#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jjt n LEU 4 N 0.00 1.41 -4.01 4.31 0.00 -1.26 -4.99 117.00 112.46 2jjt n LEU 4 Ca 0.00 1.08 -0.27 0.00 0.00 0.00 0.00 56.01 56.82 2jjt n LEU 4 Cb 0.00 -1.24 -0.17 0.00 0.00 0.00 0.00 43.42 42.01 2jjt n LEU 4 CO 0.00 -1.85 -0.47 -1.10 0.00 0.00 0.00 177.39 173.97 2jjt s GLN 5 N -1.64 1.92 -0.30 1.96 -0.21 -1.26 -5.00 119.66 115.12 2jjt s GLN 5 Ca 0.61 -0.45 -0.12 0.00 0.02 0.00 0.00 55.36 55.42 2jjt s GLN 5 Cb -0.66 -1.69 -0.04 0.00 1.00 0.00 0.00 33.01 31.62 2jjt s GLN 5 CO 0.58 -0.09 0.24 0.08 -2.12 0.00 0.00 175.29 173.98 2jjt s VAL 6 N 1.09 5.27 -0.20 1.09 1.01 -1.26 -2.00 120.40 125.40 2jjt s VAL 6 Ca -0.06 0.11 0.01 0.00 0.00 0.00 0.00 61.98 62.05 2jjt s VAL 6 Cb -0.14 -3.63 0.04 0.00 0.00 0.00 0.00 36.38 32.65 2jjt s VAL 6 CO -0.02 0.14 -0.13 -0.63 0.00 0.00 0.00 175.10 174.46 2jjt s ILE 7 N 1.82 1.85 -0.47 2.22 1.01 0.20 -4.15 121.20 123.67 2jjt s ILE 7 Ca 0.08 -1.10 -0.16 0.00 0.00 0.00 0.00 60.65 59.47 2jjt s ILE 7 Cb -0.16 -1.86 0.07 0.00 0.01 0.00 0.00 42.46 40.52 2jjt s ILE 7 CO 0.11 0.23 0.42 -1.10 0.00 0.00 0.00 174.94 174.60 2jjt s GLN 8 N 1.31 3.00 0.43 2.79 -0.21 -1.26 -1.21 119.66 124.50 2jjt s GLN 8 Ca -0.01 -1.27 0.13 0.00 0.02 0.00 0.00 55.36 54.23 2jjt s GLN 8 Cb -0.16 -4.12 0.93 0.00 1.00 0.00 0.00 33.01 30.66 2jjt s GLN 8 CO -0.09 -1.04 1.96 -1.00 -2.12 0.00 0.00 175.29 173.01 2jjt h PRO 9 N 8.78 0.05 -4.83 2.91 0.13 -1.96 -3.40 132.00 133.68 2jjt h PRO 9 Ca -0.28 -0.01 -0.69 0.00 -0.87 0.00 0.00 66.00 64.15 2jjt h PRO 9 Cb 1.11 -0.01 -0.19 0.00 0.13 0.00 0.00 31.00 32.05 2jjt h PRO 9 CO 0.88 0.24 -0.28 -0.51 -0.23 0.00 0.00 178.00 178.10 2jjt s ASP 10 N -6.97 6.17 0.43 1.44 1.01 -1.26 -4.92 116.67 112.57 2jjt s ASP 10 Ca -0.04 -0.54 0.21 0.00 0.71 0.00 0.00 52.55 52.89 2jjt s ASP 10 Cb 0.16 -2.20 0.96 0.00 1.01 0.00 0.00 42.92 42.85 2jjt s ASP 10 CO 0.71 -0.46 1.87 0.11 0.21 0.00 0.00 175.17 177.61 2jjt h LYS 11 N 8.61 0.00 -3.14 8.23 1.57 -1.78 -3.39 116.57 126.67 2jjt h LYS 11 Ca -0.28 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.34 2jjt h LYS 11 Cb 1.13 0.00 -0.25 0.00 0.08 0.00 0.00 32.23 33.18 2jjt h LYS 11 CO 0.74 0.27 -0.42 -1.54 -0.57 0.00 0.00 179.45 177.93 2jjt s SER 12 N -6.40 -0.25 -0.03 0.86 1.04 -1.26 -0.77 113.70 106.88 2jjt s SER 12 Ca -0.01 0.47 0.06 0.00 0.48 0.00 0.00 55.95 56.96 2jjt s SER 12 Cb 0.12 0.50 -0.01 0.00 0.10 0.00 0.00 66.02 66.73 2jjt s SER 12 CO 0.65 -0.10 -0.23 -0.69 0.98 0.00 0.00 173.24 173.85 2jjt s VAL 13 N 0.05 1.83 -0.14 5.02 1.01 0.00 -4.92 120.40 123.25 2jjt s VAL 13 Ca -0.01 -0.97 0.00 0.00 0.00 0.00 0.00 61.98 61.01 2jjt s VAL 13 Cb -0.02 -1.53 0.03 0.00 0.00 0.00 0.00 36.38 34.85 2jjt s VAL 13 CO 0.00 0.51 -0.12 -0.55 0.00 0.00 0.00 175.10 174.95 2jjt s SER 14 N -0.33 2.59 0.07 3.32 0.15 -1.26 -1.11 113.70 117.13 2jjt s SER 14 Ca 0.03 -0.47 0.05 0.00 0.70 0.00 0.00 55.95 56.26 2jjt s SER 14 Cb -0.11 -1.07 -0.03 0.00 -1.71 0.00 0.00 66.02 63.10 2jjt s SER 14 CO 0.01 -0.09 -0.15 -0.69 1.20 0.00 0.00 173.24 173.53 2jjt s VAL 15 N 1.55 1.16 0.36 4.45 1.01 -0.74 -4.99 120.40 123.20 2jjt s VAL 15 Ca 0.04 -1.25 -0.25 0.00 0.00 0.00 0.00 61.98 60.53 2jjt s VAL 15 Cb -0.13 -1.09 -0.10 0.00 0.00 0.00 0.00 36.38 35.06 2jjt s VAL 15 CO -0.10 -0.15 0.99 0.00 0.00 0.00 0.00 175.10 175.84 2jjt s ALA 16 N -1.15 3.15 0.45 5.51 0.00 -1.26 -0.04 121.76 128.42 2jjt s ALA 16 Ca -0.00 0.60 -0.24 0.00 0.00 0.00 0.00 51.96 52.31 2jjt s ALA 16 Cb -0.09 -3.22 -0.08 0.00 0.00 0.00 0.00 23.12 19.73 2jjt s ALA 16 CO 0.02 0.00 1.30 0.00 0.00 0.00 0.00 175.76 177.09 2jjt s ALA 17 N -1.67 3.12 0.00 0.00 0.00 -1.07 -2.57 121.76 119.57 2jjt s ALA 17 Ca 0.54 1.22 0.00 0.00 0.00 0.00 0.00 51.96 53.73 2jjt s ALA 17 Cb -0.19 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.43 2jjt s ALA 17 CO 0.25 -0.95 0.00 0.41 0.00 0.00 0.00 175.76 175.47 2jjt n GLY 18 N 0.63 1.25 3.95 0.00 0.00 0.92 -4.94 105.19 106.99 2jjt n GLY 18 Ca 0.06 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.86 2jjt n GLY 18 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2jjt s GLU 19 N -0.43 2.42 0.25 1.61 2.02 -1.06 -4.55 118.70 118.95 2jjt s GLU 19 Ca 0.00 -1.67 -0.11 0.00 0.02 0.00 0.00 54.97 53.21 2jjt s GLU 19 Cb 0.00 -2.42 -0.08 0.00 0.10 0.00 0.00 34.13 31.73 2jjt s GLU 19 CO 0.00 -0.53 0.58 -1.12 0.02 0.00 0.00 175.26 174.22 2jjt s SER 20 N -4.36 6.66 -0.10 -0.19 0.01 -1.26 -1.43 113.70 113.03 2jjt s SER 20 Ca 0.49 0.99 0.03 0.00 1.31 0.00 0.00 55.95 58.77 2jjt s SER 20 Cb -0.04 -2.25 -0.01 0.00 0.21 0.00 0.00 66.02 63.92 2jjt s SER 20 CO 0.30 -0.09 -0.20 0.00 0.41 0.00 0.00 173.24 173.66 2jjt s ALA 21 N -1.84 2.36 -0.25 1.44 0.00 0.15 -4.94 121.76 118.68 2jjt s ALA 21 Ca 0.48 -0.96 -0.09 0.00 0.00 0.00 0.00 51.96 51.40 2jjt s ALA 21 Cb -0.11 -0.93 -0.04 0.00 0.00 0.00 0.00 23.12 22.04 2jjt s ALA 21 CO 0.20 0.32 0.11 0.42 0.00 0.00 0.00 175.76 176.82 2jjt s ILE 22 N 0.16 4.76 -0.23 0.00 -1.09 -1.26 -0.40 121.20 123.14 2jjt s ILE 22 Ca -0.11 -0.02 -0.06 0.00 -2.23 0.00 0.00 60.65 58.23 2jjt s ILE 22 Cb -0.16 -3.23 -0.02 0.00 -1.58 0.00 0.00 42.46 37.47 2jjt s ILE 22 CO 0.06 0.32 0.01 -0.76 -1.23 0.00 0.00 174.94 173.35 2jjt s LEU 23 N 1.48 3.19 0.05 2.97 1.43 -0.39 -4.99 118.68 122.42 2jjt s LEU 23 Ca 0.06 -0.28 -0.14 0.00 -1.03 0.00 0.00 54.13 52.74 2jjt s LEU 23 Cb -0.15 -1.83 -0.06 0.00 0.03 0.00 0.00 46.19 44.18 2jjt s LEU 23 CO 0.06 -0.01 0.44 -1.00 0.23 0.00 0.00 176.35 176.07 2jjt s HIS 24 N 1.46 3.69 -0.20 0.29 3.76 -1.26 -1.63 115.29 121.39 2jjt s HIS 24 Ca 0.05 0.99 -0.17 0.00 -0.15 0.00 0.00 55.06 55.78 2jjt s HIS 24 Cb -0.15 -2.29 0.05 0.00 1.11 0.00 0.00 32.58 31.31 2jjt s HIS 24 CO 0.01 0.58 0.53 0.00 -0.85 0.00 0.00 174.74 175.01 2jjt s THR 26 N 0.48 0.08 0.03 0.00 -1.32 -0.35 -0.37 115.64 114.19 2jjt s THR 26 Ca -0.02 -0.66 0.05 0.00 -1.21 0.00 0.00 61.69 59.86 2jjt s THR 26 Cb -0.04 -0.34 -0.03 0.00 -1.51 0.00 0.00 72.50 70.57 2jjt s THR 26 CO -0.02 -0.36 -0.12 0.68 -2.21 0.00 0.00 174.62 172.59 2jjt s VAL 27 N -1.20 3.25 -1.26 5.08 -7.23 -0.60 -0.63 120.40 117.81 2jjt s VAL 27 Ca -0.13 -1.02 0.27 0.00 -1.81 0.00 0.00 61.98 59.29 2jjt s VAL 27 Cb -0.07 -2.41 0.18 0.00 0.56 0.00 0.00 36.38 34.64 2jjt s VAL 27 CO 0.01 0.33 1.62 0.35 -0.31 0.00 0.00 175.10 177.10 2jjt n THR 28 N 1.43 0.00 -3.71 5.32 -2.24 -0.85 -4.85 114.28 109.38 2jjt n THR 28 Ca -0.15 -0.03 -0.13 0.00 -2.27 0.00 0.00 64.05 61.46 2jjt n THR 28 Cb 0.52 0.07 -0.08 0.00 -2.10 0.00 0.00 70.33 68.75 2jjt n THR 28 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2jjt s SER 29 N -2.81 -0.25 0.00 3.42 0.15 -1.26 -4.94 113.70 108.01 2jjt s SER 29 Ca 0.17 0.07 0.25 0.00 0.70 0.00 0.00 55.95 57.15 2jjt s SER 29 Cb 0.19 0.37 0.41 0.00 -1.71 0.00 0.00 66.02 65.28 2jjt s SER 29 CO 0.59 -0.55 1.35 0.18 1.20 0.00 0.00 173.24 176.01 2jjt n LEU 30 N 0.90 1.48 -4.72 3.45 4.77 -1.26 -4.91 117.00 116.71 2jjt n LEU 30 Ca -0.20 -0.49 -0.27 0.00 -0.03 0.00 0.00 56.01 55.02 2jjt n LEU 30 Cb 0.58 -0.07 -0.07 0.00 -2.33 0.00 0.00 43.42 41.53 2jjt n LEU 30 CO 0.22 0.28 -0.29 0.27 -1.33 0.00 0.00 177.39 176.53 2jjt s ILE 31 N -2.49 4.04 0.89 -0.08 -4.36 -1.26 -4.47 121.20 113.47 2jjt s ILE 31 Ca 0.22 -1.24 -0.12 0.00 -0.26 0.00 0.00 60.65 59.25 2jjt s ILE 31 Cb 0.19 -3.03 0.12 0.00 1.25 0.00 0.00 42.46 40.99 2jjt s ILE 31 CO 0.54 -0.08 1.09 -2.16 0.24 0.00 0.00 174.94 174.58 2jjt s PRO 32 N -2.91 1.32 0.12 0.37 0.04 -1.26 -4.75 135.00 127.93 2jjt s PRO 32 Ca 0.28 0.79 -0.31 0.00 0.04 0.00 0.00 61.00 61.80 2jjt s PRO 32 Cb -0.10 -1.82 -0.11 0.00 0.04 0.00 0.00 34.50 32.52 2jjt s PRO 32 CO 0.20 -2.19 1.84 0.28 0.04 0.00 0.00 177.00 177.17 2jjt n VAL 33 N -3.84 0.36 0.00 -0.36 0.31 -1.26 -4.92 118.33 108.62 2jjt n VAL 33 Ca 0.07 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2jjt n VAL 33 Cb 0.55 -2.12 0.00 0.00 -0.91 0.00 0.00 33.84 31.36 2jjt n VAL 33 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2jjt n GLY 34 N 4.23 3.37 3.86 2.92 0.00 -1.26 -2.87 105.19 115.44 2jjt n GLY 34 Ca 0.18 -0.92 -0.31 0.00 0.00 0.00 0.00 46.02 44.97 2jjt n GLY 34 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2jjt s PRO 35 N -2.14 3.72 -0.22 1.61 0.04 -1.25 -4.69 135.00 132.07 2jjt s PRO 35 Ca 0.00 0.81 -0.10 0.00 0.04 0.00 0.00 61.00 61.75 2jjt s PRO 35 Cb 0.00 -2.11 -0.05 0.00 0.04 0.00 0.00 34.50 32.39 2jjt s PRO 35 CO 0.00 -0.46 0.14 0.42 0.04 0.00 0.00 177.00 177.14 2jjt s ILE 36 N -2.98 5.34 0.13 0.56 -1.09 -1.26 -0.96 121.20 120.93 2jjt s ILE 36 Ca 0.56 0.17 0.08 0.00 -2.23 0.00 0.00 60.65 59.23 2jjt s ILE 36 Cb -0.11 -3.46 -0.04 0.00 -1.58 0.00 0.00 42.46 37.28 2jjt s ILE 36 CO 0.46 0.40 -0.20 -1.10 -1.23 0.00 0.00 174.94 173.27 2jjt s GLN 37 N 0.68 1.19 -0.13 2.79 -0.21 -0.09 -4.58 119.66 119.31 2jjt s GLN 37 Ca 0.07 -1.27 -0.06 0.00 0.02 0.00 0.00 55.36 54.13 2jjt s GLN 37 Cb -0.12 -1.36 -0.04 0.00 1.00 0.00 0.00 33.01 32.49 2jjt s GLN 37 CO 0.01 0.30 0.08 -1.58 -2.12 0.00 0.00 175.29 171.98 2jjt s TRP 38 N -1.56 3.37 0.11 0.91 0.52 0.01 -0.77 118.94 121.52 2jjt s TRP 38 Ca 0.11 0.30 0.07 0.00 0.02 0.00 0.00 56.10 56.59 2jjt s TRP 38 Cb -0.08 -1.95 -0.04 0.00 -1.15 0.00 0.00 33.47 30.26 2jjt s TRP 38 CO 0.05 0.47 -0.18 -0.06 0.02 0.00 0.00 176.95 177.26 2jjt s PHE 39 N -0.52 1.60 -0.26 -1.98 0.08 -0.06 -0.10 117.98 116.75 2jjt s PHE 39 Ca 0.11 -0.47 -0.10 0.00 0.12 0.00 0.00 56.93 56.59 2jjt s PHE 39 Cb -0.12 -0.85 -0.04 0.00 -0.57 0.00 0.00 43.02 41.43 2jjt s PHE 39 CO 0.02 0.19 0.15 0.50 -0.10 0.00 0.00 175.22 175.98 2jjt s ARG 40 N -2.24 3.91 0.00 0.44 3.52 -0.10 -0.57 118.95 123.91 2jjt s ARG 40 Ca 0.07 -0.35 0.00 0.00 -0.13 0.00 0.00 55.73 55.33 2jjt s ARG 40 Cb -0.08 -3.54 0.00 0.00 -1.56 0.00 0.00 34.95 29.77 2jjt s ARG 40 CO 0.04 -0.11 0.00 0.41 -0.81 0.00 0.00 175.30 174.83 2jjt n GLY 41 N 4.81 1.00 0.00 8.12 0.00 -0.58 -1.22 105.19 117.32 2jjt n GLY 41 Ca -0.15 -1.91 0.00 0.00 0.00 0.00 0.00 46.02 43.96 2jjt n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jjt n ALA 42 N 1.38 1.82 -1.00 4.61 0.00 -1.26 -4.72 120.51 121.34 2jjt n ALA 42 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2jjt n ALA 42 Cb 0.00 0.08 0.00 0.00 0.00 0.00 0.00 19.45 19.53 2jjt n ALA 42 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jjt n GLY 43 N 2.40 -2.11 0.13 0.00 0.00 -1.26 -4.87 105.19 99.47 2jjt n GLY 43 Ca 0.00 -1.50 0.12 0.00 0.00 0.00 0.00 46.02 44.64 2jjt n GLY 43 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2jjt n PRO 44 N -1.31 0.20 -0.23 1.61 -0.02 -1.26 -2.62 135.00 131.38 2jjt n PRO 44 Ca 0.00 0.41 0.05 0.00 -2.02 0.00 0.00 63.50 61.93 2jjt n PRO 44 Cb 0.00 -1.87 0.16 0.00 -0.02 0.00 0.00 33.50 31.77 2jjt n PRO 44 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2jjt n ALA 45 N -1.78 2.60 -1.93 3.55 0.00 -1.26 -4.97 120.51 116.72 2jjt n ALA 45 Ca 0.02 -0.66 -0.41 0.00 0.00 0.00 0.00 53.44 52.40 2jjt n ALA 45 Cb 0.25 -0.99 -0.03 0.00 0.00 0.00 0.00 19.45 18.68 2jjt n ALA 45 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 2jjt s ARG 46 N -1.60 4.40 -0.32 0.00 1.70 -1.08 -4.98 118.95 117.07 2jjt s ARG 46 Ca 0.23 2.07 -0.26 0.00 -0.47 0.00 0.00 55.73 57.31 2jjt s ARG 46 Cb 0.13 -3.17 0.01 0.00 -0.57 0.00 0.00 34.95 31.36 2jjt s ARG 46 CO 0.14 -0.20 0.90 -2.00 -1.08 0.00 0.00 175.30 173.05 2jjt s GLU 47 N -0.58 3.98 0.09 3.89 2.12 -0.35 -4.88 118.70 122.97 2jjt s GLU 47 Ca 0.54 0.74 -0.31 0.00 0.36 0.00 0.00 54.97 56.30 2jjt s GLU 47 Cb -0.37 -3.74 -0.10 0.00 0.26 0.00 0.00 34.13 30.18 2jjt s GLU 47 CO 0.42 -0.78 1.90 -0.11 -0.54 0.00 0.00 175.26 176.14 2jjt n LEU 48 N 6.48 4.11 -0.13 2.70 7.94 -1.26 -0.92 117.00 135.92 2jjt n LEU 48 Ca 0.07 0.95 -0.21 0.00 -1.11 0.00 0.00 56.01 55.71 2jjt n LEU 48 Cb 0.48 -1.54 -0.12 0.00 0.53 0.00 0.00 43.42 42.77 2jjt n LEU 48 CO 0.54 0.19 -1.36 -0.38 -1.11 0.00 0.00 177.39 175.28 2jjt n ILE 49 N 5.05 1.51 -3.64 1.96 2.08 0.86 -4.91 119.36 122.27 2jjt n ILE 49 Ca 0.19 -0.52 -0.15 0.00 0.56 0.00 0.00 62.75 62.83 2jjt n ILE 49 Cb 0.39 -1.54 -0.07 0.00 -0.75 0.00 0.00 39.64 37.66 2jjt n ILE 49 CO 0.00 0.00 0.00 -0.47 0.56 0.00 0.00 176.55 176.64 2jjt s TYR 50 N -2.52 -0.67 0.24 1.39 5.04 -1.04 -4.80 117.35 115.00 2jjt s TYR 50 Ca -0.36 1.54 -0.05 0.00 -2.44 0.00 0.00 57.07 55.75 2jjt s TYR 50 Cb 0.10 0.27 -0.02 0.00 0.35 0.00 0.00 41.96 42.66 2jjt s TYR 50 CO 0.58 -0.39 0.31 0.54 -1.34 0.00 0.00 175.55 175.25 2jjt s ASN 51 N -0.03 0.21 0.42 4.32 2.20 -1.26 -0.81 114.94 119.99 2jjt s ASN 51 Ca -0.03 -1.24 0.29 0.00 -0.94 0.00 0.00 52.86 50.94 2jjt s ASN 51 Cb -0.04 0.50 1.08 0.00 -2.00 0.00 0.00 41.25 40.80 2jjt s ASN 51 CO 0.03 -1.02 1.84 1.56 -2.94 0.00 0.00 177.10 176.57 2jjt h GLN 52 N 2.40 0.00 -6.63 3.55 4.20 -2.00 -3.45 115.11 113.18 2jjt h GLN 52 Ca -0.31 0.00 -0.53 0.00 0.06 0.00 0.00 58.65 57.88 2jjt h GLN 52 Cb 1.25 0.00 0.02 0.00 0.30 0.00 0.00 27.48 29.05 2jjt h GLN 52 CO 0.44 0.00 0.63 0.15 -0.67 0.00 0.00 178.83 179.38 2jjt s LYS 53 N -3.46 4.40 -0.39 1.46 1.02 -1.26 -4.98 119.74 116.53 2jjt s LYS 53 Ca 0.04 1.98 -0.29 0.00 0.02 0.00 0.00 55.97 57.72 2jjt s LYS 53 Cb 0.09 -3.23 0.01 0.00 -0.52 0.00 0.00 37.83 34.17 2jjt s LYS 53 CO 0.52 -0.25 1.39 -1.83 -0.92 0.00 0.00 175.35 174.26 2jjt s GLU 54 N 0.23 3.63 0.00 1.68 -1.05 -1.26 -4.73 118.70 117.21 2jjt s GLU 54 Ca 0.58 0.98 0.00 0.00 -0.15 0.00 0.00 54.97 56.38 2jjt s GLU 54 Cb -0.35 -4.00 0.00 0.00 -0.44 0.00 0.00 34.13 29.34 2jjt s GLU 54 CO 0.35 -1.49 0.00 0.41 0.95 0.00 0.00 175.26 175.48 2jjt n GLY 55 N 4.95 -2.13 3.82 -3.83 0.00 -1.26 -5.11 105.19 101.62 2jjt n GLY 55 Ca 0.16 0.69 -0.26 0.00 0.00 0.00 0.00 46.02 46.62 2jjt n GLY 55 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2jjt n HIS 56 N -0.64 -2.08 -3.14 1.61 -0.00 -1.26 -4.94 115.22 104.76 2jjt n HIS 56 Ca 0.00 0.87 -0.21 0.00 -0.00 0.00 0.00 57.72 58.38 2jjt n HIS 56 Cb 0.00 -4.17 -0.04 0.00 -0.00 0.00 0.00 29.99 25.79 2jjt n HIS 56 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.34 177.53 2jjt n PHE 57 N -4.47 1.04 0.32 4.41 3.72 -1.26 -5.00 117.46 116.22 2jjt n PHE 57 Ca -0.14 -3.84 0.22 0.00 -0.05 0.00 0.00 57.45 53.63 2jjt n PHE 57 Cb 0.61 -0.43 1.12 0.00 -0.94 0.00 0.00 39.48 39.84 2jjt n PHE 57 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 2jjt h PRO 58 N 3.11 0.00 0.00 -1.08 0.13 -1.96 -2.51 132.00 129.69 2jjt h PRO 58 Ca 0.11 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 65.09 2jjt h PRO 58 Cb 0.86 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.96 2jjt h PRO 58 CO 0.57 0.00 -2.04 0.54 -0.23 0.00 0.00 178.00 176.85 2jjt n ARG 59 N -3.04 0.79 -3.77 0.86 1.74 -1.26 -4.98 116.66 107.01 2jjt n ARG 59 Ca -0.02 -0.10 -0.37 0.00 -0.77 0.00 0.00 57.85 56.58 2jjt n ARG 59 Cb 0.10 -1.46 -0.06 0.00 -1.02 0.00 0.00 32.46 30.02 2jjt n ARG 59 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2jjt s VAL 60 N -2.95 5.36 -0.05 1.55 1.01 -0.95 -1.54 120.40 122.83 2jjt s VAL 60 Ca -0.08 0.35 -0.14 0.00 0.00 0.00 0.00 61.98 62.11 2jjt s VAL 60 Cb 0.09 -3.50 0.03 0.00 0.00 0.00 0.00 36.38 33.00 2jjt s VAL 60 CO 0.78 0.57 0.32 -0.89 0.00 0.00 0.00 175.10 175.88 2jjt s THR 61 N -1.08 0.04 0.22 3.92 2.01 -0.26 -4.88 115.64 115.60 2jjt s THR 61 Ca 0.19 -0.31 -0.30 0.00 0.31 0.00 0.00 61.69 61.58 2jjt s THR 61 Cb -0.13 -0.57 -0.09 0.00 0.01 0.00 0.00 72.50 71.71 2jjt s THR 61 CO 0.08 -0.17 1.23 0.28 -0.69 0.00 0.00 174.62 175.35 2jjt s THR 62 N -0.82 3.34 -0.09 -0.82 -1.32 -1.26 0.24 115.64 114.90 2jjt s THR 62 Ca -0.09 1.18 0.15 0.00 -1.21 0.00 0.00 61.69 61.72 2jjt s THR 62 Cb -0.04 -3.75 -0.16 0.00 -1.51 0.00 0.00 72.50 67.04 2jjt s THR 62 CO 0.03 0.21 0.82 0.58 -2.21 0.00 0.00 174.62 174.05 2jjt h VAL 63 N 3.56 0.67 -6.59 5.08 2.07 -1.77 -3.45 116.25 115.82 2jjt h VAL 63 Ca -0.45 -2.29 -0.49 0.00 0.82 0.00 0.00 66.70 64.29 2jjt h VAL 63 Cb 1.22 2.21 0.03 0.00 -1.52 0.00 0.00 31.29 33.22 2jjt h VAL 63 CO 0.73 0.38 -0.06 -1.54 0.02 0.00 0.00 177.57 177.10 2jjt n SER 64 N -2.97 2.11 -4.47 0.57 3.41 -1.26 -5.03 113.62 105.97 2jjt n SER 64 Ca -0.11 -2.54 -0.44 0.00 -0.26 0.00 0.00 58.87 55.52 2jjt n SER 64 Cb 0.91 -0.44 -0.00 0.00 -0.26 0.00 0.00 64.21 64.42 2jjt n SER 64 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 2jjt s GLU 65 N -4.68 4.09 0.00 4.33 1.03 -1.26 -4.81 118.70 117.40 2jjt s GLU 65 Ca 0.62 -2.54 0.31 0.00 0.03 0.00 0.00 54.97 53.39 2jjt s GLU 65 Cb -0.05 -5.11 1.65 0.00 -0.80 0.00 0.00 34.13 29.82 2jjt s GLU 65 CO 0.39 -1.81 2.11 -1.13 -1.33 0.00 0.00 175.26 173.49 2jjt n SER 66 N 5.89 0.06 -0.01 0.83 3.41 -1.26 -2.76 113.62 119.78 2jjt n SER 66 Ca 0.38 -0.54 0.12 0.00 -0.26 0.00 0.00 58.87 58.57 2jjt n SER 66 Cb 0.43 -0.15 0.69 0.00 -0.26 0.00 0.00 64.21 64.92 2jjt n SER 66 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2jjt n THR 67 N -1.12 0.00 -4.33 6.66 -2.24 -1.26 -4.87 114.28 107.12 2jjt n THR 67 Ca 0.18 -0.01 -0.35 0.00 -2.27 0.00 0.00 64.05 61.61 2jjt n THR 67 Cb 0.19 -0.35 -0.09 0.00 -2.10 0.00 0.00 70.33 67.98 2jjt n THR 67 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2jjt s LYS 68 N -2.00 2.98 0.28 -0.78 1.02 -1.11 -5.02 119.74 115.11 2jjt s LYS 68 Ca 0.35 -0.42 -0.03 0.00 0.02 0.00 0.00 55.97 55.88 2jjt s LYS 68 Cb 0.16 -2.80 0.37 0.00 -0.52 0.00 0.00 37.83 35.04 2jjt s LYS 68 CO 0.27 0.70 1.92 -0.09 -0.92 0.00 0.00 175.35 177.23 2jjt h ARG 69 N 5.01 1.13 0.00 1.68 2.43 -1.90 -2.95 114.38 119.78 2jjt h ARG 69 Ca -0.51 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 58.56 2jjt h ARG 69 Cb 1.19 -0.24 0.00 0.00 -0.42 0.00 0.00 29.97 30.50 2jjt h ARG 69 CO 0.55 0.79 0.00 1.05 -1.51 0.00 0.00 179.97 180.85 2jjt h GLU 70 N 1.15 0.00 -6.36 0.20 9.09 -1.95 -3.46 114.58 113.25 2jjt h GLU 70 Ca 0.30 0.00 -0.54 0.00 0.05 0.00 0.00 59.36 59.17 2jjt h GLU 70 Cb -0.05 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.05 2jjt h GLU 70 CO -0.06 0.00 0.99 1.21 0.05 0.00 0.00 179.01 181.20 2jjt s ASN 71 N -5.11 6.69 0.00 3.06 2.47 -1.12 -4.91 114.94 116.03 2jjt s ASN 71 Ca 0.03 2.30 0.07 0.00 0.42 0.00 0.00 52.86 55.68 2jjt s ASN 71 Cb 0.09 -2.55 0.21 0.00 -1.45 0.00 0.00 41.25 37.54 2jjt s ASN 71 CO 0.50 -0.86 1.17 0.23 -3.72 0.00 0.00 177.10 174.42 2jjt n MET 72 N 6.08 2.90 -4.10 0.43 2.81 -1.26 -4.98 117.12 119.01 2jjt n MET 72 Ca 0.16 -1.87 -0.35 0.00 -1.81 0.00 0.00 57.70 53.83 2jjt n MET 72 Cb 0.42 -1.18 -0.10 0.00 -0.71 0.00 0.00 33.22 31.65 2jjt n MET 72 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 2jjt s ASP 73 N -1.00 5.53 -0.26 7.83 2.15 -1.26 -1.55 116.67 128.11 2jjt s ASP 73 Ca 0.16 0.10 0.12 0.00 0.43 0.00 0.00 52.55 53.36 2jjt s ASP 73 Cb 0.08 -1.88 0.47 0.00 -0.30 0.00 0.00 42.92 41.29 2jjt s ASP 73 CO 0.11 0.23 1.17 0.49 -0.17 0.00 0.00 175.17 177.00 2jjt n PHE 74 N 3.18 1.97 -2.12 -5.34 3.72 0.50 -4.83 117.46 114.55 2jjt n PHE 74 Ca -0.17 -2.04 -0.33 0.00 -0.05 0.00 0.00 57.45 54.85 2jjt n PHE 74 Cb 0.53 -0.30 0.01 0.00 -0.94 0.00 0.00 39.48 38.78 2jjt n PHE 74 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 2jjt s SER 75 N -3.54 5.74 0.11 4.37 0.01 -1.21 -4.45 113.70 114.74 2jjt s SER 75 Ca 0.43 1.94 0.03 0.00 1.31 0.00 0.00 55.95 59.65 2jjt s SER 75 Cb 0.38 -2.55 -0.04 0.00 0.21 0.00 0.00 66.02 64.02 2jjt s SER 75 CO -0.00 -1.20 -0.08 0.27 0.41 0.00 0.00 173.24 172.64 2jjt s ILE 76 N -2.23 0.83 -0.11 1.44 -4.36 -0.64 -2.27 121.20 113.86 2jjt s ILE 76 Ca 0.66 -1.94 0.03 0.00 -0.26 0.00 0.00 60.65 59.14 2jjt s ILE 76 Cb -0.18 -1.70 -0.00 0.00 1.25 0.00 0.00 42.46 41.83 2jjt s ILE 76 CO 0.33 -0.82 -0.21 -0.55 0.24 0.00 0.00 174.94 173.93 2jjt s SER 77 N -3.03 3.30 -0.19 4.36 0.15 0.14 -1.26 113.70 117.17 2jjt s SER 77 Ca 0.13 -0.51 -0.07 0.00 0.70 0.00 0.00 55.95 56.19 2jjt s SER 77 Cb 0.04 -1.46 -0.04 0.00 -1.71 0.00 0.00 66.02 62.85 2jjt s SER 77 CO -0.03 0.15 0.05 -0.63 1.20 0.00 0.00 173.24 173.98 2jjt s ILE 78 N 0.41 4.67 0.27 6.45 1.01 0.46 -1.10 121.20 133.37 2jjt s ILE 78 Ca -0.16 -0.07 0.05 0.00 0.00 0.00 0.00 60.65 60.47 2jjt s ILE 78 Cb -0.17 -3.11 -0.03 0.00 0.01 0.00 0.00 42.46 39.16 2jjt s ILE 78 CO 0.07 0.45 0.40 -0.94 0.00 0.00 0.00 174.94 174.92 2jjt s SER 79 N 0.48 6.24 -1.09 3.58 1.04 -0.59 -0.68 113.70 122.68 2jjt s SER 79 Ca 0.03 0.04 -0.22 0.00 0.48 0.00 0.00 55.95 56.28 2jjt s SER 79 Cb -0.13 -1.73 0.02 0.00 0.10 0.00 0.00 66.02 64.28 2jjt s SER 79 CO 0.01 -0.17 0.70 0.59 0.98 0.00 0.00 173.24 175.35 2jjt n ASN 80 N -1.49 -4.81 -4.71 7.02 4.13 -1.23 -4.85 115.26 109.32 2jjt n ASN 80 Ca -0.07 -1.10 -0.42 0.00 1.68 0.00 0.00 54.58 54.68 2jjt n ASN 80 Cb 0.57 -2.32 -0.03 0.00 -1.54 0.00 0.00 39.78 36.46 2jjt n ASN 80 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2jjt s ILE 81 N -3.37 2.76 0.28 2.41 -1.09 -0.52 -4.75 121.20 116.92 2jjt s ILE 81 Ca 0.37 0.52 0.12 0.00 -2.23 0.00 0.00 60.65 59.42 2jjt s ILE 81 Cb -0.18 -3.33 -0.05 0.00 -1.58 0.00 0.00 42.46 37.32 2jjt s ILE 81 CO 0.92 0.03 -0.17 0.42 -1.23 0.00 0.00 174.94 174.91 2jjt s THR 82 N 1.32 2.61 0.61 2.92 -4.23 -1.26 -0.06 115.64 117.55 2jjt s THR 82 Ca 0.70 -2.33 0.28 0.00 -1.18 0.00 0.00 61.69 59.16 2jjt s THR 82 Cb -0.42 -2.39 0.36 0.00 1.34 0.00 0.00 72.50 71.39 2jjt s THR 82 CO 0.31 -0.39 1.86 -0.65 -0.54 0.00 0.00 174.62 175.21 2jjt h PRO 83 N 2.21 0.00 0.00 3.99 0.11 -1.95 0.21 132.00 136.57 2jjt h PRO 83 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 2jjt h PRO 83 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 2jjt h PRO 83 CO 0.60 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.39 2jjt h ALA 84 N 1.37 1.00 0.00 -0.75 0.00 -2.00 -3.07 119.26 115.81 2jjt h ALA 84 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.09 2jjt h ALA 84 Cb 1.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2jjt h ALA 84 CO -0.00 0.00 -0.30 -0.25 0.00 0.00 0.00 179.25 178.70 2jjt n ASP 85 N -2.33 0.31 -4.76 0.00 8.00 0.74 -4.89 116.55 113.62 2jjt n ASP 85 Ca 0.01 0.07 -0.41 0.00 0.71 0.00 0.00 54.79 55.17 2jjt n ASP 85 Cb 0.21 -0.06 -0.01 0.00 -0.02 0.00 0.00 41.12 41.24 2jjt n ASP 85 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2jjt n ALA 86 N -1.51 2.47 0.00 2.24 0.00 -1.16 -4.91 120.51 117.64 2jjt n ALA 86 Ca 0.06 0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.85 2jjt n ALA 86 Cb 0.34 -2.44 0.00 0.00 0.00 0.00 0.00 19.45 17.35 2jjt n ALA 86 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jjt n GLY 87 N 1.17 -1.57 3.52 0.00 0.00 -0.24 -4.98 105.19 103.08 2jjt n GLY 87 Ca 0.04 -1.26 -0.37 0.00 0.00 0.00 0.00 46.02 44.43 2jjt n GLY 87 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jjt s THR 88 N -2.83 4.84 -0.09 2.61 2.01 -1.26 0.98 115.64 121.91 2jjt s THR 88 Ca 0.00 0.00 -0.01 0.00 0.31 0.00 0.00 61.69 61.99 2jjt s THR 88 Cb 0.00 -3.29 -0.03 0.00 0.01 0.00 0.00 72.50 69.19 2jjt s THR 88 CO 0.00 0.29 -0.01 -0.31 -0.69 0.00 0.00 174.62 173.90 2jjt s TYR 89 N 1.69 3.11 -0.03 4.92 2.02 -0.07 -1.53 117.35 127.47 2jjt s TYR 89 Ca 0.07 0.15 0.05 0.00 -0.37 0.00 0.00 57.07 56.96 2jjt s TYR 89 Cb -0.16 -1.78 -0.01 0.00 -0.40 0.00 0.00 41.96 39.62 2jjt s TYR 89 CO 0.08 0.43 -0.17 0.71 -1.57 0.00 0.00 175.55 175.02 2jjt s TYR 90 N -0.82 1.66 -0.30 2.71 2.02 0.26 -1.13 117.35 121.75 2jjt s TYR 90 Ca 0.12 -0.42 -0.10 0.00 -0.37 0.00 0.00 57.07 56.30 2jjt s TYR 90 Cb -0.11 -1.10 -0.02 0.00 -0.40 0.00 0.00 41.96 40.32 2jjt s TYR 90 CO 0.02 -0.11 0.17 0.00 -1.57 0.00 0.00 175.55 174.06 2jjt s VAL 92 N 1.68 1.71 -0.15 0.00 1.01 0.05 -0.44 120.40 124.26 2jjt s VAL 92 Ca 0.06 -0.90 -0.08 0.00 0.00 0.00 0.00 61.98 61.05 2jjt s VAL 92 Cb -0.17 -1.43 -0.04 0.00 0.00 0.00 0.00 36.38 34.74 2jjt s VAL 92 CO 0.08 0.48 0.14 -0.75 0.00 0.00 0.00 175.10 175.05 2jjt s LYS 93 N -0.33 3.72 0.28 2.72 2.47 0.92 -0.91 119.74 128.62 2jjt s LYS 93 Ca 0.04 -0.16 0.10 0.00 -1.56 0.00 0.00 55.97 54.39 2jjt s LYS 93 Cb -0.10 -3.28 -0.05 0.00 -1.46 0.00 0.00 37.83 32.95 2jjt s LYS 93 CO 0.01 0.60 -0.05 -0.06 0.16 0.00 0.00 175.35 176.01 2jjt s PHE 94 N -0.51 2.57 0.05 4.03 0.08 -0.13 -0.98 117.98 123.09 2jjt s PHE 94 Ca 0.12 -0.29 0.06 0.00 0.12 0.00 0.00 56.93 56.94 2jjt s PHE 94 Cb -0.12 -1.20 -0.04 0.00 -0.57 0.00 0.00 43.02 41.10 2jjt s PHE 94 CO 0.02 0.62 -0.12 1.03 -0.10 0.00 0.00 175.22 176.67 2jjt s ARG 95 N -3.64 2.24 0.37 0.44 0.52 0.02 -3.82 118.95 115.07 2jjt s ARG 95 Ca 0.32 -0.92 -0.26 0.00 -0.52 0.00 0.00 55.73 54.35 2jjt s ARG 95 Cb -0.05 -2.32 -0.09 0.00 0.52 0.00 0.00 34.95 33.01 2jjt s ARG 95 CO 0.19 0.55 1.15 0.15 0.02 0.00 0.00 175.30 177.35 2jjt s LYS 96 N -1.70 4.22 0.03 3.54 -0.14 -1.14 -1.47 119.74 123.09 2jjt s LYS 96 Ca 0.18 1.81 -0.11 0.00 -1.36 0.00 0.00 55.97 56.49 2jjt s LYS 96 Cb -0.11 -2.80 0.04 0.00 -1.68 0.00 0.00 37.83 33.28 2jjt s LYS 96 CO 0.09 -0.16 0.49 0.41 -0.76 0.00 0.00 175.35 175.42 2jjt n GLY 97 N 0.72 0.69 3.04 -3.33 0.00 -1.26 -4.81 105.19 100.24 2jjt n GLY 97 Ca 0.03 -0.96 -0.34 0.00 0.00 0.00 0.00 46.02 44.75 2jjt n GLY 97 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2jjt s SER 98 N -2.12 5.14 0.71 1.61 0.01 -1.26 -2.87 113.70 114.92 2jjt s SER 98 Ca 0.11 -3.21 -0.01 0.00 1.31 0.00 0.00 55.95 54.15 2jjt s SER 98 Cb -0.01 -1.79 0.12 0.00 0.21 0.00 0.00 66.02 64.55 2jjt s SER 98 CO 0.01 -0.26 0.99 -2.16 0.41 0.00 0.00 173.24 172.22 2jjt s PRO 99 N -0.58 1.72 0.75 12.44 0.04 -1.26 -5.13 135.00 142.98 2jjt s PRO 99 Ca 0.20 -1.09 -0.15 0.00 0.04 0.00 0.00 61.00 60.00 2jjt s PRO 99 Cb -0.17 -2.33 0.04 0.00 0.04 0.00 0.00 34.50 32.08 2jjt s PRO 99 CO -0.06 -1.42 1.15 -0.25 0.04 0.00 0.00 177.00 176.47 2jjt n ASP 100 N -2.82 1.09 -4.28 6.66 8.00 -1.14 -4.98 116.55 119.09 2jjt n ASP 100 Ca 0.15 0.66 -0.23 0.00 0.71 0.00 0.00 54.79 56.07 2jjt n ASP 100 Cb 0.61 -1.49 -0.12 0.00 -0.02 0.00 0.00 41.12 40.09 2jjt n ASP 100 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2jjt s THR 101 N -1.89 1.64 -0.09 -3.53 -4.23 -0.54 -4.88 115.64 102.13 2jjt s THR 101 Ca 0.75 -1.55 -0.30 0.00 -1.18 0.00 0.00 61.69 59.41 2jjt s THR 101 Cb -0.32 -1.53 -0.02 0.00 1.34 0.00 0.00 72.50 71.97 2jjt s THR 101 CO 0.48 -0.11 1.19 -0.70 -0.54 0.00 0.00 174.62 174.94 2jjt s GLU 102 N -1.98 4.33 -0.20 3.99 2.12 -1.26 -0.80 118.70 124.89 2jjt s GLU 102 Ca 0.06 1.63 -0.16 0.00 0.36 0.00 0.00 54.97 56.86 2jjt s GLU 102 Cb -0.09 -3.60 -0.08 0.00 0.26 0.00 0.00 34.13 30.62 2jjt s GLU 102 CO 0.04 -0.49 -0.29 0.34 -0.54 0.00 0.00 175.26 174.32 2jjt n PHE 103 N 5.50 0.22 -3.79 5.30 7.35 -0.15 -4.90 117.46 126.98 2jjt n PHE 103 Ca 0.11 0.09 -0.13 0.00 -0.76 0.00 0.00 57.45 56.77 2jjt n PHE 103 Cb 0.46 -0.71 -0.09 0.00 0.35 0.00 0.00 39.48 39.49 2jjt n PHE 103 CO 0.00 0.00 0.00 0.15 -0.76 0.00 0.00 176.76 176.15 2jjt s LYS 104 N -2.67 0.59 0.08 -4.13 1.02 -1.12 -5.03 119.74 108.49 2jjt s LYS 104 Ca -0.29 -0.17 0.09 0.00 0.02 0.00 0.00 55.97 55.62 2jjt s LYS 104 Cb 0.07 0.26 -0.03 0.00 -0.52 0.00 0.00 37.83 37.60 2jjt s LYS 104 CO 0.42 -0.15 -0.24 0.45 -0.92 0.00 0.00 175.35 174.91 2jjt s SER 105 N -1.17 2.92 0.92 2.83 0.15 -1.26 -0.05 113.70 118.03 2jjt s SER 105 Ca -0.12 -0.65 -0.11 0.00 0.70 0.00 0.00 55.95 55.77 2jjt s SER 105 Cb -0.05 -0.22 0.14 0.00 -1.71 0.00 0.00 66.02 64.18 2jjt s SER 105 CO 0.03 0.17 1.09 -0.83 1.20 0.00 0.00 173.24 174.90 2jjt s GLY 106 N -1.62 1.62 0.00 9.45 0.00 0.41 -4.73 107.32 112.45 2jjt s GLY 106 Ca 0.10 0.06 0.29 0.00 0.00 0.00 0.00 44.72 45.16 2jjt s GLY 106 CO 0.04 0.55 1.94 0.00 0.00 0.00 0.00 173.10 175.63 2jjt n ALA 107 N -4.03 2.34 0.00 3.20 0.00 -1.26 -4.72 120.51 116.04 2jjt n ALA 107 Ca 0.07 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.40 2jjt n ALA 107 Cb 0.54 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.53 2jjt n ALA 107 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jjt n GLY 108 N 1.34 2.93 2.88 0.00 0.00 -1.26 -5.06 105.19 106.02 2jjt n GLY 108 Ca 0.09 -1.66 -0.28 0.00 0.00 0.00 0.00 46.02 44.17 2jjt n GLY 108 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jjt s THR 109 N -1.57 1.12 -0.28 2.61 2.01 -0.28 -4.48 115.64 114.76 2jjt s THR 109 Ca 0.00 -0.70 -0.28 0.00 0.31 0.00 0.00 61.69 61.02 2jjt s THR 109 Cb 0.00 -1.33 0.01 0.00 0.01 0.00 0.00 72.50 71.19 2jjt s THR 109 CO 0.00 0.07 1.02 -0.70 -0.69 0.00 0.00 174.62 174.32 2jjt s GLU 110 N 1.62 4.13 -0.17 4.92 2.56 0.05 -0.89 118.70 130.91 2jjt s GLU 110 Ca -0.00 1.11 -0.09 0.00 0.00 0.00 0.00 54.97 55.99 2jjt s GLU 110 Cb -0.16 -3.70 -0.05 0.00 2.00 0.00 0.00 34.13 32.23 2jjt s GLU 110 CO -0.07 -0.76 0.12 -1.17 -0.56 0.00 0.00 175.26 172.81 2jjt s LEU 111 N 3.38 4.20 0.08 2.70 2.96 0.28 -0.82 118.68 131.45 2jjt s LEU 111 Ca 0.43 0.28 0.07 0.00 -0.22 0.00 0.00 54.13 54.69 2jjt s LEU 111 Cb -0.14 -2.06 -0.03 0.00 0.50 0.00 0.00 46.19 44.46 2jjt s LEU 111 CO 0.11 0.25 -0.18 -0.94 -1.32 0.00 0.00 176.35 174.27 2jjt s SER 112 N -0.09 2.22 -0.22 3.68 1.04 -0.26 -1.08 113.70 118.98 2jjt s SER 112 Ca 0.10 -0.61 -0.04 0.00 0.48 0.00 0.00 55.95 55.88 2jjt s SER 112 Cb -0.11 -0.13 -0.01 0.00 0.10 0.00 0.00 66.02 65.87 2jjt s SER 112 CO 0.00 0.05 -0.03 -0.69 0.98 0.00 0.00 173.24 173.54 2jjt s VAL 113 N -1.07 3.46 0.46 5.02 1.01 -1.26 -1.79 120.40 126.23 2jjt s VAL 113 Ca 0.04 -0.46 0.07 0.00 0.00 0.00 0.00 61.98 61.63 2jjt s VAL 113 Cb -0.09 -2.57 0.02 0.00 0.00 0.00 0.00 36.38 33.73 2jjt s VAL 113 CO 0.03 0.42 0.63 0.00 0.00 0.00 0.00 175.10 176.18 2jjt s ARG 114 N 1.45 2.72 0.00 2.72 1.70 0.95 -4.92 118.95 123.57 2jjt s ARG 114 Ca 0.05 -1.20 0.27 0.00 -0.47 0.00 0.00 55.73 54.39 2jjt s ARG 114 Cb -0.14 -2.70 0.87 0.00 -0.57 0.00 0.00 34.95 32.41 2jjt s ARG 114 CO -0.02 -0.41 1.64 0.00 -1.08 0.00 0.00 175.30 175.43