0.49 0.63 0.00 0.02 0.00 0.00 175.30 175.83 1nji s ALA 18 N -3.07 3.51 -0.47 2.13 0.00 -1.26 -4.32 121.76 118.27 1nji s ALA 18 Ca 0.54 0.02 -0.04 0.00 0.00 0.00 0.00 51.96 52.48 1nji s ALA 18 Cb -0.11 -2.66 -0.06 0.00 0.00 0.00 0.00 23.12 20.29 1nji s ALA 18 CO 0.51 0.39 1.83 -0.35 0.00 0.00 0.00 175.76 178.14 1nji n PRO 19 N 0.92 1.34 -0.30 0.00 -0.04 -1.26 -4.67 135.00 130.99 1nji n PRO 19 Ca -0.05 -0.97 0.12 0.00 -0.04 0.00 0.00 63.50 62.57 1nji n PRO 19 Cb 0.51 -2.14 0.24 0.00 -0.04 0.00 0.00 33.50 32.07 1nji n PRO 19 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1nji n SER 20 N 3.90 -0.12 0.00 3.54 7.64 -1.26 0.90 113.62 128.22 1nji n SER 20 Ca 0.29 1.47 0.01 0.00 1.01 0.00 0.00 58.87 61.65 1nji n SER 20 Cb 0.19 -0.53 0.04 0.00 -1.01 0.00 0.00 64.21 62.90 1nji n SER 20 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1nji n HIS 21 N -5.27 0.00 0.83 1.43 1.44 -1.26 -0.14 115.22 112.25 1nji n HIS 21 Ca 0.20 0.00 0.10 0.00 -2.01 0.00 0.00 57.72 56.00 1nji n HIS 21 Cb 0.65 -0.45 0.05 0.00 0.12 0.00 0.00 29.99 30.35 1nji n HIS 21 CO 0.00 0.00 0.00 -2.13 -2.81 0.00 0.00 176.34 171.40 1nji n ARG 22 N -1.45 1.65 -2.95 -1.40 0.63 0.26 -4.97 116.66 108.42 1nji n ARG 22 Ca 0.01 -1.34 -0.34 0.00 -0.92 0.00 0.00 57.85 55.26 1nji n ARG 22 Cb 0.02 -1.37 -0.07 0.00 0.45 0.00 0.00 32.46 31.49 1nji n ARG 22 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 1nji s TYR 23 N -1.86 3.41 -0.01 -0.14 4.12 0.80 -4.89 117.35 118.77 1nji s TYR 23 Ca 0.20 1.47 -0.00 0.00 0.02 0.00 0.00 57.07 58.76 1nji s TYR 23 Cb 0.16 -2.73 -0.00 0.00 -1.52 0.00 0.00 41.96 37.87 1nji s TYR 23 CO 0.35 0.04 -0.01 0.87 0.02 0.00 0.00 175.55 176.82 1nji h LYS 24 N 2.32 0.00 -3.87 -0.62 1.57 -1.93 -3.50 116.57 110.54 1nji h LYS 24 Ca -0.48 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.15 1nji h LYS 24 Cb 1.18 0.00 -0.19 0.00 0.08 0.00 0.00 32.23 33.30 1nji h LYS 24 CO 0.63 0.00 -0.61 0.00 -0.57 0.00 0.00 179.45 178.90 1nji s ALA 25 N -2.97 0.02 -0.86 3.86 0.00 -1.26 -5.08 121.76 115.47 1nji s ALA 25 Ca -0.01 -0.55 -0.19 0.00 0.00 0.00 0.00 51.96 51.21 1nji s ALA 25 Cb 0.00 0.18 0.13 0.00 0.00 0.00 0.00 23.12 23.42 1nji s ALA 25 CO 0.01 -0.23 1.05 0.34 0.00 0.00 0.00 175.76 176.93 1nji s ASP 26 N -1.76 6.54 -0.20 0.00 -1.08 -1.26 -4.99 116.67 113.93 1nji s ASP 26 Ca -0.11 -1.90 -0.31 0.00 -0.52 0.00 0.00 52.55 49.72 1nji s ASP 26 Cb -0.06 -2.38 -0.08 0.00 -1.46 0.00 0.00 42.92 38.94 1nji s ASP 26 CO -0.02 -1.09 2.13 0.18 0.52 0.00 0.00 175.17 176.89 1nji n LEU 27 N 6.54 3.14 -3.82 -1.34 4.77 -1.26 -4.96 117.00 120.07 1nji n LEU 27 Ca 0.17 0.46 -0.12 0.00 -0.03 0.00 0.00 56.01 56.49 1nji n LEU 27 Cb 0.48 -1.45 -0.11 0.00 -2.33 0.00 0.00 43.42 40.01 1nji n LEU 27 CO 0.52 -0.49 -0.12 -1.61 -1.33 0.00 0.00 177.39 174.35 1nji s GLU 28 N 5.74 0.39 0.41 3.23 2.02 -1.26 -4.91 118.70 124.32 1nji s GLU 28 Ca 1.00 -0.03 -0.27 0.00 0.02 0.00 0.00 54.97 55.70 1nji s GLU 28 Cb -0.53 0.18 -0.09 0.00 0.10 0.00 0.00 34.13 33.79 1nji s GLU 28 CO 0.42 -0.08 1.41 -1.01 0.02 0.00 0.00 175.26 176.01 1nji s HIS 29 N -0.64 2.63 0.87 1.61 3.76 -0.96 -4.97 115.29 117.59 1nji s HIS 29 Ca -0.07 1.28 -0.11 0.00 -0.15 0.00 0.00 55.06 56.01 1nji s HIS 29 Cb -0.04 -3.88 0.12 0.00 1.11 0.00 0.00 32.58 29.89 1nji s HIS 29 CO 0.01 -2.68 1.10 1.03 -0.85 0.00 0.00 174.74 173.35 1nji s ARG 30 N -2.24 1.42 -0.18 1.40 0.52 -1.26 -4.74 118.95 113.86 1nji s ARG 30 Ca 0.57 1.10 -0.08 0.00 -0.52 0.00 0.00 55.73 56.79 1nji s ARG 30 Cb -0.43 -1.81 -0.04 0.00 0.52 0.00 0.00 34.95 33.19 1nji s ARG 30 CO 0.56 -2.21 0.10 0.15 0.02 0.00 0.00 175.30 173.93 1nji s LYS 31 N -4.83 3.99 -0.11 3.54 1.02 -1.26 -5.05 119.74 117.04 1nji s LYS 31 Ca 0.64 -0.26 0.03 0.00 0.02 0.00 0.00 55.97 56.39 1nji s LYS 31 Cb -0.19 -3.30 0.01 0.00 -0.52 0.00 0.00 37.83 33.83 1nji s LYS 31 CO 0.57 0.36 -0.21 0.08 -0.92 0.00 0.00 175.35 175.24 1nji s VAL 32 N 0.17 1.88 0.18 3.17 1.01 -1.26 -5.01 120.40 120.52 1nji s VAL 32 Ca 0.07 -0.89 -0.18 0.00 0.00 0.00 0.00 61.98 60.98 1nji s VAL 32 Cb -0.12 -1.66 0.12 0.00 0.00 0.00 0.00 36.38 34.73 1nji s VAL 32 CO -0.00 0.52 1.63 -0.33 0.00 0.00 0.00 175.10 176.92 1nji h GLU 33 N 7.10 -0.10 0.00 2.72 3.07 -1.99 -3.48 114.58 121.91 1nji h GLU 33 Ca -0.27 0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.59 1nji h GLU 33 Cb 1.20 0.02 0.00 0.00 -0.84 0.00 0.00 28.75 29.14 1nji h GLU 33 CO 0.51 -0.06 0.00 -3.47 -1.40 0.00 0.00 179.01 174.58 1nji n ASP 34 N -5.38 0.00 0.00 1.42 -0.08 -1.26 -5.04 116.55 106.21 1nji n ASP 34 Ca 0.03 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.31 1nji n ASP 34 Cb 0.29 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.75 1nji n ASP 34 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1nji n GLY 35 N -0.97 2.40 2.68 0.27 0.00 -1.26 -4.47 105.19 103.83 1nji n GLY 35 Ca 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.65 1nji n GLY 35 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1nji n ASP 36 N 1.13 0.00 -0.30 1.61 2.03 -1.26 -4.44 116.55 115.33 1nji n ASP 36 Ca 0.00 0.00 0.26 0.00 0.52 0.00 0.00 54.79 55.57 1nji n ASP 36 Cb 0.00 0.00 0.41 0.00 -0.72 0.00 0.00 41.12 40.81 1nji n ASP 36 CO 0.00 0.00 0.00 1.33 -1.92 0.00 0.00 177.20 176.61 1nji n VAL 37 N -1.82 0.00 -1.65 5.18 0.24 -1.26 -4.33 118.33 114.68 1nji n VAL 37 Ca 0.00 0.90 -0.46 0.00 -2.04 0.00 0.00 64.34 62.74 1nji n VAL 37 Cb 0.00 -1.56 -0.04 0.00 -1.47 0.00 0.00 33.84 30.77 1nji n VAL 37 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 1nji n ILE 38 N -2.90 0.59 -4.04 1.34 2.08 -1.26 -4.95 119.36 110.22 1nji n ILE 38 Ca 0.22 -0.17 -0.07 0.00 0.56 0.00 0.00 62.75 63.28 1nji n ILE 38 Cb 1.17 -2.09 -0.10 0.00 -0.75 0.00 0.00 39.64 37.87 1nji n ILE 38 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1nji s ALA 39 N 4.99 0.35 0.29 -1.39 0.00 -1.26 -1.12 121.76 123.63 1nji s ALA 39 Ca 0.94 -1.06 -0.11 0.00 0.00 0.00 0.00 51.96 51.73 1nji s ALA 39 Cb -0.58 0.30 0.01 0.00 0.00 0.00 0.00 23.12 22.84 1nji s ALA 39 CO 0.47 -0.38 0.53 0.20 0.00 0.00 0.00 175.76 176.58 1nji s GLY 40 N -2.81 0.72 -0.08 0.00 0.00 -0.44 -1.18 107.32 103.54 1nji s GLY 40 Ca 0.05 -0.99 0.05 0.00 0.00 0.00 0.00 44.72 43.83 1nji s GLY 40 CO -0.10 -0.65 -0.23 -1.59 0.00 0.00 0.00 173.10 170.53 1nji s THR 41 N -3.54 2.16 -0.01 0.90 2.01 0.69 -1.36 115.64 116.50 1nji s THR 41 Ca 0.23 -1.01 -0.30 0.00 0.31 0.00 0.00 61.69 60.92 1nji s THR 41 Cb -0.02 -1.81 -0.07 0.00 0.01 0.00 0.00 72.50 70.62 1nji s THR 41 CO 0.12 0.56 1.71 -0.69 -0.69 0.00 0.00 174.62 175.63 1nji s VAL 42 N 0.02 3.37 -0.06 3.82 1.01 -0.36 -1.18 120.40 127.02 1nji s VAL 42 Ca -0.09 0.54 0.20 0.00 0.00 0.00 0.00 61.98 62.64 1nji s VAL 42 Cb -0.15 -3.35 -0.31 0.00 0.00 0.00 0.00 36.38 32.57 1nji s VAL 42 CO 0.05 -0.04 0.46 0.52 0.00 0.00 0.00 175.10 176.10 1nji n VAL 43 N 5.32 0.00 -3.61 2.92 0.31 0.14 -0.97 118.33 122.45 1nji n VAL 43 Ca 0.17 -0.45 -0.04 0.00 -0.01 0.00 0.00 64.34 64.02 1nji n VAL 43 Cb 0.42 0.07 -0.02 0.00 -0.91 0.00 0.00 33.84 33.40 1nji n VAL 43 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1nji s ASP 44 N -4.28 -0.11 -0.17 4.52 2.15 -1.13 -4.93 116.67 112.71 1nji s ASP 44 Ca -0.07 -0.00 -0.01 0.00 0.43 0.00 0.00 52.55 52.90 1nji s ASP 44 Cb 0.13 0.12 -0.00 0.00 -0.30 0.00 0.00 42.92 42.87 1nji s ASP 44 CO 0.84 -0.19 -0.14 -0.63 -0.17 0.00 0.00 175.17 174.89 1nji s ILE 45 N -2.34 2.75 0.32 4.11 -1.09 -1.26 0.35 121.20 124.04 1nji s ILE 45 Ca 0.10 -0.73 0.08 0.00 -2.23 0.00 0.00 60.65 57.87 1nji s ILE 45 Cb -0.01 -2.18 -0.06 0.00 -1.58 0.00 0.00 42.46 38.63 1nji s ILE 45 CO -0.04 0.50 -0.05 -1.61 -1.23 0.00 0.00 174.94 172.51 1nji s GLU 46 N 0.98 1.71 -0.06 2.79 2.02 0.28 -4.91 118.70 121.52 1nji s GLU 46 Ca -0.02 -1.90 -0.20 0.00 0.02 0.00 0.00 54.97 52.87 1nji s GLU 46 Cb -0.15 -1.40 -0.04 0.00 0.10 0.00 0.00 34.13 32.64 1nji s GLU 46 CO -0.02 0.05 0.58 -1.58 0.02 0.00 0.00 175.26 174.31 1nji s HIS 47 N -2.85 3.60 -0.47 1.61 5.65 -1.26 0.17 115.29 121.75 1nji s HIS 47 Ca 0.32 1.11 -0.16 0.00 0.25 0.00 0.00 55.06 56.58 1nji s HIS 47 Cb 0.04 -2.64 0.07 0.00 -1.18 0.00 0.00 32.58 28.87 1nji s HIS 47 CO 0.15 0.22 0.41 0.34 -0.65 0.00 0.00 174.74 175.21 1nji s ASP 48 N 0.33 6.15 0.52 9.88 -1.08 -0.46 -4.86 116.67 127.15 1nji s ASP 48 Ca 0.31 -1.25 0.24 0.00 -0.52 0.00 0.00 52.55 51.33 1nji s ASP 48 Cb -0.17 -2.19 1.36 0.00 -1.46 0.00 0.00 42.92 40.46 1nji s ASP 48 CO 0.15 -0.65 2.00 -0.65 0.52 0.00 0.00 175.17 176.54 1nji h PRO 49 N 8.76 0.03 0.00 4.34 0.11 -1.90 -0.06 132.00 143.29 1nji h PRO 49 Ca -0.28 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 1nji h PRO 49 Cb 1.11 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.21 1nji h PRO 49 CO 0.87 0.02 0.00 0.00 -0.21 0.00 0.00 178.00 178.68 1nji h ALA 50 N 1.75 1.00 0.00 -0.75 0.00 -1.92 -3.37 119.26 115.96 1nji h ALA 50 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1nji h ALA 50 Cb 0.92 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.71 1nji h ALA 50 CO -0.01 0.00 0.00 0.54 0.00 0.00 0.00 179.25 179.78 1nji n ARG 51 N -2.73 0.32 -3.74 0.00 1.74 -0.52 -5.01 116.66 106.72 1nji n ARG 51 Ca 0.05 -0.22 -0.28 0.00 -0.77 0.00 0.00 57.85 56.62 1nji n ARG 51 Cb 0.47 -0.68 0.02 0.00 -1.02 0.00 0.00 32.46 31.26 1nji n ARG 51 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1nji n SER 52 N -0.11 -4.76 -3.86 0.55 7.64 -0.15 -4.76 113.62 108.18 1nji n SER 52 Ca 0.00 -0.67 -0.11 0.00 1.01 0.00 0.00 58.87 59.11 1nji n SER 52 Cb 0.09 -3.82 -0.09 0.00 -1.01 0.00 0.00 64.21 59.38 1nji n SER 52 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1nji s ALA 53 N -3.22 -0.36 0.81 -0.43 0.00 -1.24 -4.96 121.76 112.35 1nji s ALA 53 Ca 0.59 -0.19 -0.10 0.00 0.00 0.00 0.00 51.96 52.26 1nji s ALA 53 Cb -0.30 0.19 0.08 0.00 0.00 0.00 0.00 23.12 23.09 1nji s ALA 53 CO 0.73 -0.29 1.10 -1.25 0.00 0.00 0.00 175.76 176.05 1nji s PRO 54 N -1.98 1.96 -0.05 0.00 0.04 -1.26 -1.35 135.00 132.36 1nji s PRO 54 Ca -0.10 1.24 -0.10 0.00 0.04 0.00 0.00 61.00 62.08 1nji s PRO 54 Cb -0.04 -1.86 0.02 0.00 0.04 0.00 0.00 34.50 32.66 1nji s PRO 54 CO -0.01 -1.87 0.23 0.54 0.04 0.00 0.00 177.00 175.93 1nji s VAL 55 N -2.85 0.03 -0.17 -0.36 0.11 0.46 -4.30 120.40 113.32 1nji s VAL 55 Ca 0.62 -0.28 -0.09 0.00 -2.93 0.00 0.00 61.98 59.31 1nji s VAL 55 Cb -0.18 -0.43 -0.05 0.00 -1.53 0.00 0.00 36.38 34.19 1nji s VAL 55 CO 0.56 -0.15 0.12 0.00 -3.33 0.00 0.00 175.10 172.30 1nji s ALA 56 N -0.57 3.71 -0.22 1.54 0.00 -0.43 0.10 121.76 125.89 1nji s ALA 56 Ca -0.07 -0.68 -0.22 0.00 0.00 0.00 0.00 51.96 50.99 1nji s ALA 56 Cb -0.04 -2.06 -0.02 0.00 0.00 0.00 0.00 23.12 21.00 1nji s ALA 56 CO 0.01 0.32 0.71 0.00 0.00 0.00 0.00 175.76 176.81 1nji s ALA 57 N -0.11 3.59 -0.02 0.00 0.00 0.15 0.10 121.76 125.47 1nji s ALA 57 Ca 0.10 -0.24 0.07 0.00 0.00 0.00 0.00 51.96 51.89 1nji s ALA 57 Cb -0.11 -3.11 -0.02 0.00 0.00 0.00 0.00 23.12 19.88 1nji s ALA 57 CO 0.00 -0.73 -0.22 0.08 0.00 0.00 0.00 175.76 174.88 1nji s VAL 58 N 2.35 1.77 -0.27 0.00 1.01 -0.51 0.25 120.40 125.00 1nji s VAL 58 Ca 0.31 -0.96 -0.07 0.00 0.00 0.00 0.00 61.98 61.26 1nji s VAL 58 Cb -0.16 -1.47 -0.01 0.00 0.00 0.00 0.00 36.38 34.74 1nji s VAL 58 CO 0.09 0.50 0.07 -1.61 0.00 0.00 0.00 175.10 174.16 1nji s GLU 59 N -0.51 3.42 0.28 2.72 2.02 -0.32 -1.98 118.70 124.33 1nji s GLU 59 Ca 0.08 -0.63 -0.08 0.00 0.02 0.00 0.00 54.97 54.36 1nji s GLU 59 Cb -0.09 -3.34 -0.06 0.00 0.10 0.00 0.00 34.13 30.74 1nji s GLU 59 CO -0.01 -0.30 0.59 -0.06 0.02 0.00 0.00 175.26 175.50 1nji s PHE 60 N 1.57 3.45 0.29 1.61 0.40 0.15 -0.22 117.98 125.23 1nji s PHE 60 Ca 0.05 0.80 0.02 0.00 -0.60 0.00 0.00 56.93 57.20 1nji s PHE 60 Cb -0.16 -2.22 0.72 0.00 0.51 0.00 0.00 43.02 41.87 1nji s PHE 60 CO 0.03 0.17 1.62 0.93 0.70 0.00 0.00 175.22 178.67 1nji h GLU 61 N 1.96 0.12 -1.48 0.44 5.08 -1.46 -0.10 114.58 119.15 1nji h GLU 61 Ca -0.47 -0.01 -0.09 0.00 -1.00 0.00 0.00 59.36 57.79 1nji h GLU 61 Cb 1.18 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 30.36 1nji h GLU 61 CO 0.67 0.08 0.12 -0.40 -1.00 0.00 0.00 179.01 178.48 1nji n ASP 62 N -5.32 4.57 0.00 1.42 5.75 -1.26 -4.82 116.55 116.88 1nji n ASP 62 Ca 0.22 -2.45 0.00 0.00 -0.01 0.00 0.00 54.79 52.55 1nji n ASP 62 Cb 0.71 -0.86 0.00 0.00 -1.03 0.00 0.00 41.12 39.94 1nji n ASP 62 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1nji n GLY 63 N 0.75 2.71 3.71 6.12 0.00 -0.05 -4.99 105.19 113.43 1nji n GLY 63 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 1nji n GLY 63 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1nji s ASP 64 N -0.92 6.58 -0.27 1.61 1.01 -1.24 -4.71 116.67 118.73 1nji s ASP 64 Ca 0.00 2.59 -0.00 0.00 0.71 0.00 0.00 52.55 55.84 1nji s ASP 64 Cb 0.00 -2.58 0.04 0.00 1.01 0.00 0.00 42.92 41.39 1nji s ASP 64 CO 0.00 -0.85 -0.06 -0.60 0.21 0.00 0.00 175.17 173.87 1nji s ARG 65 N 1.63 2.56 0.03 8.23 6.06 -1.26 0.30 118.95 136.50 1nji s ARG 65 Ca 0.72 -1.16 -0.01 0.00 -2.50 0.00 0.00 55.73 52.77 1nji s ARG 65 Cb -0.43 -3.02 -0.03 0.00 0.06 0.00 0.00 34.95 31.54 1nji s ARG 65 CO 0.32 -0.51 -0.01 1.03 -2.50 0.00 0.00 175.30 173.62 1nji s ARG 66 N 1.25 0.46 0.40 5.12 0.52 -0.84 -4.99 118.95 120.88 1nji s ARG 66 Ca -0.04 -0.86 -0.17 0.00 -0.52 0.00 0.00 55.73 54.15 1nji s ARG 66 Cb -0.18 0.16 -0.09 0.00 0.52 0.00 0.00 34.95 35.36 1nji s ARG 66 CO -0.04 -0.09 0.85 -0.51 0.02 0.00 0.00 175.30 175.54 1nji s LEU 67 N -2.10 3.92 0.06 2.53 1.43 -1.26 -1.42 118.68 121.83 1nji s LEU 67 Ca -0.06 1.44 0.05 0.00 -1.03 0.00 0.00 54.13 54.53 1nji s LEU 67 Cb -0.02 -4.29 -0.03 0.00 0.03 0.00 0.00 46.19 41.88 1nji s LEU 67 CO -0.05 -0.35 -0.13 -0.63 0.23 0.00 0.00 176.35 175.42 1nji s ILE 68 N -2.21 1.03 -0.53 -0.59 1.01 0.29 -4.72 121.20 115.48 1nji s ILE 68 Ca 0.57 -1.16 -0.27 0.00 0.00 0.00 0.00 60.65 59.79 1nji s ILE 68 Cb -0.10 -0.98 -0.02 0.00 0.01 0.00 0.00 42.46 41.37 1nji s ILE 68 CO 0.20 -0.16 1.80 -0.22 0.00 0.00 0.00 174.94 176.56 1nji s LEU 69 N -1.50 3.37 -0.06 2.97 2.96 -1.26 -1.31 118.68 123.84 1nji s LEU 69 Ca -0.02 0.61 -0.30 0.00 -0.22 0.00 0.00 54.13 54.20 1nji s LEU 69 Cb -0.09 -2.85 -0.02 0.00 0.50 0.00 0.00 46.19 43.73 1nji s LEU 69 CO 0.02 -2.13 0.99 0.00 -1.32 0.00 0.00 176.35 173.90 1nji s ALA 70 N 8.21 3.31 0.69 5.97 0.00 -1.26 -4.91 121.76 133.77 1nji s ALA 70 Ca 0.69 0.43 -0.07 0.00 0.00 0.00 0.00 51.96 53.02 1nji s ALA 70 Cb -0.15 -3.39 0.05 0.00 0.00 0.00 0.00 23.12 19.63 1nji s ALA 70 CO 0.25 -0.45 1.00 -2.14 0.00 0.00 0.00 175.76 174.42 1nji s PRO 71 N 1.61 2.33 0.57 0.00 0.02 -1.26 -1.33 135.00 136.94 1nji s PRO 71 Ca 0.49 -0.18 -0.19 0.00 0.02 0.00 0.00 61.00 61.14 1nji s PRO 71 Cb -0.19 -2.17 -0.05 0.00 0.02 0.00 0.00 34.50 32.11 1nji s PRO 71 CO 0.22 -1.16 1.17 -2.00 -0.33 0.00 0.00 177.00 174.90 1nji s GLU 72 N -5.22 3.16 0.00 5.54 2.12 0.16 -3.70 118.70 120.76 1nji s GLU 72 Ca 0.59 1.72 0.00 0.00 0.36 0.00 0.00 54.97 57.64 1nji s GLU 72 Cb -0.11 -1.97 0.00 0.00 0.26 0.00 0.00 34.13 32.32 1nji s GLU 72 CO 0.45 -1.03 0.00 0.41 -0.54 0.00 0.00 175.26 174.55 1nji n GLY 73 N 0.33 0.58 3.69 -1.50 0.00 -1.26 -4.82 105.19 102.21 1nji n GLY 73 Ca 0.13 -0.40 -0.35 0.00 0.00 0.00 0.00 46.02 45.40 1nji n GLY 73 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nji s VAL 74 N -2.00 5.02 0.14 1.61 1.01 -1.24 -5.04 120.40 119.90 1nji s VAL 74 Ca 0.00 0.05 0.02 0.00 0.00 0.00 0.00 61.98 62.05 1nji s VAL 74 Cb 0.00 -3.25 -0.04 0.00 0.00 0.00 0.00 36.38 33.08 1nji s VAL 74 CO 0.00 0.48 -0.04 -0.83 0.00 0.00 0.00 175.10 174.71 1nji s GLY 75 N 0.13 1.01 0.19 4.51 0.00 -1.26 -5.05 107.32 106.86 1nji s GLY 75 Ca 0.06 -1.48 -0.32 0.00 0.00 0.00 0.00 44.72 42.99 1nji s GLY 75 CO 0.00 -1.50 1.16 -0.62 0.00 0.00 0.00 173.10 172.14 1nji n VAL 76 N -0.15 1.04 0.00 1.40 0.31 -1.26 -1.81 118.33 117.85 1nji n VAL 76 Ca -0.09 -0.26 0.00 0.00 -0.01 0.00 0.00 64.34 63.98 1nji n VAL 76 Cb 0.62 -0.92 0.00 0.00 -0.91 0.00 0.00 33.84 32.63 1nji n VAL 76 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1nji n GLY 77 N 1.93 2.96 3.51 2.92 0.00 -0.14 -4.99 105.19 111.39 1nji n GLY 77 Ca 0.14 -0.51 -0.39 0.00 0.00 0.00 0.00 46.02 45.26 1nji n GLY 77 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1nji n ASP 78 N 0.52 -0.46 -4.29 1.61 9.92 -0.75 -4.58 116.55 118.51 1nji n ASP 78 Ca 0.00 0.80 -0.35 0.00 -0.53 0.00 0.00 54.79 54.71 1nji n ASP 78 Cb 0.00 -1.22 -0.14 0.00 -0.64 0.00 0.00 41.12 39.12 1nji n ASP 78 CO 0.00 0.00 0.00 -0.70 0.13 0.00 0.00 177.20 176.63 1nji s GLU 79 N -2.14 3.22 0.10 -1.24 2.12 -1.26 -1.22 118.70 118.28 1nji s GLU 79 Ca 0.69 -0.73 0.02 0.00 0.36 0.00 0.00 54.97 55.31 1nji s GLU 79 Cb -0.47 -3.05 -0.04 0.00 0.26 0.00 0.00 34.13 30.84 1nji s GLU 79 CO 0.54 -0.27 0.17 -0.51 -0.54 0.00 0.00 175.26 174.65 1nji s LEU 80 N 1.45 4.09 0.07 2.70 1.43 -0.46 -4.94 118.68 123.02 1nji s LEU 80 Ca 0.04 0.10 0.05 0.00 -1.03 0.00 0.00 54.13 53.29 1nji s LEU 80 Cb -0.15 -2.71 -0.03 0.00 0.03 0.00 0.00 46.19 43.33 1nji s LEU 80 CO -0.03 0.13 -0.14 -1.10 0.23 0.00 0.00 176.35 175.44 1nji s GLN 81 N -2.73 0.80 -0.10 1.70 -0.21 -1.26 -1.32 119.66 116.53 1nji s GLN 81 Ca 0.32 -0.94 -0.02 0.00 0.02 0.00 0.00 55.36 54.74 1nji s GLN 81 Cb -0.12 -0.79 0.04 0.00 1.00 0.00 0.00 33.01 33.14 1nji s GLN 81 CO 0.26 0.18 0.04 0.08 -2.12 0.00 0.00 175.29 173.72 1nji s VAL 82 N -1.27 0.22 0.00 1.09 1.01 -0.28 -1.67 120.40 119.50 1nji s VAL 82 Ca -0.02 0.02 0.00 0.00 0.00 0.00 0.00 61.98 61.98 1nji s VAL 82 Cb -0.10 -0.54 0.00 0.00 0.00 0.00 0.00 36.38 35.74 1nji s VAL 82 CO 0.02 0.07 0.00 0.61 0.00 0.00 0.00 175.10 175.80 1nji n GLY 83 N 5.19 1.08 0.37 4.51 0.00 -0.80 -4.17 105.19 111.37 1nji n GLY 83 Ca -0.06 -1.20 0.02 0.00 0.00 0.00 0.00 46.02 44.78 1nji n GLY 83 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1nji h VAL 84 N 2.36 1.12 -0.44 1.61 2.07 -1.87 -2.27 116.25 118.82 1nji h VAL 84 Ca 0.00 -0.38 0.00 0.00 0.82 0.00 0.00 66.70 67.14 1nji h VAL 84 Cb 0.00 -0.07 0.00 0.00 -1.52 0.00 0.00 31.29 29.70 1nji h VAL 84 CO 0.00 0.20 0.00 0.47 0.02 0.00 0.00 177.57 178.26 1nji n ASP 85 N -4.46 4.25 -4.77 0.57 8.00 -1.26 -4.90 116.55 113.97 1nji n ASP 85 Ca 0.13 -2.58 -0.40 0.00 0.71 0.00 0.00 54.79 52.66 1nji n ASP 85 Cb 0.14 -0.59 0.00 0.00 -0.02 0.00 0.00 41.12 40.65 1nji n ASP 85 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1nji s ALA 86 N -2.13 3.24 1.01 2.24 0.00 -0.86 -4.97 121.76 120.29 1nji s ALA 86 Ca 0.40 1.31 -0.11 0.00 0.00 0.00 0.00 51.96 53.56 1nji s ALA 86 Cb 0.29 -3.52 0.20 0.00 0.00 0.00 0.00 23.12 20.08 1nji s ALA 86 CO 0.14 -0.96 1.10 -2.00 0.00 0.00 0.00 175.76 174.04 1nji s GLU 87 N -2.33 0.27 -1.06 0.00 2.12 -1.26 -4.91 118.70 111.53 1nji s GLU 87 Ca 0.59 1.25 -0.03 0.00 0.36 0.00 0.00 54.97 57.13 1nji s GLU 87 Cb -0.40 -1.66 0.31 0.00 0.26 0.00 0.00 34.13 32.64 1nji s GLU 87 CO 0.51 -3.04 1.52 -0.89 -0.54 0.00 0.00 175.26 172.82 1nji n ILE 88 N -4.49 5.39 -4.36 -3.70 5.41 -1.26 -4.89 119.36 111.47 1nji n ILE 88 Ca 0.08 -5.94 -0.19 0.00 1.00 0.00 0.00 62.75 57.70 1nji n ILE 88 Cb 0.53 -1.99 -0.10 0.00 -0.71 0.00 0.00 39.64 37.37 1nji n ILE 88 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1nji s ALA 89 N -3.05 2.10 0.49 -1.39 0.00 -1.26 -5.10 121.76 113.55 1nji s ALA 89 Ca 0.33 -1.69 -0.23 0.00 0.00 0.00 0.00 51.96 50.37 1nji s ALA 89 Cb 0.08 -0.09 -0.07 0.00 0.00 0.00 0.00 23.12 23.03 1nji s ALA 89 CO 0.07 0.08 1.23 -2.30 0.00 0.00 0.00 175.76 174.84 1nji n PRO 90 N -0.41 1.63 0.00 0.00 -0.02 -1.26 -2.33 135.00 132.61 1nji n PRO 90 Ca -0.08 0.59 0.00 0.00 -2.02 0.00 0.00 63.50 62.00 1nji n PRO 90 Cb 0.60 -2.38 0.00 0.00 -0.02 0.00 0.00 33.50 31.70 1nji n PRO 90 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1nji n GLY 91 N 0.91 1.88 3.89 -1.23 0.00 -0.62 -4.97 105.19 105.04 1nji n GLY 91 Ca 0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.79 1nji n GLY 91 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1nji s ASN 92 N -2.10 6.50 -0.09 1.61 -0.87 -0.98 -4.63 114.94 114.38 1nji s ASN 92 Ca 0.00 0.60 0.03 0.00 -1.57 0.00 0.00 52.86 51.93 1nji s ASN 92 Cb 0.00 -2.10 -0.01 0.00 -0.02 0.00 0.00 41.25 39.12 1nji s ASN 92 CO 0.00 0.07 -0.20 -0.89 -2.57 0.00 0.00 177.10 173.51 1nji s THR 93 N -1.62 2.42 0.11 1.60 2.01 -0.67 -1.07 115.64 118.42 1nji s THR 93 Ca 0.40 -0.91 -0.25 0.00 0.31 0.00 0.00 61.69 61.24 1nji s THR 93 Cb -0.12 -1.94 0.07 0.00 0.01 0.00 0.00 72.50 70.52 1nji s THR 93 CO 0.24 0.56 0.64 -1.48 -0.69 0.00 0.00 174.62 173.88 1nji s LEU 94 N 0.09 -0.57 0.40 4.42 2.34 -0.50 -1.90 118.68 122.97 1nji s LEU 94 Ca -0.09 0.13 -0.26 0.00 0.06 0.00 0.00 54.13 53.97 1nji s LEU 94 Cb -0.15 2.55 -0.10 0.00 -0.56 0.00 0.00 46.19 47.92 1nji s LEU 94 CO 0.06 -0.88 1.21 -0.81 -1.06 0.00 0.00 176.35 174.87 1nji n PRO 95 N -0.14 1.82 -0.07 1.48 -0.04 -1.26 -1.89 135.00 134.90 1nji n PRO 95 Ca -0.17 0.65 0.25 0.00 -0.04 0.00 0.00 63.50 64.19 1nji n PRO 95 Cb 0.63 -2.29 0.64 0.00 -0.04 0.00 0.00 33.50 32.45 1nji n PRO 95 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1nji h LEU 96 N 2.04 0.00 -0.32 1.53 3.38 -0.64 0.40 115.31 121.69 1nji h LEU 96 Ca -0.47 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.43 1nji h LEU 96 Cb 1.30 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.04 1nji h LEU 96 CO 0.60 0.00 -0.08 0.00 0.09 0.00 0.00 178.44 179.04 1nji h ALA 97 N 1.13 0.45 0.00 1.53 0.00 -1.61 -2.80 119.26 117.95 1nji h ALA 97 Ca 0.35 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1nji h ALA 97 Cb 1.90 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.58 1nji h ALA 97 CO -0.00 0.28 0.00 0.39 0.00 0.00 0.00 179.25 179.92 1nji n GLU 98 N -4.44 0.30 -3.24 0.00 -0.58 0.12 -4.78 120.64 108.02 1nji n GLU 98 Ca -0.03 0.06 -0.39 0.00 -0.42 0.00 0.00 57.16 56.39 1nji n GLU 98 Cb 0.33 -1.50 -0.06 0.00 -0.57 0.00 0.00 31.44 29.65 1nji n GLU 98 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 1nji s ILE 99 N -2.63 5.05 0.20 -3.67 -1.09 -1.06 -5.03 121.20 112.97 1nji s ILE 99 Ca 0.22 1.14 -0.30 0.00 -2.23 0.00 0.00 60.65 59.47 1nji s ILE 99 Cb 0.16 -3.89 -0.09 0.00 -1.58 0.00 0.00 42.46 37.07 1nji s ILE 99 CO 0.38 0.37 1.31 -2.16 -1.23 0.00 0.00 174.94 173.61 1nji s PRO 100 N 0.23 4.39 0.64 2.79 0.04 -1.26 -4.96 135.00 136.86 1nji s PRO 100 Ca 0.30 2.06 -0.18 0.00 0.04 0.00 0.00 61.00 63.21 1nji s PRO 100 Cb -0.17 -3.19 -0.02 0.00 0.04 0.00 0.00 34.50 31.16 1nji s PRO 100 CO 0.14 -0.25 1.16 0.39 0.04 0.00 0.00 177.00 178.48 1nji n GLU 101 N 2.60 1.00 -0.55 4.56 1.02 -1.26 -2.70 120.64 125.31 1nji n GLU 101 Ca 0.06 0.39 0.00 0.00 -0.02 0.00 0.00 57.16 57.59 1nji n GLU 101 Cb 0.43 -2.39 0.00 0.00 -0.02 0.00 0.00 31.44 29.46 1nji n GLU 101 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1nji n GLY 102 N 1.07 0.76 3.70 0.62 0.00 0.09 -5.02 105.19 106.41 1nji n GLY 102 Ca 0.15 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.82 1nji n GLY 102 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nji s VAL 103 N -2.80 4.99 0.28 1.61 1.01 -1.10 -4.95 120.40 119.44 1nji s VAL 103 Ca 0.00 0.03 -0.29 0.00 0.00 0.00 0.00 61.98 61.72 1nji s VAL 103 Cb 0.00 -3.23 -0.10 0.00 0.00 0.00 0.00 36.38 33.05 1nji s VAL 103 CO 0.00 0.50 1.38 -2.84 0.00 0.00 0.00 175.10 174.14 1nji s PRO 104 N 0.02 4.30 0.05 2.72 0.02 -1.26 -3.42 135.00 137.43 1nji s PRO 104 Ca 0.07 2.26 -0.00 0.00 0.02 0.00 0.00 61.00 63.35 1nji s PRO 104 Cb -0.12 -3.09 -0.04 0.00 0.02 0.00 0.00 34.50 31.27 1nji s PRO 104 CO 0.00 -0.33 -0.04 0.08 -0.33 0.00 0.00 177.00 176.39 1nji s VAL 105 N -0.48 0.26 0.22 3.83 1.01 -0.46 -1.52 120.40 123.27 1nji s VAL 105 Ca 0.55 -1.59 -0.02 0.00 0.00 0.00 0.00 61.98 60.92 1nji s VAL 105 Cb -0.41 -1.22 -0.03 0.00 0.00 0.00 0.00 36.38 34.72 1nji s VAL 105 CO 0.47 -0.85 0.20 0.00 0.00 0.00 0.00 175.10 174.93 1nji n ASN 107 N -0.45 -5.18 -4.78 0.00 5.15 0.43 -1.19 115.26 109.23 1nji n ASN 107 Ca 0.02 -1.05 -0.39 0.00 -0.60 0.00 0.00 54.58 52.56 1nji n ASN 107 Cb 0.65 -3.09 -0.06 0.00 -0.53 0.00 0.00 39.78 36.75 1nji n ASN 107 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1nji s VAL 108 N -3.46 4.61 0.40 3.44 1.01 -0.26 -4.10 120.40 122.04 1nji s VAL 108 Ca 0.47 1.46 -0.23 0.00 0.00 0.00 0.00 61.98 63.69 1nji s VAL 108 Cb -0.18 -4.02 -0.11 0.00 0.00 0.00 0.00 36.38 32.07 1nji s VAL 108 CO 0.88 0.50 0.95 -1.61 0.00 0.00 0.00 175.10 175.83 1nji s GLU 109 N -0.88 4.31 -0.00 2.72 2.02 -0.90 0.12 118.70 126.09 1nji s GLU 109 Ca 0.33 1.20 -0.09 0.00 0.02 0.00 0.00 54.97 56.43 1nji s GLU 109 Cb -0.21 -2.36 -0.31 0.00 0.10 0.00 0.00 34.13 31.35 1nji s GLU 109 CO 0.22 0.04 0.84 1.03 0.02 0.00 0.00 175.26 177.41 1nji h SER 110 N 2.27 0.59 -3.68 -0.19 0.87 -1.92 -3.45 113.55 108.04 1nji h SER 110 Ca -0.48 -0.77 -0.23 0.00 -1.23 0.00 0.00 61.79 59.08 1nji h SER 110 Cb 1.19 -0.19 -0.29 0.00 -0.44 0.00 0.00 62.40 62.66 1nji h SER 110 CO 0.62 1.63 -0.65 -0.94 -0.53 0.00 0.00 176.83 176.96 1nji s SER 111 N -7.26 -0.05 -0.35 6.23 1.04 -1.26 -4.77 113.70 107.28 1nji s SER 111 Ca -0.11 0.14 -0.32 0.00 0.48 0.00 0.00 55.95 56.14 1nji s SER 111 Cb 0.06 0.11 -0.14 0.00 0.10 0.00 0.00 66.02 66.15 1nji s SER 111 CO 0.88 -0.05 1.25 -0.81 0.98 0.00 0.00 173.24 175.49 1nji n PRO 112 N 3.36 0.00 -0.15 4.02 -0.04 -1.26 -1.61 135.00 139.32 1nji n PRO 112 Ca -0.16 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.30 1nji n PRO 112 Cb 0.57 -1.04 0.00 0.00 -0.04 0.00 0.00 33.50 32.99 1nji n PRO 112 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1nji n GLY 113 N 3.67 0.82 0.00 0.55 0.00 -1.26 -4.92 105.19 104.05 1nji n GLY 113 Ca 0.28 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.37 1nji n GLY 113 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1nji n ASP 114 N 0.00 0.00 0.00 1.61 5.68 -0.63 -4.84 116.55 118.36 1nji n ASP 114 Ca 0.00 -0.81 0.00 0.00 -0.50 0.00 0.00 54.79 53.48 1nji n ASP 114 Cb 0.00 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 39.98 1nji n ASP 114 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1nji n GLY 115 N 0.20 0.55 0.02 6.12 0.00 -1.26 -4.84 105.19 105.97 1nji n GLY 115 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1nji n GLY 115 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nji n GLY 116 N -2.91 0.71 0.83 -0.02 0.00 -1.26 -2.27 105.19 100.27 1nji n GLY 116 Ca 0.00 -1.28 0.00 0.00 0.00 0.00 0.00 46.02 44.74 1nji n GLY 116 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1nji n LYS 117 N 2.35 0.00 -3.07 1.61 4.76 0.34 -4.85 118.16 119.30 1nji n LYS 117 Ca 0.00 0.00 -0.28 0.00 -2.87 0.00 0.00 58.31 55.16 1nji n LYS 117 Cb 0.00 -0.51 -0.02 0.00 -1.84 0.00 0.00 35.03 32.65 1nji n LYS 117 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 1nji s PHE 118 N -1.85 3.49 -0.19 2.13 0.40 -0.27 -4.71 117.98 116.99 1nji s PHE 118 Ca 0.00 0.77 -0.09 0.00 -0.60 0.00 0.00 56.93 57.01 1nji s PHE 118 Cb 0.00 -2.22 0.01 0.00 0.51 0.00 0.00 43.02 41.32 1nji s PHE 118 CO 0.00 0.00 0.18 0.00 0.70 0.00 0.00 175.22 176.10 1nji n ALA 119 N -1.36 -2.45 -0.67 5.36 0.00 -1.26 -1.11 120.51 119.01 1nji n ALA 119 Ca -0.00 0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.70 1nji n ALA 119 Cb 0.54 -1.21 0.00 0.00 0.00 0.00 0.00 19.45 18.79 1nji n ALA 119 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1nji n ARG 120 N 0.75 0.00 -1.99 0.00 1.74 -1.26 0.16 116.66 116.07 1nji n ARG 120 Ca -0.01 0.00 -0.28 0.00 -0.77 0.00 0.00 57.85 56.79 1nji n ARG 120 Cb 0.43 -0.27 0.08 0.00 -1.02 0.00 0.00 32.46 31.68 1nji n ARG 120 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1nji s ALA 121 N 0.00 2.82 -0.13 7.54 0.00 -1.26 -4.95 121.76 125.78 1nji s ALA 121 Ca 0.00 -0.69 -0.38 0.00 0.00 0.00 0.00 51.96 50.89 1nji s ALA 121 Cb 0.00 -2.87 -0.16 0.00 0.00 0.00 0.00 23.12 20.10 1nji s ALA 121 CO 0.00 -1.50 1.62 0.43 0.00 0.00 0.00 175.76 176.31 1nji n SER 122 N -3.16 2.24 0.00 0.00 7.64 -1.26 -2.70 113.62 116.37 1nji n SER 122 Ca 0.08 1.08 0.00 0.00 1.01 0.00 0.00 58.87 61.04 1nji n SER 122 Cb 0.60 -1.18 0.00 0.00 -1.01 0.00 0.00 64.21 62.62 1nji n SER 122 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1nji n GLY 123 N 3.63 0.00 3.96 0.23 0.00 -0.72 -4.59 105.19 107.71 1nji n GLY 123 Ca 0.23 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.01 1nji n GLY 123 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1nji s VAL 124 N -0.94 2.25 -0.13 1.61 -7.23 -1.10 -4.63 120.40 110.24 1nji s VAL 124 Ca 0.00 -0.44 -0.30 0.00 -1.81 0.00 0.00 61.98 59.42 1nji s VAL 124 Cb 0.00 -2.81 0.13 0.00 0.56 0.00 0.00 36.38 34.25 1nji s VAL 124 CO 0.00 0.00 1.02 0.54 -0.31 0.00 0.00 175.10 176.35 1nji s ASN 125 N -4.64 -0.31 0.46 4.85 2.20 -1.26 -1.48 114.94 114.75 1nji s ASN 125 Ca 0.64 0.20 0.05 0.00 -0.94 0.00 0.00 52.86 52.81 1nji s ASN 125 Cb -0.07 0.29 0.01 0.00 -2.00 0.00 0.00 41.25 39.48 1nji s ASN 125 CO 0.44 -0.39 0.63 0.00 -2.94 0.00 0.00 177.10 174.85 1nji s ALA 126 N -1.88 4.23 -0.20 3.54 0.00 0.58 -3.90 121.76 124.13 1nji s ALA 126 Ca 0.02 -1.49 -0.01 0.00 0.00 0.00 0.00 51.96 50.49 1nji s ALA 126 Cb -0.01 -1.82 0.06 0.00 0.00 0.00 0.00 23.12 21.35 1nji s ALA 126 CO -0.03 -0.42 -0.01 -1.14 0.00 0.00 0.00 175.76 174.17 1nji s GLN 127 N -4.48 1.09 -0.20 0.00 2.00 -0.36 -1.36 119.66 116.35 1nji s GLN 127 Ca 0.54 -0.64 -0.29 0.00 -2.00 0.00 0.00 55.36 52.97 1nji s GLN 127 Cb -0.10 -2.26 -0.01 0.00 0.80 0.00 0.00 33.01 31.44 1nji s GLN 127 CO 0.35 -0.60 1.26 -1.17 -0.50 0.00 0.00 175.29 174.64 1nji s LEU 128 N 1.66 4.09 -0.07 3.68 2.96 -1.22 -0.82 118.68 128.97 1nji s LEU 128 Ca -0.03 1.55 -0.08 0.00 -0.22 0.00 0.00 54.13 55.35 1nji s LEU 128 Cb -0.17 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 42.95 1nji s LEU 128 CO -0.07 -0.85 -0.15 0.18 -1.32 0.00 0.00 176.35 174.14 1nji n LEU 129 N 6.88 0.98 -4.69 -0.68 4.77 -0.38 -0.73 117.00 123.15 1nji n LEU 129 Ca 0.14 0.16 -0.31 0.00 -0.03 0.00 0.00 56.01 55.97 1nji n LEU 129 Cb 0.45 -0.54 -0.08 0.00 -2.33 0.00 0.00 43.42 40.92 1nji n LEU 129 CO 0.58 -0.43 -0.33 -0.89 -1.33 0.00 0.00 177.39 174.99 1nji s THR 130 N -1.95 4.09 0.00 -5.08 2.01 -1.14 -4.50 115.64 109.08 1nji s THR 130 Ca -0.13 -0.86 0.00 0.00 0.31 0.00 0.00 61.69 61.01 1nji s THR 130 Cb 0.02 -2.92 0.00 0.00 0.01 0.00 0.00 72.50 69.61 1nji s THR 130 CO 0.19 0.19 0.00 1.41 -0.69 0.00 0.00 174.62 175.72 1nji n HIS 131 N 0.79 -1.10 0.00 4.92 8.25 -1.26 -1.58 115.22 125.24 1nji n HIS 131 Ca -0.12 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.34 1nji n HIS 131 Cb 0.52 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.63 1nji n HIS 131 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 1nji n ASP 132 N -1.63 0.00 0.04 0.41 -0.08 -1.20 -4.75 116.55 109.34 1nji n ASP 132 Ca 0.00 0.00 0.11 0.00 -1.51 0.00 0.00 54.79 53.39 1nji n ASP 132 Cb 0.00 0.00 0.02 0.00 2.34 0.00 0.00 41.12 43.48 1nji n ASP 132 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 1nji n ARG 133 N -1.00 0.38 -0.03 -0.67 1.74 -1.26 -4.50 116.66 111.32 1nji n ARG 133 Ca 0.00 0.01 -0.04 0.00 -0.77 0.00 0.00 57.85 57.05 1nji n ARG 133 Cb 0.00 -1.64 -0.03 0.00 -1.02 0.00 0.00 32.46 29.77 1nji n ARG 133 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1nji n ASN 134 N -2.14 3.21 -4.07 0.55 3.02 -1.26 -4.92 115.26 109.65 1nji n ASN 134 Ca 0.01 -0.02 -0.22 0.00 -0.03 0.00 0.00 54.58 54.32 1nji n ASN 134 Cb 0.47 -0.10 -0.15 0.00 -0.61 0.00 0.00 39.78 39.38 1nji n ASN 134 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1nji s VAL 135 N -2.12 1.02 -0.28 2.41 0.11 -1.26 -4.37 120.40 115.92 1nji s VAL 135 Ca -0.08 -0.52 -0.04 0.00 -2.93 0.00 0.00 61.98 58.41 1nji s VAL 135 Cb 0.02 -0.88 0.02 0.00 -1.53 0.00 0.00 36.38 34.02 1nji s VAL 135 CO 0.14 0.30 0.01 0.00 -3.33 0.00 0.00 175.10 172.22 1nji s ALA 136 N -0.07 2.88 -0.35 1.54 0.00 0.11 -3.22 121.76 122.65 1nji s ALA 136 Ca 0.01 -1.52 -0.20 0.00 0.00 0.00 0.00 51.96 50.25 1nji s ALA 136 Cb -0.07 -1.94 0.00 0.00 0.00 0.00 0.00 23.12 21.10 1nji s ALA 136 CO 0.00 -0.96 0.62 0.08 0.00 0.00 0.00 175.76 175.51 1nji s VAL 137 N 1.39 4.91 -0.07 0.00 1.01 -0.61 -0.13 120.40 126.89 1nji s VAL 137 Ca 0.00 0.59 0.03 0.00 0.00 0.00 0.00 61.98 62.60 1nji s VAL 137 Cb -0.17 -4.05 -0.02 0.00 0.00 0.00 0.00 36.38 32.13 1nji s VAL 137 CO -0.01 -0.28 -0.16 -0.69 0.00 0.00 0.00 175.10 173.96 1nji s VAL 138 N 2.66 2.89 -0.41 2.92 1.01 0.34 -1.25 120.40 128.57 1nji s VAL 138 Ca 0.24 -0.76 -0.16 0.00 0.00 0.00 0.00 61.98 61.30 1nji s VAL 138 Cb -0.15 -2.14 0.02 0.00 0.00 0.00 0.00 36.38 34.11 1nji s VAL 138 CO 0.14 0.57 0.35 -0.75 0.00 0.00 0.00 175.10 175.41 1nji s LYS 139 N -0.34 3.08 0.71 2.72 2.20 -0.00 0.10 119.74 128.21 1nji s LYS 139 Ca 0.03 -0.87 -0.11 0.00 -0.36 0.00 0.00 55.97 54.67 1nji s LYS 139 Cb -0.13 -3.95 0.01 0.00 -1.51 0.00 0.00 37.83 32.25 1nji s LYS 139 CO 0.02 -0.76 1.06 -0.51 -0.36 0.00 0.00 175.35 174.81 1nji s LEU 140 N 1.87 3.11 0.64 5.43 1.43 -0.01 -1.22 118.68 129.93 1nji s LEU 140 Ca 0.08 1.63 0.29 0.00 -1.03 0.00 0.00 54.13 55.10 1nji s LEU 140 Cb -0.18 -4.48 1.55 0.00 0.03 0.00 0.00 46.19 43.11 1nji s LEU 140 CO 0.11 -1.51 1.90 1.55 0.23 0.00 0.00 176.35 178.63 1nji h PRO 141 N -0.77 0.00 0.00 1.29 0.13 -1.90 0.48 132.00 131.23 1nji h PRO 141 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1nji h PRO 141 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1nji h PRO 141 CO 0.56 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.20 1nji n SER 142 N -3.17 0.70 0.00 1.44 3.41 -1.26 -4.88 113.62 109.87 1nji n SER 142 Ca 0.01 0.60 0.00 0.00 -0.26 0.00 0.00 58.87 59.22 1nji n SER 142 Cb 0.48 -0.78 0.00 0.00 -0.26 0.00 0.00 64.21 63.65 1nji n SER 142 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1nji n GLY 143 N 0.86 0.39 3.77 5.00 0.00 0.17 -5.08 105.19 110.30 1nji n GLY 143 Ca 0.04 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.68 1nji n GLY 143 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1nji s GLU 144 N -0.77 4.16 -0.41 1.61 2.12 -1.24 -4.74 118.70 119.42 1nji s GLU 144 Ca 0.00 1.75 -0.21 0.00 0.36 0.00 0.00 54.97 56.87 1nji s GLU 144 Cb 0.00 -2.71 0.02 0.00 0.26 0.00 0.00 34.13 31.70 1nji s GLU 144 CO 0.00 -0.20 0.69 -1.64 -0.54 0.00 0.00 175.26 173.57 1nji s MET 145 N -2.23 3.45 -0.17 4.30 -1.94 -1.26 -0.83 119.30 120.62 1nji s MET 145 Ca 0.56 -0.14 -0.06 0.00 -1.71 0.00 0.00 55.69 54.33 1nji s MET 145 Cb -0.29 -3.90 -0.04 0.00 2.01 0.00 0.00 34.83 32.62 1nji s MET 145 CO 0.36 -0.96 0.04 0.21 -0.01 0.00 0.00 175.02 174.66 1nji s LYS 146 N 2.95 3.89 -0.31 2.03 2.47 0.28 -4.94 119.74 126.10 1nji s LYS 146 Ca 0.26 -0.38 -0.19 0.00 -1.56 0.00 0.00 55.97 54.09 1nji s LYS 146 Cb -0.14 -3.13 -0.01 0.00 -1.46 0.00 0.00 37.83 33.09 1nji s LYS 146 CO 0.19 0.28 0.57 1.03 0.16 0.00 0.00 175.35 177.58 1nji s ARG 147 N 0.33 3.85 0.13 4.03 0.52 -1.26 -0.50 118.95 126.05 1nji s ARG 147 Ca 0.01 0.16 0.08 0.00 -0.52 0.00 0.00 55.73 55.46 1nji s ARG 147 Cb -0.13 -3.74 -0.04 0.00 0.52 0.00 0.00 34.95 31.57 1nji s ARG 147 CO 0.01 -0.55 -0.18 -0.51 0.02 0.00 0.00 175.30 174.09 1nji s LEU 148 N 2.49 2.39 0.12 2.53 1.43 0.81 -4.92 118.68 123.52 1nji s LEU 148 Ca 0.22 -0.80 -0.31 0.00 -1.03 0.00 0.00 54.13 52.22 1nji s LEU 148 Cb -0.15 -0.75 -0.10 0.00 0.03 0.00 0.00 46.19 45.22 1nji s LEU 148 CO 0.12 -0.04 1.76 -0.62 0.23 0.00 0.00 176.35 177.79 1nji s ASP 149 N -2.39 6.48 0.27 2.29 -1.08 -1.26 0.08 116.67 121.06 1nji s ASP 149 Ca 0.11 2.69 0.16 0.00 -0.52 0.00 0.00 52.55 54.99 1nji s ASP 149 Cb -0.07 -2.57 0.86 0.00 -1.46 0.00 0.00 42.92 39.69 1nji s ASP 149 CO 0.05 -0.96 1.45 -0.81 0.52 0.00 0.00 175.17 175.42 1nji n PRO 150 N 5.37 0.10 0.01 4.34 -0.04 -1.26 -0.47 135.00 143.05 1nji n PRO 150 Ca 0.17 0.59 0.13 0.00 -0.04 0.00 0.00 63.50 64.35 1nji n PRO 150 Cb 0.38 -1.94 0.59 0.00 -0.04 0.00 0.00 33.50 32.49 1nji n PRO 150 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 1nji n GLN 151 N -2.07 0.01 -2.10 0.54 -0.06 -1.26 -1.68 117.38 110.76 1nji n GLN 151 Ca -0.01 0.03 -0.42 0.00 -2.00 0.00 0.00 57.00 54.60 1nji n GLN 151 Cb 0.12 -1.52 -0.03 0.00 -4.06 0.00 0.00 30.24 24.76 1nji n GLN 151 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1nji s ARG 153 N 3.28 3.42 0.27 0.00 0.52 -1.26 -0.89 118.95 124.28 1nji s ARG 153 Ca 0.69 1.21 -0.16 0.00 -0.52 0.00 0.00 55.73 56.95 1nji s ARG 153 Cb -0.33 -2.05 0.01 0.00 0.52 0.00 0.00 34.95 33.11 1nji s ARG 153 CO 0.28 -0.73 0.59 0.00 0.02 0.00 0.00 175.30 175.45 1nji s ALA 154 N -2.40 -0.65 -0.09 2.13 0.00 -0.79 -2.13 121.76 117.82 1nji s ALA 154 Ca 0.64 -0.64 0.02 0.00 0.00 0.00 0.00 51.96 51.98 1nji s ALA 154 Cb -0.16 0.97 -0.02 0.00 0.00 0.00 0.00 23.12 23.91 1nji s ALA 154 CO 0.34 -0.94 -0.16 0.99 0.00 0.00 0.00 175.76 175.99 1nji s THR 155 N -3.92 2.80 0.18 0.00 2.01 -0.34 -1.42 115.64 114.96 1nji s THR 155 Ca 0.18 -0.78 -0.30 0.00 0.31 0.00 0.00 61.69 61.10 1nji s THR 155 Cb -0.03 -2.12 -0.08 0.00 0.01 0.00 0.00 72.50 70.28 1nji s THR 155 CO 0.08 0.55 1.23 -0.63 -0.69 0.00 0.00 174.62 175.17 1nji s ILE 156 N -0.04 3.50 0.00 1.82 1.01 -0.23 -0.72 121.20 126.53 1nji s ILE 156 Ca -0.04 1.24 0.00 0.00 0.00 0.00 0.00 60.65 61.84 1nji s ILE 156 Cb -0.14 -3.79 0.00 0.00 0.01 0.00 0.00 42.46 38.54 1nji s ILE 156 CO 0.04 0.19 0.00 0.61 0.00 0.00 0.00 174.94 175.78 1nji n GLY 157 N 2.32 1.49 3.94 6.18 0.00 -0.57 -1.59 105.19 116.96 1nji n GLY 157 Ca 0.05 -2.11 -0.25 0.00 0.00 0.00 0.00 46.02 43.71 1nji n GLY 157 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1nji s VAL 158 N -1.70 5.24 0.46 1.61 -7.23 -1.26 -2.98 120.40 114.54 1nji s VAL 158 Ca 0.00 -0.60 -0.24 0.00 -1.81 0.00 0.00 61.98 59.33 1nji s VAL 158 Cb 0.00 -3.78 -0.07 0.00 0.56 0.00 0.00 36.38 33.09 1nji s VAL 158 CO 0.00 -0.22 1.28 -0.69 -0.31 0.00 0.00 175.10 175.16 1nji s VAL 159 N -1.90 2.60 1.12 1.32 1.01 -0.55 0.40 120.40 124.40 1nji s VAL 159 Ca 0.36 0.49 -0.13 0.00 0.00 0.00 0.00 61.98 62.71 1nji s VAL 159 Cb -0.10 -3.27 0.26 0.00 0.00 0.00 0.00 36.38 33.27 1nji s VAL 159 CO 0.30 0.03 1.05 -0.83 0.00 0.00 0.00 175.10 175.64 1nji s GLY 160 N -0.96 1.54 -0.05 4.51 0.00 -0.44 -2.21 107.32 109.71 1nji s GLY 160 Ca 0.63 -0.24 0.00 0.00 0.00 0.00 0.00 44.72 45.10 1nji s GLY 160 CO 0.45 0.45 0.00 0.61 0.00 0.00 0.00 173.10 174.61 1nji n GLY 161 N 0.15 0.47 3.47 0.20 0.00 -1.26 -1.75 105.19 106.46 1nji n GLY 161 Ca 0.03 -0.19 -0.38 0.00 0.00 0.00 0.00 46.02 45.48 1nji n GLY 161 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nji n GLY 162 N -2.60 -1.50 2.23 -0.02 0.00 -1.26 -3.04 105.19 99.01 1nji n GLY 162 Ca -0.00 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.85 1nji n GLY 162 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nji n GLY 163 N 1.79 0.87 0.36 -0.02 0.00 -1.26 -4.88 105.19 102.04 1nji n GLY 163 Ca 0.12 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.24 1nji n GLY 163 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1nji h ARG 164 N 3.51 0.83 0.00 1.61 2.43 -1.89 0.04 114.38 120.91 1nji h ARG 164 Ca 0.00 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.11 1nji h ARG 164 Cb 0.00 -0.19 -0.00 0.00 -0.42 0.00 0.00 29.97 29.36 1nji h ARG 164 CO 0.00 0.55 -0.03 1.15 -1.51 0.00 0.00 179.97 180.13 1nji h THR 165 N 0.85 0.12 -0.38 0.20 2.02 -1.92 -3.23 112.91 110.57 1nji h THR 165 Ca 0.54 -0.41 0.05 0.00 0.77 0.00 0.00 66.41 67.37 1nji h THR 165 Cb 0.72 1.36 -0.02 0.00 -1.74 0.00 0.00 68.15 68.47 1nji h THR 165 CO -0.33 0.03 0.26 0.44 0.37 0.00 0.00 175.52 176.28 1nji h ASP 166 N 0.00 0.26 -3.38 4.18 3.32 -1.39 -3.42 116.42 116.00 1nji h ASP 166 Ca -0.00 -0.00 -0.59 0.00 0.02 0.00 0.00 57.03 56.46 1nji h ASP 166 Cb 0.35 -0.06 -0.09 0.00 0.22 0.00 0.00 39.33 39.75 1nji h ASP 166 CO 0.00 0.17 -0.15 -0.75 -1.72 0.00 0.00 179.24 176.80 1nji s LYS 167 N -5.30 4.27 0.70 3.56 2.20 -1.22 -5.06 119.74 118.88 1nji s LYS 167 Ca -0.07 0.36 -0.14 0.00 -0.36 0.00 0.00 55.97 55.76 1nji s LYS 167 Cb 0.18 -3.48 0.02 0.00 -1.51 0.00 0.00 37.83 33.04 1nji s LYS 167 CO 0.72 0.06 1.12 -1.25 -0.36 0.00 0.00 175.35 175.64 1nji s PRO 168 N 0.96 2.55 0.42 4.03 0.04 -1.26 -4.91 135.00 136.84 1nji s PRO 168 Ca 0.23 1.41 0.23 0.00 0.04 0.00 0.00 61.00 62.91 1nji s PRO 168 Cb -0.15 -1.92 0.71 0.00 0.04 0.00 0.00 34.50 33.18 1nji s PRO 168 CO 0.09 -1.45 1.73 0.74 0.04 0.00 0.00 177.00 178.16 1nji h PHE 169 N -0.28 0.00 0.00 0.56 -1.00 -1.97 -3.46 116.94 110.79 1nji h PHE 169 Ca -0.46 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.32 1nji h PHE 169 Cb 1.25 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.81 1nji h PHE 169 CO 0.54 0.22 0.00 0.28 -1.61 0.00 0.00 178.31 177.74 1nji n VAL 170 N -3.27 0.00 -4.31 -0.55 0.31 -1.26 -4.65 118.33 104.60 1nji n VAL 170 Ca 0.01 0.00 -0.19 0.00 -0.01 0.00 0.00 64.34 64.15 1nji n VAL 170 Cb 0.49 0.00 -0.13 0.00 -0.91 0.00 0.00 33.84 33.29 1nji n VAL 170 CO 0.00 0.00 0.00 -1.59 -1.32 0.00 0.00 176.83 173.92 1nji s LYS 171 N 0.00 0.84 0.27 5.55 -2.85 -1.26 -5.05 119.74 117.25 1nji s LYS 171 Ca 0.00 -0.69 -0.08 0.00 -1.00 0.00 0.00 55.97 54.20 1nji s LYS 171 Cb 0.00 -0.81 0.45 0.00 -2.06 0.00 0.00 37.83 35.40 1nji s LYS 171 CO 0.00 0.20 1.57 0.00 0.10 0.00 0.00 175.35 177.22 1nji h ALA 172 N 5.02 0.65 -1.00 0.59 0.00 -2.01 0.21 119.26 122.71 1nji h ALA 172 Ca -0.37 0.38 0.24 0.00 0.00 0.00 0.00 54.91 55.16 1nji h ALA 172 Cb 1.18 0.74 -0.09 0.00 0.00 0.00 0.00 17.79 19.62 1nji h ALA 172 CO 0.44 -0.38 0.64 0.78 0.00 0.00 0.00 179.25 180.73 1nji h GLY 173 N 0.00 1.24 1.14 0.00 0.00 -1.96 -0.30 103.07 103.19 1nji h GLY 173 Ca 0.47 -0.23 -0.17 0.00 0.00 0.00 0.00 47.33 47.39 1nji h GLY 173 CO -1.00 -0.10 -0.47 3.43 0.00 0.00 0.00 176.54 178.40 1nji h ASN 174 N 0.46 1.00 0.09 0.19 2.35 -0.85 -2.40 115.58 116.42 1nji h ASN 174 Ca 0.57 -0.50 0.01 0.00 -0.55 0.00 0.00 56.30 55.82 1nji h ASN 174 Cb 1.34 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 39.41 1nji h ASN 174 CO -0.29 1.30 -0.11 0.50 -1.65 0.00 0.00 177.43 177.19 1nji h LYS 175 N 0.72 -0.22 -0.95 0.81 3.11 -1.13 -2.67 116.57 116.23 1nji h LYS 175 Ca 0.04 0.02 0.09 0.00 -2.81 0.00 0.00 60.65 57.98 1nji h LYS 175 Cb 1.08 0.05 -0.11 0.00 -1.00 0.00 0.00 32.23 32.24 1nji h LYS 175 CO 0.11 -0.15 -0.56 1.58 -2.81 0.00 0.00 179.45 177.62 1nji n HIS 176 N -5.22 -0.42 -0.28 1.91 -0.00 -0.26 -0.03 115.22 110.92 1nji n HIS 176 Ca -0.07 1.19 0.06 0.00 0.46 0.00 0.00 57.72 59.36 1nji n HIS 176 Cb 0.15 -0.58 0.28 0.00 -0.12 0.00 0.00 29.99 29.72 1nji n HIS 176 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 1nji h HIS 177 N 0.00 0.97 0.59 1.57 3.86 -1.29 -0.46 115.15 120.40 1nji h HIS 177 Ca 0.15 0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 59.36 1nji h HIS 177 Cb 0.39 -0.32 0.01 0.00 1.06 0.00 0.00 27.41 28.55 1nji h HIS 177 CO -1.02 0.48 -0.28 -0.22 0.86 0.00 0.00 177.93 177.75 1nji h LYS 178 N 0.93 -0.77 -1.09 2.45 3.64 -0.36 -3.14 116.57 118.24 1nji h LYS 178 Ca 0.39 0.05 0.36 0.00 -1.27 0.00 0.00 60.65 60.18 1nji h LYS 178 Cb 0.30 0.17 -0.14 0.00 -0.41 0.00 0.00 32.23 32.15 1nji h LYS 178 CO -0.15 -0.46 0.65 1.98 -2.27 0.00 0.00 179.45 179.19 1nji h MET 179 N -1.10 0.23 0.00 1.90 4.05 -0.02 0.53 114.93 120.50 1nji h MET 179 Ca -0.08 -0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.33 1nji h MET 179 Cb 0.66 -0.05 0.00 0.00 -0.80 0.00 0.00 31.60 31.41 1nji h MET 179 CO 0.13 0.15 0.00 1.17 0.23 0.00 0.00 176.91 178.59 1nji n LYS 180 N -4.94 0.05 -0.25 0.39 4.81 -0.22 -1.34 118.16 116.67 1nji n LYS 180 Ca 0.33 0.30 0.07 0.00 -0.87 0.00 0.00 58.31 58.14 1nji n LYS 180 Cb 1.12 -1.50 0.21 0.00 0.02 0.00 0.00 35.03 34.88 1nji n LYS 180 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1nji n ALA 181 N -1.40 2.28 -2.42 3.14 0.00 0.18 -4.78 120.51 117.51 1nji n ALA 181 Ca 0.03 -1.24 -0.21 0.00 0.00 0.00 0.00 53.44 52.02 1nji n ALA 181 Cb 0.07 -0.59 -0.11 0.00 0.00 0.00 0.00 19.45 18.83 1nji n ALA 181 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1nji s ARG 182 N -1.08 1.59 -1.20 0.00 1.81 -0.45 -4.72 118.95 114.90 1nji s ARG 182 Ca 0.31 -1.87 -0.10 0.00 -1.72 0.00 0.00 55.73 52.36 1nji s ARG 182 Cb 0.17 -0.81 0.21 0.00 -0.45 0.00 0.00 34.95 34.07 1nji s ARG 182 CO 0.20 -0.17 1.53 0.41 -0.68 0.00 0.00 175.30 176.60 1nji n GLY 183 N -0.63 4.22 3.32 -3.53 0.00 -1.26 -4.47 105.19 102.83 1nji n GLY 183 Ca -0.03 -2.23 -0.14 0.00 0.00 0.00 0.00 46.02 43.63 1nji n GLY 183 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1nji s THR 184 N 0.08 0.01 -0.16 2.61 2.01 -1.26 -4.78 115.64 114.15 1nji s THR 184 Ca 0.38 -0.12 -0.17 0.00 0.31 0.00 0.00 61.69 62.09 1nji s THR 184 Cb 0.01 -0.64 -0.04 0.00 0.01 0.00 0.00 72.50 71.84 1nji s THR 184 CO 0.01 -0.07 0.42 -0.75 -0.69 0.00 0.00 174.62 173.54 1nji s LYS 185 N -0.28 4.25 -0.12 4.92 2.47 -1.26 -4.91 119.74 124.81 1nji s LYS 185 Ca -0.04 0.30 -0.19 0.00 -1.56 0.00 0.00 55.97 54.48 1nji s LYS 185 Cb -0.03 -3.48 0.05 0.00 -1.46 0.00 0.00 37.83 32.90 1nji s LYS 185 CO 0.02 0.07 0.49 -0.46 0.16 0.00 0.00 175.35 175.63 1nji s TRP 186 N 0.94 -0.48 0.00 4.03 -0.00 -1.26 -4.75 118.94 117.43 1nji s TRP 186 Ca 0.22 1.05 0.00 0.00 -0.00 0.00 0.00 56.10 57.36 1nji s TRP 186 Cb -0.15 0.20 0.00 0.00 -0.00 0.00 0.00 33.47 33.53 1nji s TRP 186 CO 0.08 -0.36 0.00 -0.35 -0.00 0.00 0.00 176.95 176.33 1nji n PRO 187 N 2.11 0.29 -4.22 5.86 -0.04 -1.26 -5.10 135.00 132.63 1nji n PRO 187 Ca -0.16 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 62.96 1nji n PRO 187 Cb 0.56 0.00 -0.16 0.00 -0.04 0.00 0.00 33.50 33.87 1nji n PRO 187 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1nji s ASN 188 N -1.06 3.43 -0.10 3.54 0.01 -1.26 -5.10 114.94 114.39 1nji s ASN 188 Ca 0.00 -0.57 -0.16 0.00 -0.71 0.00 0.00 52.86 51.42 1nji s ASN 188 Cb 0.00 -1.54 -0.05 0.00 0.41 0.00 0.00 41.25 40.08 1nji s ASN 188 CO 0.00 0.02 0.41 -0.69 -1.51 0.00 0.00 177.10 175.33 1nji s VAL 189 N 1.19 5.19 0.29 1.60 1.01 -1.26 -5.04 120.40 123.37 1nji s VAL 189 Ca 0.02 0.80 -0.29 0.00 0.00 0.00 0.00 61.98 62.51 1nji s VAL 189 Cb -0.14 -3.74 -0.10 0.00 0.00 0.00 0.00 36.38 32.41 1nji s VAL 189 CO -0.08 0.40 1.28 -0.13 0.00 0.00 0.00 175.10 176.58 1nji s ARG 190 N 0.20 4.41 0.16 2.72 0.52 -1.26 -4.93 118.95 120.76 1nji s ARG 190 Ca 0.23 2.12 -0.17 0.00 -0.52 0.00 0.00 55.73 57.38 1nji s ARG 190 Cb -0.15 -3.12 0.07 0.00 0.52 0.00 0.00 34.95 32.27 1nji s ARG 190 CO 0.09 -0.15 1.70 0.78 0.02 0.00 0.00 175.30 177.74 1nji h GLY 191 N 4.03 0.31 1.55 -3.53 0.00 -1.96 -0.45 103.07 103.03 1nji h GLY 191 Ca -0.47 0.06 0.00 0.00 0.00 0.00 0.00 47.33 46.92 1nji h GLY 191 CO 0.69 -0.09 0.04 -0.62 0.00 0.00 0.00 176.54 176.56 1nji n VAL 192 N -5.21 1.33 0.43 4.60 0.31 -1.26 0.33 118.33 118.87 1nji n VAL 192 Ca 0.01 0.38 0.11 0.00 -0.01 0.00 0.00 64.34 64.82 1nji n VAL 192 Cb 0.18 -1.38 0.16 0.00 -0.91 0.00 0.00 33.84 31.90 1nji n VAL 192 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1nji n ALA 193 N -1.32 2.42 -2.89 3.52 0.00 -0.18 -4.58 120.51 117.48 1nji n ALA 193 Ca 0.00 -0.89 -0.04 0.00 0.00 0.00 0.00 53.44 52.51 1nji n ALA 193 Cb 0.04 -0.75 0.01 0.00 0.00 0.00 0.00 19.45 18.75 1nji n ALA 193 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1nji n MET 194 N 1.27 0.87 -3.68 0.00 2.81 0.15 -4.99 117.12 113.55 1nji n MET 194 Ca 0.16 -0.47 -0.26 0.00 -1.81 0.00 0.00 57.70 55.32 1nji n MET 194 Cb 0.55 -0.05 -0.03 0.00 -0.71 0.00 0.00 33.22 32.98 1nji n MET 194 CO 0.00 0.00 0.00 -0.80 1.51 0.00 0.00 175.97 176.68 1nji s ASN 195 N -1.57 6.36 0.26 7.83 0.01 -1.26 -2.11 114.94 124.46 1nji s ASN 195 Ca 0.10 0.36 -0.02 0.00 -0.71 0.00 0.00 52.86 52.59 1nji s ASN 195 Cb -0.01 -1.99 0.52 0.00 0.41 0.00 0.00 41.25 40.18 1nji s ASN 195 CO 0.06 -0.09 1.76 0.00 -1.51 0.00 0.00 177.10 177.32 1nji h ALA 196 N 1.67 1.24 -0.08 0.60 0.00 -1.82 0.36 119.26 121.22 1nji h ALA 196 Ca -0.49 0.09 0.02 0.00 0.00 0.00 0.00 54.91 54.54 1nji h ALA 196 Cb 1.20 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.99 1nji h ALA 196 CO 0.66 -0.11 0.08 -0.24 0.00 0.00 0.00 179.25 179.64 1nji h VAL 197 N 0.59 0.64 0.00 0.00 3.04 -1.94 -2.93 116.25 115.66 1nji h VAL 197 Ca 0.45 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 66.14 1nji h VAL 197 Cb 0.64 0.94 0.00 0.00 -2.01 0.00 0.00 31.29 30.86 1nji h VAL 197 CO -0.37 0.00 -1.13 0.47 -1.01 0.00 0.00 177.57 175.53 1nji n ASP 198 N -4.04 0.60 -3.63 3.17 8.00 0.09 -0.94 116.55 119.79 1nji n ASP 198 Ca -0.01 -0.31 -0.11 0.00 0.71 0.00 0.00 54.79 55.07 1nji n ASP 198 Cb 0.18 0.96 -0.07 0.00 -0.02 0.00 0.00 41.12 42.18 1nji n ASP 198 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 1nji s HIS 199 N -3.20 -0.67 0.54 1.24 2.46 -1.07 -4.53 115.29 110.05 1nji s HIS 199 Ca 0.03 1.62 0.30 0.00 0.47 0.00 0.00 55.06 57.47 1nji s HIS 199 Cb 0.15 0.33 1.62 0.00 -0.13 0.00 0.00 32.58 34.54 1nji s HIS 199 CO 0.82 -0.33 1.90 -1.00 -2.47 0.00 0.00 174.74 173.67 1nji h PRO 200 N 4.81 0.00 0.00 2.88 0.13 -1.84 0.38 132.00 138.36 1nji h PRO 200 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 1nji h PRO 200 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1nji h PRO 200 CO 0.08 0.00 -0.82 1.19 -0.23 0.00 0.00 178.00 178.22 1nji n PHE 201 N -2.78 0.09 -0.78 1.56 0.99 -1.26 -4.47 117.46 110.81 1nji n PHE 201 Ca -0.02 0.03 -0.30 0.00 -0.00 0.00 0.00 57.45 57.15 1nji n PHE 201 Cb 0.31 -0.24 0.17 0.00 -1.00 0.00 0.00 39.48 38.71 1nji n PHE 201 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.76 176.96 1nji s GLY 202 N -3.22 1.65 0.00 1.37 0.00 0.13 -4.34 107.32 102.91 1nji s GLY 202 Ca 0.08 0.37 0.00 0.00 0.00 0.00 0.00 44.72 45.16 1nji s GLY 202 CO 0.78 0.84 0.00 0.61 0.00 0.00 0.00 173.10 175.33 1nji n GLY 203 N 0.02 -3.63 0.00 0.20 0.00 -0.90 -3.97 105.19 96.92 1nji n GLY 203 Ca 0.09 -1.95 0.00 0.00 0.00 0.00 0.00 46.02 44.16 1nji n GLY 203 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nji n GLY 204 N -0.25 1.22 0.08 -0.02 0.00 -1.26 -4.72 105.19 100.24 1nji n GLY 204 Ca 0.00 -1.84 0.12 0.00 0.00 0.00 0.00 46.02 44.30 1nji n GLY 204 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nji n GLY 205 N 1.27 -1.52 3.17 -0.02 0.00 -1.26 -4.84 105.19 101.99 1nji n GLY 205 Ca 0.00 -0.17 -0.09 0.00 0.00 0.00 0.00 46.02 45.76 1nji n GLY 205 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1nji s ARG 206 N -3.14 0.91 -0.35 1.61 1.70 -1.26 -5.13 118.95 113.29 1nji s ARG 206 Ca 0.08 -1.35 -0.23 0.00 -0.47 0.00 0.00 55.73 53.75 1nji s ARG 206 Cb 0.13 0.26 0.01 0.00 -0.57 0.00 0.00 34.95 34.78 1nji s ARG 206 CO 0.68 -0.26 0.78 -0.65 -1.08 0.00 0.00 175.30 174.77 1nji s GLN 207 N -4.01 3.81 -0.11 3.89 -0.21 -1.26 -4.98 119.66 116.79 1nji s GLN 207 Ca 0.20 0.38 -0.30 0.00 0.02 0.00 0.00 55.36 55.65 1nji s GLN 207 Cb 0.07 -3.79 0.11 0.00 1.00 0.00 0.00 33.01 30.40 1nji s GLN 207 CO -0.01 -0.80 0.90 -3.38 -2.12 0.00 0.00 175.29 169.89 1nji s HIS 208 N 3.05 -0.44 0.58 0.91 -3.43 -1.26 -5.10 115.29 109.61 1nji s HIS 208 Ca 0.31 0.68 -0.18 0.00 -0.80 0.00 0.00 55.06 55.08 1nji s HIS 208 Cb -0.13 0.45 -0.04 0.00 -1.43 0.00 0.00 32.58 31.43 1nji s HIS 208 CO 0.16 -0.44 1.11 -1.25 -2.00 0.00 0.00 174.74 172.32 1nji s PRO 209 N -1.44 3.19 0.00 -0.38 0.04 -1.26 -4.89 135.00 130.26 1nji s PRO 209 Ca -0.03 1.50 -0.24 0.00 0.04 0.00 0.00 61.00 62.26 1nji s PRO 209 Cb -0.00 -1.99 -0.14 0.00 0.04 0.00 0.00 34.50 32.40 1nji s PRO 209 CO 0.02 -0.96 1.08 0.78 0.04 0.00 0.00 177.00 177.96 1nji h GLY 210 N 0.78 -0.73 0.00 0.56 0.00 -1.78 -3.47 103.07 98.43 1nji h GLY 210 Ca -0.49 0.27 0.00 0.00 0.00 0.00 0.00 47.33 47.11 1nji h GLY 210 CO 0.56 -0.26 0.00 0.28 0.00 0.00 0.00 176.54 177.12 1nji n LYS 211 N -5.26 1.79 -2.68 4.80 5.02 -1.26 -5.09 118.16 115.48 1nji n LYS 211 Ca -0.10 0.00 -0.35 0.00 -2.02 0.00 0.00 58.31 55.84 1nji n LYS 211 Cb 0.31 0.00 -0.05 0.00 -0.02 0.00 0.00 35.03 35.27 1nji n LYS 211 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1nji s PRO 212 N -0.94 4.15 0.42 1.97 0.04 -1.26 -4.96 135.00 134.42 1nji s PRO 212 Ca 0.00 1.29 0.20 0.00 0.04 0.00 0.00 61.00 62.54 1nji s PRO 212 Cb 0.00 -2.31 0.94 0.00 0.04 0.00 0.00 34.50 33.17 1nji s PRO 212 CO 0.00 -0.12 1.87 0.87 0.04 0.00 0.00 177.00 179.66 1nji h LYS 213 N 2.11 0.00 -6.18 4.56 1.57 -1.94 -3.43 116.57 113.25 1nji h LYS 213 Ca -0.49 0.00 -0.56 0.00 -1.87 0.00 0.00 60.65 57.73 1nji h LYS 213 Cb 1.20 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.48 1nji h LYS 213 CO 0.61 0.28 0.95 -1.12 -0.57 0.00 0.00 179.45 179.60 1nji s SER 214 N -6.45 6.87 0.03 0.86 0.01 -1.26 -1.31 113.70 112.45 1nji s SER 214 Ca -0.01 1.80 0.05 0.00 1.31 0.00 0.00 55.95 59.09 1nji s SER 214 Cb 0.12 -2.54 -0.04 0.00 0.21 0.00 0.00 66.02 63.78 1nji s SER 214 CO 0.66 -0.81 -0.08 -0.51 0.41 0.00 0.00 173.24 172.91 1nji s ILE 215 N 3.67 3.53 0.62 1.44 1.10 -0.39 -4.95 121.20 126.23 1nji s ILE 215 Ca 0.59 -0.93 -0.18 0.00 -0.51 0.00 0.00 60.65 59.61 1nji s ILE 215 Cb -0.24 -2.57 -0.02 0.00 0.15 0.00 0.00 42.46 39.78 1nji s ILE 215 CO 0.18 0.31 1.25 -0.55 -2.11 0.00 0.00 174.94 174.03 1nji s SER 216 N -1.65 4.85 0.42 4.50 0.15 -1.26 -0.76 113.70 119.94 1nji s SER 216 Ca 0.18 2.52 0.08 0.00 0.70 0.00 0.00 55.95 59.43 1nji s SER 216 Cb -0.11 -2.61 0.88 0.00 -1.71 0.00 0.00 66.02 62.47 1nji s SER 216 CO 0.09 -1.83 2.03 0.03 1.20 0.00 0.00 173.24 174.77 1nji h ARG 217 N 0.68 0.41 0.00 5.44 2.47 -1.95 -1.98 114.38 119.46 1nji h ARG 217 Ca -0.51 -0.04 0.00 0.00 -1.26 0.00 0.00 59.98 58.17 1nji h ARG 217 Cb 1.32 -0.09 0.00 0.00 -1.65 0.00 0.00 29.97 29.55 1nji h ARG 217 CO 0.54 0.33 0.00 0.09 0.56 0.00 0.00 179.97 181.49 1nji n ASN 218 N -4.44 0.00 -4.69 7.04 3.02 -1.26 -4.89 115.26 110.04 1nji n ASN 218 Ca 0.01 -0.44 -0.40 0.00 -0.03 0.00 0.00 54.58 53.72 1nji n ASN 218 Cb 0.11 -0.18 0.02 0.00 -0.61 0.00 0.00 39.78 39.12 1nji n ASN 218 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1nji n ALA 219 N -1.18 1.08 -1.96 5.41 0.00 -0.74 -4.97 120.51 118.15 1nji n ALA 219 Ca 0.18 0.21 -0.32 0.00 0.00 0.00 0.00 53.44 53.50 1nji n ALA 219 Cb 0.19 -2.24 -0.05 0.00 0.00 0.00 0.00 19.45 17.35 1nji n ALA 219 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1nji s PRO 220 N -2.35 4.03 0.32 0.00 0.04 -1.26 -4.67 135.00 131.10 1nji s PRO 220 Ca 0.65 0.86 -0.29 0.00 0.04 0.00 0.00 61.00 62.26 1nji s PRO 220 Cb -0.49 -2.26 -0.12 0.00 0.04 0.00 0.00 34.50 31.67 1nji s PRO 220 CO 0.55 -0.05 1.45 -0.35 0.04 0.00 0.00 177.00 178.64 1nji n PRO 221 N -0.92 2.40 0.00 0.56 -0.04 -1.26 -0.36 135.00 135.38 1nji n PRO 221 Ca 0.05 0.85 0.00 0.00 -0.04 0.00 0.00 63.50 64.36 1nji n PRO 221 Cb 0.54 -2.54 0.00 0.00 -0.04 0.00 0.00 33.50 31.46 1nji n PRO 221 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1nji n GLY 222 N 1.36 2.34 0.00 0.55 0.00 -1.26 -4.79 105.19 103.38 1nji n GLY 222 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 1nji n GLY 222 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1nji n ARG 223 N -0.52 1.97 -2.25 1.61 0.63 0.51 -4.72 116.66 113.90 1nji n ARG 223 Ca 0.00 0.00 -0.37 0.00 -0.92 0.00 0.00 57.85 56.56 1nji n ARG 223 Cb 0.00 -0.94 -0.03 0.00 0.45 0.00 0.00 32.46 31.94 1nji n ARG 223 CO 0.00 0.00 0.00 0.21 -2.51 0.00 0.00 177.63 175.33 1nji s LYS 224 N -1.80 2.89 0.19 -0.14 2.20 -0.92 -4.89 119.74 117.27 1nji s LYS 224 Ca 0.00 0.00 -0.13 0.00 -0.36 0.00 0.00 55.97 55.49 1nji s LYS 224 Cb 0.00 -4.56 0.01 0.00 -1.51 0.00 0.00 37.83 31.76 1nji s LYS 224 CO 0.00 -2.62 0.40 0.14 -0.36 0.00 0.00 175.35 172.91 1nji s VAL 225 N 7.82 0.04 0.00 4.02 -7.23 -1.26 -4.99 120.40 118.79 1nji s VAL 225 Ca 0.56 -1.17 0.00 0.00 -1.81 0.00 0.00 61.98 59.56 1nji s VAL 225 Cb -0.09 -1.80 0.00 0.00 0.56 0.00 0.00 36.38 35.05 1nji s VAL 225 CO 0.12 -0.19 0.00 0.61 -0.31 0.00 0.00 175.10 175.33 1nji n GLY 226 N -0.28 0.60 3.44 2.32 0.00 -1.26 -4.54 105.19 105.46 1nji n GLY 226 Ca -0.07 -1.15 -0.44 0.00 0.00 0.00 0.00 46.02 44.35 1nji n GLY 226 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1nji s ASP 227 N -4.00 6.22 -0.14 1.61 1.01 -0.43 -4.97 116.67 115.97 1nji s ASP 227 Ca 0.00 -0.97 -0.29 0.00 0.71 0.00 0.00 52.55 52.00 1nji s ASP 227 Cb 0.00 -2.33 -0.03 0.00 1.01 0.00 0.00 42.92 41.57 1nji s ASP 227 CO 0.00 -1.07 1.44 -0.63 0.21 0.00 0.00 175.17 175.12 1nji s ILE 228 N 3.04 3.96 -1.56 0.77 1.01 -1.26 -1.26 121.20 125.90 1nji s ILE 228 Ca 0.17 1.15 -0.17 0.00 0.00 0.00 0.00 60.65 61.80 1nji s ILE 228 Cb -0.19 -3.79 0.16 0.00 0.01 0.00 0.00 42.46 38.65 1nji s ILE 228 CO 0.11 -0.16 0.62 0.00 0.00 0.00 0.00 174.94 175.51 1nji n ALA 229 N 7.10 -1.18 -1.78 9.38 0.00 0.06 -4.82 120.51 129.26 1nji n ALA 229 Ca 0.16 -0.06 -0.42 0.00 0.00 0.00 0.00 53.44 53.12 1nji n ALA 229 Cb 0.44 -2.83 -0.03 0.00 0.00 0.00 0.00 19.45 17.03 1nji n ALA 229 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1nji s SER 230 N -3.07 6.44 0.48 0.00 1.04 -1.25 -4.85 113.70 112.49 1nji s SER 230 Ca 0.66 2.78 0.27 0.00 0.48 0.00 0.00 55.95 60.15 1nji s SER 230 Cb -0.37 -2.59 0.75 0.00 0.10 0.00 0.00 66.02 63.91 1nji s SER 230 CO 0.81 -0.94 1.76 0.11 0.98 0.00 0.00 173.24 175.96 1nji h LYS 231 N 7.13 0.00 -2.10 4.02 1.57 -1.97 -3.47 116.57 121.75 1nji h LYS 231 Ca -0.43 0.00 0.27 0.00 -1.87 0.00 0.00 60.65 58.61 1nji h LYS 231 Cb 1.20 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 33.44 1nji h LYS 231 CO 0.95 0.01 0.74 -0.98 -0.57 0.00 0.00 179.45 179.60 1nji s ARG 232 N -3.39 0.76 0.27 3.15 1.70 -1.26 -5.19 118.95 114.98 1nji s ARG 232 Ca 0.05 -0.47 -0.09 0.00 -0.47 0.00 0.00 55.73 54.75 1nji s ARG 232 Cb 0.07 0.23 -0.01 0.00 -0.57 0.00 0.00 34.95 34.67 1nji s ARG 232 CO 0.62 -0.35 0.44 0.95 -1.08 0.00 0.00 175.30 175.87 1nji s THR 233 N -2.31 0.00 0.00 4.99 -4.23 -1.26 -5.12 115.64 107.70 1nji s THR 233 Ca 0.21 -1.53 0.00 0.00 -1.18 0.00 0.00 61.69 59.19 1nji s THR 233 Cb 0.00 -2.37 0.00 0.00 1.34 0.00 0.00 72.50 71.47 1nji s THR 233 CO 0.01 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.70 1nji n GLY 234 N -0.41 -1.07 0.00 3.99 0.00 -1.26 -4.70 105.19 101.74 1nji n GLY 234 Ca -0.01 -1.22 0.00 0.00 0.00 0.00 0.00 46.02 44.79 1nji n GLY 234 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nji n ARG 235 N -0.02 3.27 -1.53 1.61 1.74 -1.26 -5.09 116.66 115.38 1nji n ARG 235 Ca 0.00 0.00 -0.40 0.00 -0.77 0.00 0.00 57.85 56.68 1nji n ARG 235 Cb 0.00 -0.92 0.02 0.00 -1.02 0.00 0.00 32.46 30.54 1nji n ARG 235 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1nji n GLY 236 N 2.61 -0.91 2.96 -0.13 0.00 -1.26 -5.29 105.19 103.17 1nji n GLY 236 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1nji n GLY 236 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93