#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2e7c s SER 2 N 0.00 -0.10 0.11 1.61 1.04 -1.26 -5.18 113.70 109.93 2e7c s SER 2 Ca 0.00 -0.50 0.05 0.00 0.48 0.00 0.00 55.95 55.97 2e7c s SER 2 Cb 0.00 0.48 -0.04 0.00 0.10 0.00 0.00 66.02 66.56 2e7c s SER 2 CO 0.00 -0.92 0.04 -0.55 0.98 0.00 0.00 173.24 172.79 2e7c s SER 3 N -3.11 5.17 -0.46 7.02 0.15 -1.26 -5.09 113.70 116.12 2e7c s SER 3 Ca 0.16 -0.16 0.02 0.00 0.70 0.00 0.00 55.95 56.67 2e7c s SER 3 Cb -0.01 -1.27 0.14 0.00 -1.71 0.00 0.00 66.02 63.16 2e7c s SER 3 CO 0.03 0.15 0.25 -0.83 1.20 0.00 0.00 173.24 174.04 2e7c s GLY 4 N -2.53 1.83 0.20 9.45 0.00 -1.26 -5.09 107.32 109.91 2e7c s GLY 4 Ca 0.27 -2.73 0.00 0.00 0.00 0.00 0.00 44.72 42.26 2e7c s GLY 4 CO 0.20 1.45 0.09 -0.56 0.00 0.00 0.00 173.10 174.27 2e7c s SER 5 N 0.21 0.63 0.26 1.64 0.01 -1.26 -5.03 113.70 110.16 2e7c s SER 5 Ca 0.18 -1.32 0.02 0.00 1.31 0.00 0.00 55.95 56.14 2e7c s SER 5 Cb -0.24 0.26 0.65 0.00 0.21 0.00 0.00 66.02 66.90 2e7c s SER 5 CO -0.00 -0.75 1.31 -1.20 0.41 0.00 0.00 173.24 173.02 2e7c n SER 6 N -0.28 -0.09 0.00 2.44 7.64 -1.26 -4.79 113.62 117.27 2e7c n SER 6 Ca -0.01 1.42 0.00 0.00 1.01 0.00 0.00 58.87 61.29 2e7c n SER 6 Cb 0.65 -0.52 0.00 0.00 -1.01 0.00 0.00 64.21 63.33 2e7c n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2e7c n GLY 7 N -1.42 0.68 3.06 0.23 0.00 -1.26 -5.13 105.19 101.35 2e7c n GLY 7 Ca 0.20 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.95 2e7c n GLY 7 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2e7c s THR 8 N -0.71 1.39 -0.08 2.61 -1.32 -1.26 -5.13 115.64 111.14 2e7c s THR 8 Ca 0.00 -0.61 0.04 0.00 -1.21 0.00 0.00 61.69 59.91 2e7c s THR 8 Cb 0.00 -1.25 0.00 0.00 -1.51 0.00 0.00 72.50 69.74 2e7c s THR 8 CO 0.00 0.41 -0.21 -0.22 -2.21 0.00 0.00 174.62 172.40 2e7c s LEU 9 N 0.73 1.97 -0.29 9.08 2.96 -1.26 -5.11 118.68 126.76 2e7c s LEU 9 Ca -0.12 -0.47 -0.17 0.00 -0.22 0.00 0.00 54.13 53.14 2e7c s LEU 9 Cb -0.16 -1.23 0.16 0.00 0.50 0.00 0.00 46.19 45.47 2e7c s LEU 9 CO 0.03 0.14 1.09 0.00 -1.32 0.00 0.00 176.35 176.29 2e7c s ALA 10 N 0.31 -2.36 -0.27 5.97 0.00 -1.26 -5.18 121.76 118.97 2e7c s ALA 10 Ca -0.14 2.09 -0.26 0.00 0.00 0.00 0.00 51.96 53.65 2e7c s ALA 10 Cb -0.16 -1.77 0.12 0.00 0.00 0.00 0.00 23.12 21.30 2e7c s ALA 10 CO 0.06 -0.32 1.01 1.14 0.00 0.00 0.00 175.76 177.66 2e7c s GLN 11 N 1.10 0.54 -0.05 0.00 0.00 -1.26 -5.14 119.66 114.85 2e7c s GLN 11 Ca -0.07 0.57 -0.30 0.00 -0.00 0.00 0.00 55.36 55.56 2e7c s GLN 11 Cb -0.03 0.26 -0.05 0.00 0.00 0.00 0.00 33.01 33.19 2e7c s GLN 11 CO -0.13 -0.08 1.49 -1.25 0.00 0.00 0.00 175.29 175.32 2e7c s PRO 12 N 0.09 4.23 -0.24 9.60 0.04 -1.26 -4.99 135.00 142.46 2e7c s PRO 12 Ca 0.02 2.01 -0.03 0.00 0.04 0.00 0.00 61.00 63.05 2e7c s PRO 12 Cb -0.04 -3.78 0.11 0.00 0.04 0.00 0.00 34.50 30.82 2e7c s PRO 12 CO -0.05 -0.72 0.24 0.08 0.04 0.00 0.00 177.00 176.58 2e7c s VAL 13 N 3.31 -0.32 -0.04 -0.36 1.01 -1.26 -5.13 120.40 117.61 2e7c s VAL 13 Ca 0.66 -0.32 0.01 0.00 0.00 0.00 0.00 61.98 62.34 2e7c s VAL 13 Cb -0.31 -0.82 0.02 0.00 0.00 0.00 0.00 36.38 35.27 2e7c s VAL 13 CO 0.26 -0.36 -0.06 -0.89 0.00 0.00 0.00 175.10 174.05 2e7c s THR 14 N 2.31 0.62 -0.07 3.92 2.01 -1.26 -5.14 115.64 118.02 2e7c s THR 14 Ca 0.08 -0.20 0.05 0.00 0.31 0.00 0.00 61.69 61.93 2e7c s THR 14 Cb -0.15 -0.61 -0.01 0.00 0.01 0.00 0.00 72.50 71.74 2e7c s THR 14 CO -0.22 0.23 -0.24 -0.63 -0.69 0.00 0.00 174.62 173.07 2e7c s ILE 15 N 0.69 2.10 -0.22 1.82 1.09 -1.26 -5.12 121.20 120.30 2e7c s ILE 15 Ca -0.10 -1.04 -0.10 0.00 -1.10 0.00 0.00 60.65 58.32 2e7c s ILE 15 Cb -0.13 -1.77 -0.05 0.00 -1.06 0.00 0.00 42.46 39.45 2e7c s ILE 15 CO 0.01 0.57 0.13 0.00 -0.10 0.00 0.00 174.94 175.54 2e7c s ARG 16 N 0.01 4.03 0.21 2.79 1.70 -1.26 -5.09 118.95 121.34 2e7c s ARG 16 Ca -0.09 -0.30 0.07 0.00 -0.47 0.00 0.00 55.73 54.95 2e7c s ARG 16 Cb -0.15 -3.44 -0.04 0.00 -0.57 0.00 0.00 34.95 30.75 2e7c s ARG 16 CO 0.05 0.12 0.10 -1.83 -1.08 0.00 0.00 175.30 172.66 2e7c s GLU 17 N 0.86 2.68 0.05 3.89 1.03 -1.26 -5.10 118.70 120.86 2e7c s GLU 17 Ca 0.07 -1.08 -0.28 0.00 0.03 0.00 0.00 54.97 53.71 2e7c s GLU 17 Cb -0.13 -2.47 -0.05 0.00 -0.80 0.00 0.00 34.13 30.68 2e7c s GLU 17 CO 0.03 0.43 0.87 0.42 -1.33 0.00 0.00 175.26 175.68 2e7c s ILE 18 N -1.96 4.70 0.11 1.83 1.01 -1.26 -4.97 121.20 120.66 2e7c s ILE 18 Ca 0.31 1.86 -0.23 0.00 0.00 0.00 0.00 60.65 62.59 2e7c s ILE 18 Cb -0.09 -4.23 -0.08 0.00 0.01 0.00 0.00 42.46 38.08 2e7c s ILE 18 CO 0.22 0.30 1.69 0.00 0.00 0.00 0.00 174.94 177.15 2e7c h ALA 19 N 5.94 -0.09 -3.30 9.38 0.00 -2.00 -3.43 119.26 125.76 2e7c h ALA 19 Ca -0.43 0.02 -0.24 0.00 0.00 0.00 0.00 54.91 54.26 2e7c h ALA 19 Cb 1.21 0.19 -0.31 0.00 0.00 0.00 0.00 17.79 18.88 2e7c h ALA 19 CO 0.72 -0.59 -0.60 -2.00 0.00 0.00 0.00 179.25 176.78 2e7c s GLU 20 N -6.16 0.09 0.57 0.00 2.56 -1.24 -4.91 118.70 109.61 2e7c s GLU 20 Ca -0.14 0.33 -0.18 0.00 0.00 0.00 0.00 54.97 54.98 2e7c s GLU 20 Cb 0.08 -0.15 -0.05 0.00 2.00 0.00 0.00 34.13 36.01 2e7c s GLU 20 CO 0.67 -0.15 1.13 -1.25 -0.56 0.00 0.00 175.26 175.10 2e7c s PRO 21 N 1.02 3.23 0.35 4.30 0.04 -1.26 -1.02 135.00 141.66 2e7c s PRO 21 Ca -0.08 1.56 -0.27 0.00 0.04 0.00 0.00 61.00 62.25 2e7c s PRO 21 Cb -0.10 -1.99 -0.09 0.00 0.04 0.00 0.00 34.50 32.35 2e7c s PRO 21 CO -0.05 -0.94 1.21 -1.25 0.04 0.00 0.00 177.00 176.01 2e7c s PRO 22 N -3.47 4.27 -0.26 0.56 0.04 -1.26 -3.71 135.00 131.17 2e7c s PRO 22 Ca 0.71 1.98 -0.09 0.00 0.04 0.00 0.00 61.00 63.64 2e7c s PRO 22 Cb -0.23 -2.92 0.11 0.00 0.04 0.00 0.00 34.50 31.50 2e7c s PRO 22 CO 0.30 -0.18 0.57 0.21 0.04 0.00 0.00 177.00 177.94 2e7c s LYS 23 N -1.95 0.49 -0.54 4.56 2.47 -0.79 -4.90 119.74 119.08 2e7c s LYS 23 Ca 0.52 1.29 -0.16 0.00 -1.56 0.00 0.00 55.97 56.06 2e7c s LYS 23 Cb -0.35 0.64 0.13 0.00 -1.46 0.00 0.00 37.83 36.80 2e7c s LYS 23 CO 0.45 -0.21 0.50 0.42 0.16 0.00 0.00 175.35 176.66 2e7c s ILE 24 N 2.72 5.16 -0.58 5.43 1.01 -1.26 -0.68 121.20 132.99 2e7c s ILE 24 Ca -0.05 -1.53 -0.27 0.00 0.00 0.00 0.00 60.65 58.80 2e7c s ILE 24 Cb -0.12 -4.31 0.03 0.00 0.01 0.00 0.00 42.46 38.08 2e7c s ILE 24 CO -0.17 -0.87 1.12 -0.13 0.00 0.00 0.00 174.94 174.89 2e7c s ARG 25 N 1.56 3.44 0.16 2.79 1.81 -0.91 -5.00 118.95 122.80 2e7c s ARG 25 Ca 0.03 0.06 -0.21 0.00 -1.72 0.00 0.00 55.73 53.89 2e7c s ARG 25 Cb -0.29 -4.04 -0.08 0.00 -0.45 0.00 0.00 34.95 30.09 2e7c s ARG 25 CO 0.03 -1.64 0.70 -0.51 -0.68 0.00 0.00 175.30 173.19 2e7c s LEU 26 N 4.67 4.48 0.00 2.53 1.43 -1.26 -3.75 118.68 126.78 2e7c s LEU 26 Ca 0.38 1.45 0.00 0.00 -1.03 0.00 0.00 54.13 54.93 2e7c s LEU 26 Cb -0.09 -3.29 0.00 0.00 0.03 0.00 0.00 46.19 42.84 2e7c s LEU 26 CO 0.23 0.16 0.00 -0.81 0.23 0.00 0.00 176.35 176.16 2e7c n PRO 27 N 1.30 -0.04 -0.03 1.29 -0.04 -1.26 -5.00 135.00 131.22 2e7c n PRO 27 Ca -0.06 0.00 0.03 0.00 -0.04 0.00 0.00 63.50 63.43 2e7c n PRO 27 Cb 0.50 0.00 0.04 0.00 -0.04 0.00 0.00 33.50 34.00 2e7c n PRO 27 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 2e7c n ARG 28 N -0.78 0.74 -0.01 0.54 1.85 -1.26 -4.39 116.66 113.35 2e7c n ARG 28 Ca 0.00 -1.12 0.08 0.00 -1.00 0.00 0.00 57.85 55.81 2e7c n ARG 28 Cb 0.00 -1.11 -0.11 0.00 -1.05 0.00 0.00 32.46 30.18 2e7c n ARG 28 CO 0.00 0.00 0.00 -2.39 -0.01 0.00 0.00 177.63 175.23 2e7c n HIS 29 N 0.21 0.00 -0.01 2.89 1.44 -1.26 -4.50 115.22 113.99 2e7c n HIS 29 Ca 0.04 0.00 -0.14 0.00 -2.01 0.00 0.00 57.72 55.61 2e7c n HIS 29 Cb 0.20 -0.30 -0.14 0.00 0.12 0.00 0.00 29.99 29.87 2e7c n HIS 29 CO 0.00 0.00 0.00 -0.07 -2.81 0.00 0.00 176.34 173.46 2e7c h LEU 30 N 0.00 0.19 -0.94 2.39 3.38 -1.97 -3.37 115.31 114.99 2e7c h LEU 30 Ca 0.00 -0.41 0.26 0.00 0.09 0.00 0.00 57.88 57.82 2e7c h LEU 30 Cb 0.65 -0.06 -0.14 0.00 0.09 0.00 0.00 40.66 41.20 2e7c h LEU 30 CO 0.00 1.37 0.41 0.03 0.09 0.00 0.00 178.44 180.34 2e7c h ARG 31 N 0.03 0.31 -6.15 1.13 3.08 -1.79 -3.40 114.38 107.59 2e7c h ARG 31 Ca -0.34 -0.02 -0.59 0.00 0.07 0.00 0.00 59.98 59.11 2e7c h ARG 31 Cb 2.02 -0.07 -0.05 0.00 0.08 0.00 0.00 29.97 31.96 2e7c h ARG 31 CO 0.09 0.21 -0.16 1.14 -1.07 0.00 0.00 179.97 180.17 2e7c s GLN 32 N -5.82 3.92 -0.45 0.04 -2.07 -1.26 -4.94 119.66 109.08 2e7c s GLN 32 Ca -0.11 0.40 -0.30 0.00 -1.82 0.00 0.00 55.36 53.52 2e7c s GLN 32 Cb 0.27 -3.07 -0.15 0.00 -1.09 0.00 0.00 33.01 28.98 2e7c s GLN 32 CO 0.78 0.59 1.67 2.41 -1.32 0.00 0.00 175.29 179.42 2e7c n THR 33 N 1.24 0.00 -2.11 3.63 -1.04 -1.26 -4.76 114.28 109.98 2e7c n THR 33 Ca -0.09 0.00 -0.43 0.00 -2.04 0.00 0.00 64.05 61.49 2e7c n THR 33 Cb 0.52 -0.37 -0.03 0.00 -1.82 0.00 0.00 70.33 68.63 2e7c n THR 33 CO 0.00 0.00 0.00 -0.47 -0.64 0.00 0.00 175.07 173.96 2e7c s TYR 34 N 4.93 2.09 -0.22 -1.42 5.04 -1.12 -4.87 117.35 121.78 2e7c s TYR 34 Ca 0.91 0.55 -0.10 0.00 -2.44 0.00 0.00 57.07 56.00 2e7c s TYR 34 Cb -1.07 -4.00 -0.05 0.00 0.35 0.00 0.00 41.96 37.19 2e7c s TYR 34 CO 0.46 -2.92 0.13 0.42 -1.34 0.00 0.00 175.55 172.31 2e7c s ILE 35 N 5.31 5.28 -0.11 3.14 -1.09 -1.26 0.18 121.20 132.65 2e7c s ILE 35 Ca 0.72 0.15 -0.13 0.00 -2.23 0.00 0.00 60.65 59.15 2e7c s ILE 35 Cb -0.24 -3.43 0.03 0.00 -1.58 0.00 0.00 42.46 37.24 2e7c s ILE 35 CO 0.30 0.40 0.36 -0.13 -1.23 0.00 0.00 174.94 174.63 2e7c s ARG 36 N 0.71 0.49 0.67 2.79 1.81 -0.87 -5.01 118.95 119.54 2e7c s ARG 36 Ca 0.07 0.34 -0.12 0.00 -1.72 0.00 0.00 55.73 54.31 2e7c s ARG 36 Cb -0.12 0.23 -0.01 0.00 -0.45 0.00 0.00 34.95 34.60 2e7c s ARG 36 CO 0.01 -0.08 1.05 0.15 -0.68 0.00 0.00 175.30 175.75 2e7c s LYS 37 N -0.17 3.08 0.68 3.54 1.02 -1.26 -1.01 119.74 125.61 2e7c s LYS 37 Ca -0.03 0.98 -0.12 0.00 0.02 0.00 0.00 55.97 56.81 2e7c s LYS 37 Cb -0.03 -2.01 0.00 0.00 -0.52 0.00 0.00 37.83 35.27 2e7c s LYS 37 CO 0.01 -0.98 1.06 0.14 -0.92 0.00 0.00 175.35 174.66 2e7c s VAL 38 N -2.95 3.87 0.00 3.17 -7.23 -0.42 -3.61 120.40 113.22 2e7c s VAL 38 Ca 0.59 0.68 0.00 0.00 -1.81 0.00 0.00 61.98 61.44 2e7c s VAL 38 Cb -0.14 -3.33 0.00 0.00 0.56 0.00 0.00 36.38 33.47 2e7c s VAL 38 CO 0.51 -0.72 0.00 0.61 -0.31 0.00 0.00 175.10 175.20 2e7c n GLY 39 N -1.59 1.60 3.77 2.32 0.00 -1.24 -4.84 105.19 105.21 2e7c n GLY 39 Ca 0.08 -0.04 -0.33 0.00 0.00 0.00 0.00 46.02 45.73 2e7c n GLY 39 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2e7c s GLU 40 N 0.00 2.71 0.55 1.61 0.41 -1.24 -4.16 118.70 118.59 2e7c s GLU 40 Ca 0.00 1.41 -0.16 0.00 -0.41 0.00 0.00 54.97 55.81 2e7c s GLU 40 Cb 0.00 -1.94 -0.06 0.00 -1.78 0.00 0.00 34.13 30.35 2e7c s GLU 40 CO 0.00 -1.33 1.02 -0.65 -0.49 0.00 0.00 175.26 173.81 2e7c s GLN 41 N -4.13 3.64 -0.20 1.61 1.11 -1.25 -1.86 119.66 118.59 2e7c s GLN 41 Ca 0.67 1.08 -0.03 0.00 0.01 0.00 0.00 55.36 57.09 2e7c s GLN 41 Cb -0.21 -2.09 -0.01 0.00 -1.01 0.00 0.00 33.01 29.69 2e7c s GLN 41 CO 0.43 -0.53 -0.06 -0.51 0.01 0.00 0.00 175.29 174.63 2e7c s LEU 42 N -4.27 2.90 -0.20 2.90 1.43 -1.17 -4.94 118.68 115.33 2e7c s LEU 42 Ca 0.61 -0.35 -0.00 0.00 -1.03 0.00 0.00 54.13 53.36 2e7c s LEU 42 Cb -0.13 -1.72 0.01 0.00 0.03 0.00 0.00 46.19 44.39 2e7c s LEU 42 CO 0.34 0.04 -0.15 0.21 0.23 0.00 0.00 176.35 177.02 2e7c s ASN 43 N 1.13 3.55 -0.29 2.29 2.47 -1.26 -3.29 114.94 119.54 2e7c s ASN 43 Ca 0.02 -0.62 -0.02 0.00 0.42 0.00 0.00 52.86 52.66 2e7c s ASN 43 Cb -0.15 -1.56 0.10 0.00 -1.45 0.00 0.00 41.25 38.19 2e7c s ASN 43 CO -0.01 -0.02 0.10 -0.76 -3.72 0.00 0.00 177.10 172.69 2e7c s LEU 44 N 1.34 1.79 -0.77 3.21 1.43 -1.16 -5.01 118.68 119.50 2e7c s LEU 44 Ca 0.04 -1.48 -0.15 0.00 -1.03 0.00 0.00 54.13 51.51 2e7c s LEU 44 Cb -0.14 -0.73 0.19 0.00 0.03 0.00 0.00 46.19 45.53 2e7c s LEU 44 CO -0.10 -0.41 0.75 -0.69 0.23 0.00 0.00 176.35 176.13 2e7c s VAL 45 N 1.74 5.41 -0.50 -1.59 1.01 -1.26 -2.70 120.40 122.50 2e7c s VAL 45 Ca 0.08 -2.12 -0.14 0.00 0.00 0.00 0.00 61.98 59.81 2e7c s VAL 45 Cb -0.17 -4.47 0.11 0.00 0.00 0.00 0.00 36.38 31.85 2e7c s VAL 45 CO -0.26 -1.05 0.43 -0.69 0.00 0.00 0.00 175.10 173.53 2e7c s VAL 46 N 0.82 4.99 0.82 2.92 1.01 -1.19 -4.87 120.40 124.91 2e7c s VAL 46 Ca 0.16 -1.42 -0.11 0.00 0.00 0.00 0.00 61.98 60.61 2e7c s VAL 46 Cb -0.14 -4.14 0.08 0.00 0.00 0.00 0.00 36.38 32.18 2e7c s VAL 46 CO -0.06 -0.75 1.09 -2.16 0.00 0.00 0.00 175.10 173.23 2e7c s PRO 47 N 1.56 1.87 -0.06 2.72 0.04 -1.25 -3.06 135.00 136.83 2e7c s PRO 47 Ca 0.04 1.04 -0.29 0.00 0.04 0.00 0.00 61.00 61.82 2e7c s PRO 47 Cb -0.27 -1.86 0.11 0.00 0.04 0.00 0.00 34.50 32.51 2e7c s PRO 47 CO 0.03 -1.88 0.89 -0.59 0.04 0.00 0.00 177.00 175.49 2e7c s PHE 48 N -2.92 -0.40 0.31 0.56 -0.12 -1.25 -2.15 117.98 112.02 2e7c s PHE 48 Ca 0.62 0.46 0.10 0.00 -0.05 0.00 0.00 56.93 58.06 2e7c s PHE 48 Cb -0.17 0.50 -0.05 0.00 -0.63 0.00 0.00 43.02 42.66 2e7c s PHE 48 CO 0.56 -0.50 -0.07 -0.65 -0.05 0.00 0.00 175.22 174.52 2e7c s GLN 49 N -2.25 1.97 0.00 1.99 -1.52 0.14 -4.57 119.66 115.41 2e7c s GLN 49 Ca 0.01 -1.72 0.00 0.00 -1.95 0.00 0.00 55.36 51.70 2e7c s GLN 49 Cb -0.01 -1.89 0.00 0.00 -0.22 0.00 0.00 33.01 30.89 2e7c s GLN 49 CO -0.03 0.23 0.00 0.41 -0.25 0.00 0.00 175.29 175.65 2e7c n GLY 50 N -0.82 4.25 3.26 3.09 0.00 -1.24 -1.88 105.19 111.84 2e7c n GLY 50 Ca -0.05 -0.86 -0.09 0.00 0.00 0.00 0.00 46.02 45.02 2e7c n GLY 50 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2e7c s LYS 51 N -3.10 0.96 -0.01 1.61 1.02 -0.19 -4.26 119.74 115.77 2e7c s LYS 51 Ca 0.00 -0.94 -0.25 0.00 0.02 0.00 0.00 55.97 54.79 2e7c s LYS 51 Cb 0.00 0.38 -0.20 0.00 -0.52 0.00 0.00 37.83 37.49 2e7c s LYS 51 CO 0.00 -0.33 1.28 -1.00 -0.92 0.00 0.00 175.35 174.38 2e7c h PRO 52 N 2.62 0.05 -3.51 -1.68 0.13 -1.96 -3.28 132.00 124.37 2e7c h PRO 52 Ca -0.33 -0.03 -0.61 0.00 -0.87 0.00 0.00 66.00 64.16 2e7c h PRO 52 Cb 1.22 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.95 2e7c h PRO 52 CO 0.52 0.52 -0.73 0.50 -0.23 0.00 0.00 178.00 178.59 2e7c s ARG 53 N -4.26 1.17 0.04 0.86 3.00 -1.26 -5.07 118.95 113.43 2e7c s ARG 53 Ca -0.16 -1.71 -0.31 0.00 -1.00 0.00 0.00 55.73 52.56 2e7c s ARG 53 Cb 0.02 -2.44 -0.06 0.00 0.00 0.00 0.00 34.95 32.46 2e7c s ARG 53 CO 0.69 -1.06 1.42 -1.25 0.00 0.00 0.00 175.30 175.09 2e7c s PRO 54 N 0.84 4.29 0.86 5.12 0.04 -1.26 -4.93 135.00 139.95 2e7c s PRO 54 Ca 0.14 2.03 -0.11 0.00 0.04 0.00 0.00 61.00 63.09 2e7c s PRO 54 Cb -0.21 -3.47 0.11 0.00 0.04 0.00 0.00 34.50 30.96 2e7c s PRO 54 CO -0.10 -0.54 1.09 -1.14 0.04 0.00 0.00 177.00 176.35 2e7c s GLN 55 N 2.00 1.55 -0.06 4.56 0.74 -0.44 -4.92 119.66 123.10 2e7c s GLN 55 Ca 0.65 0.92 -0.03 0.00 0.05 0.00 0.00 55.36 56.95 2e7c s GLN 55 Cb -0.34 -1.83 0.03 0.00 1.10 0.00 0.00 33.01 31.97 2e7c s GLN 55 CO 0.28 -2.07 0.13 0.08 -0.55 0.00 0.00 175.29 173.17 2e7c s VAL 56 N -2.93 -0.04 -0.07 1.34 1.01 -1.26 -3.42 120.40 115.04 2e7c s VAL 56 Ca 0.63 0.14 0.01 0.00 0.00 0.00 0.00 61.98 62.76 2e7c s VAL 56 Cb -0.18 -0.21 0.02 0.00 0.00 0.00 0.00 36.38 36.01 2e7c s VAL 56 CO 0.57 0.06 -0.09 -0.69 0.00 0.00 0.00 175.10 174.94 2e7c s VAL 57 N 0.87 0.90 -0.17 2.92 1.01 -0.75 -5.00 120.40 120.19 2e7c s VAL 57 Ca -0.07 -0.32 -0.02 0.00 0.00 0.00 0.00 61.98 61.58 2e7c s VAL 57 Cb -0.09 -0.87 -0.01 0.00 0.00 0.00 0.00 36.38 35.41 2e7c s VAL 57 CO -0.04 0.31 -0.10 0.26 0.00 0.00 0.00 175.10 175.53 2e7c s TRP 58 N 0.94 2.87 0.13 5.22 0.52 -1.26 -2.37 118.94 124.99 2e7c s TRP 58 Ca -0.10 -0.86 -0.01 0.00 0.02 0.00 0.00 56.10 55.16 2e7c s TRP 58 Cb -0.15 -1.96 -0.04 0.00 -1.15 0.00 0.00 33.47 30.18 2e7c s TRP 58 CO 0.01 -0.40 0.04 0.95 0.02 0.00 0.00 176.95 177.57 2e7c s THR 59 N 0.89 0.19 -0.30 2.01 -4.23 -0.70 -3.28 115.64 110.22 2e7c s THR 59 Ca -0.03 -1.92 0.07 0.00 -1.18 0.00 0.00 61.69 58.64 2e7c s THR 59 Cb -0.15 -2.03 0.46 0.00 1.34 0.00 0.00 72.50 72.12 2e7c s THR 59 CO 0.00 -0.49 1.23 0.29 -0.54 0.00 0.00 174.62 175.11 2e7c n LYS 60 N -0.10 3.36 0.00 3.99 5.02 -0.94 0.06 118.16 129.55 2e7c n LYS 60 Ca -0.06 -4.04 0.00 0.00 -2.02 0.00 0.00 58.31 52.19 2e7c n LYS 60 Cb 0.63 -2.21 0.00 0.00 -0.02 0.00 0.00 35.03 33.44 2e7c n LYS 60 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2e7c n GLY 61 N -0.76 1.42 0.00 0.72 0.00 -1.10 -4.50 105.19 100.96 2e7c n GLY 61 Ca 0.42 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.31 2e7c n GLY 61 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2e7c n GLY 62 N 0.00 0.05 3.87 -0.02 0.00 -1.26 -5.06 105.19 102.78 2e7c n GLY 62 Ca 0.00 -0.03 -0.29 0.00 0.00 0.00 0.00 46.02 45.70 2e7c n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2e7c s ALA 63 N -0.72 3.83 1.22 4.61 0.00 -1.26 -5.01 121.76 124.43 2e7c s ALA 63 Ca 0.00 -0.98 -0.18 0.00 0.00 0.00 0.00 51.96 50.80 2e7c s ALA 63 Cb 0.00 -1.65 0.27 0.00 0.00 0.00 0.00 23.12 21.74 2e7c s ALA 63 CO 0.00 0.70 0.96 -0.35 0.00 0.00 0.00 175.76 177.07 2e7c n PRO 64 N 0.05 -2.91 -2.81 0.00 -0.04 -1.26 -2.22 135.00 125.81 2e7c n PRO 64 Ca -0.07 -1.54 -0.22 0.00 -0.04 0.00 0.00 63.50 61.64 2e7c n PRO 64 Cb 0.52 -1.44 0.09 0.00 -0.04 0.00 0.00 33.50 32.63 2e7c n PRO 64 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2e7c s LEU 65 N 0.00 3.02 -0.79 1.53 1.43 -1.20 -4.74 118.68 117.93 2e7c s LEU 65 Ca 0.62 -0.64 0.01 0.00 -1.03 0.00 0.00 54.13 53.10 2e7c s LEU 65 Cb -0.06 -1.74 0.19 0.00 0.03 0.00 0.00 46.19 44.61 2e7c s LEU 65 CO 0.48 -1.65 0.63 -1.81 0.23 0.00 0.00 176.35 174.24 2e7c s ASP 66 N -4.72 5.47 0.57 2.29 1.01 -1.26 -4.92 116.67 115.11 2e7c s ASP 66 Ca 0.65 -3.67 0.44 0.00 0.71 0.00 0.00 52.55 50.68 2e7c s ASP 66 Cb -0.05 -1.80 1.53 0.00 1.01 0.00 0.00 42.92 43.61 2e7c s ASP 66 CO 0.42 -0.17 1.51 0.71 0.21 0.00 0.00 175.17 177.85 2e7c h THR 67 N 4.34 0.01 -0.52 -1.27 1.35 -1.98 0.38 112.91 115.22 2e7c h THR 67 Ca 0.13 0.00 0.11 0.00 -0.55 0.00 0.00 66.41 66.09 2e7c h THR 67 Cb 0.81 0.02 -0.09 0.00 -1.73 0.00 0.00 68.15 67.15 2e7c h THR 67 CO 0.79 0.00 -0.06 -1.28 -0.25 0.00 0.00 175.52 174.72 2e7c h SER 68 N 0.00 -0.35 0.01 5.36 0.87 -2.04 -3.23 113.55 114.17 2e7c h SER 68 Ca 0.82 0.14 -0.40 0.00 -1.23 0.00 0.00 61.79 61.12 2e7c h SER 68 Cb 3.54 0.27 -0.06 0.00 -0.44 0.00 0.00 62.40 65.71 2e7c h SER 68 CO -0.01 -0.13 -2.32 0.54 -0.53 0.00 0.00 176.83 174.38 2e7c n ARG 69 N -5.31 0.63 -2.89 2.24 1.74 0.12 -4.94 116.66 108.26 2e7c n ARG 69 Ca 0.06 0.25 -0.40 0.00 -0.77 0.00 0.00 57.85 56.99 2e7c n ARG 69 Cb 0.29 -1.56 -0.05 0.00 -1.02 0.00 0.00 32.46 30.12 2e7c n ARG 69 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2e7c s VAL 70 N -2.50 4.59 -0.43 1.55 1.01 -0.34 -4.82 120.40 119.46 2e7c s VAL 70 Ca -0.34 1.81 -0.09 0.00 0.00 0.00 0.00 61.98 63.35 2e7c s VAL 70 Cb 0.11 -4.20 0.09 0.00 0.00 0.00 0.00 36.38 32.38 2e7c s VAL 70 CO 0.58 0.37 0.28 -2.28 0.00 0.00 0.00 175.10 174.04 2e7c s HIS 71 N -0.19 3.36 -0.28 5.22 2.46 -1.02 -4.01 115.29 120.83 2e7c s HIS 71 Ca 0.41 -1.61 0.02 0.00 0.47 0.00 0.00 55.06 54.36 2e7c s HIS 71 Cb -0.22 -3.07 0.07 0.00 -0.13 0.00 0.00 32.58 29.23 2e7c s HIS 71 CO 0.26 -0.88 -0.06 0.08 -2.47 0.00 0.00 174.74 171.68 2e7c s VAL 72 N 1.41 2.34 -0.57 0.89 1.01 -1.26 -1.77 120.40 122.45 2e7c s VAL 72 Ca 0.04 -1.74 -0.20 0.00 0.00 0.00 0.00 61.98 60.07 2e7c s VAL 72 Cb -0.24 -2.45 0.07 0.00 0.00 0.00 0.00 36.38 33.77 2e7c s VAL 72 CO 0.01 -0.16 0.75 0.00 0.00 0.00 0.00 175.10 175.70 2e7c s ARG 73 N 1.09 3.12 0.12 2.72 1.70 -0.86 -4.93 118.95 121.90 2e7c s ARG 73 Ca -0.04 -0.96 -0.11 0.00 -0.47 0.00 0.00 55.73 54.15 2e7c s ARG 73 Cb -0.20 -4.17 -0.06 0.00 -0.57 0.00 0.00 34.95 29.94 2e7c s ARG 73 CO -0.05 -1.47 0.46 0.99 -1.08 0.00 0.00 175.30 174.15 2e7c s THR 74 N 3.05 5.01 -0.00 4.99 2.01 -1.26 -2.20 115.64 127.24 2e7c s THR 74 Ca 0.17 0.53 0.00 0.00 0.31 0.00 0.00 61.69 62.70 2e7c s THR 74 Cb -0.20 -3.67 0.00 0.00 0.01 0.00 0.00 72.50 68.65 2e7c s THR 74 CO 0.10 0.21 -0.01 -0.55 -0.69 0.00 0.00 174.62 173.68 2e7c s SER 75 N -1.88 0.15 0.57 3.53 0.15 -0.51 -4.97 113.70 110.74 2e7c s SER 75 Ca 0.37 -0.02 0.40 0.00 0.70 0.00 0.00 55.95 57.40 2e7c s SER 75 Cb -0.14 -0.02 1.37 0.00 -1.71 0.00 0.00 66.02 65.52 2e7c s SER 75 CO 0.19 0.01 1.42 -0.90 1.20 0.00 0.00 173.24 175.16 2e7c n ASP 76 N 3.11 0.00 -0.00 5.45 5.75 -1.26 -1.16 116.55 128.44 2e7c n ASP 76 Ca -0.13 0.88 -0.00 0.00 -0.01 0.00 0.00 54.79 55.53 2e7c n ASP 76 Cb 0.59 -0.39 -0.00 0.00 -1.03 0.00 0.00 41.12 40.29 2e7c n ASP 76 CO 0.00 0.00 0.00 -0.26 -0.11 0.00 0.00 177.20 176.83 2e7c h PHE 77 N 0.00 -0.01 -4.29 2.11 0.04 -1.95 -3.45 116.94 109.39 2e7c h PHE 77 Ca 0.74 -0.00 -0.16 0.00 2.80 0.00 0.00 57.97 61.35 2e7c h PHE 77 Cb 3.38 0.00 -0.15 0.00 2.20 0.00 0.00 35.95 41.39 2e7c h PHE 77 CO 0.00 -0.00 -0.59 0.16 -0.60 0.00 0.00 178.31 177.28 2e7c s ASP 78 N -3.27 0.28 0.17 2.17 -4.77 -0.31 -3.79 116.67 107.15 2e7c s ASP 78 Ca -0.00 -1.11 0.00 0.00 -3.30 0.00 0.00 52.55 48.14 2e7c s ASP 78 Cb 0.00 0.31 -0.04 0.00 -1.09 0.00 0.00 42.92 42.10 2e7c s ASP 78 CO 0.00 -0.74 0.34 0.28 0.70 0.00 0.00 175.17 175.75 2e7c s THR 79 N -4.01 5.26 -0.01 2.11 -1.32 -1.17 -1.42 115.64 115.07 2e7c s THR 79 Ca 0.20 -0.44 0.01 0.00 -1.21 0.00 0.00 61.69 60.25 2e7c s THR 79 Cb 0.07 -3.72 0.01 0.00 -1.51 0.00 0.00 72.50 67.34 2e7c s THR 79 CO -0.00 -0.10 -0.03 -0.69 -2.21 0.00 0.00 174.62 171.58 2e7c s VAL 80 N -1.78 0.32 -0.04 5.08 1.01 -0.93 -3.16 120.40 120.89 2e7c s VAL 80 Ca 0.37 -0.11 0.07 0.00 0.00 0.00 0.00 61.98 62.31 2e7c s VAL 80 Cb -0.11 -0.31 -0.02 0.00 0.00 0.00 0.00 36.38 35.94 2e7c s VAL 80 CO 0.28 0.12 -0.26 0.12 0.00 0.00 0.00 175.10 175.37 2e7c s PHE 81 N 0.26 2.38 -0.10 5.22 5.36 -1.10 -2.03 117.98 127.97 2e7c s PHE 81 Ca -0.03 -0.57 -0.08 0.00 -0.96 0.00 0.00 56.93 55.30 2e7c s PHE 81 Cb -0.06 -1.55 0.03 0.00 -0.34 0.00 0.00 43.02 41.11 2e7c s PHE 81 CO -0.00 -0.12 0.26 0.12 -1.46 0.00 0.00 175.22 174.01 2e7c s PHE 82 N -0.41 -0.31 -0.04 10.12 5.36 -0.73 -2.99 117.98 128.98 2e7c s PHE 82 Ca 0.04 0.74 0.01 0.00 -0.96 0.00 0.00 56.93 56.75 2e7c s PHE 82 Cb -0.12 0.09 0.02 0.00 -0.34 0.00 0.00 43.02 42.67 2e7c s PHE 82 CO 0.01 -0.17 -0.02 0.54 -1.46 0.00 0.00 175.22 174.11 2e7c s VAL 83 N 0.54 0.38 0.11 3.12 0.11 -1.21 -2.42 120.40 121.04 2e7c s VAL 83 Ca -0.03 -0.03 -0.32 0.00 -2.93 0.00 0.00 61.98 58.67 2e7c s VAL 83 Cb -0.05 -0.44 -0.12 0.00 -1.53 0.00 0.00 36.38 34.24 2e7c s VAL 83 CO -0.03 0.19 1.58 -0.09 -3.33 0.00 0.00 175.10 173.43 2e7c h ARG 84 N 7.25 -0.68 -4.77 1.54 9.65 -1.90 -3.10 114.38 122.36 2e7c h ARG 84 Ca -0.39 0.05 -0.57 0.00 -1.10 0.00 0.00 59.98 57.97 2e7c h ARG 84 Cb 1.14 0.16 -0.34 0.00 -1.39 0.00 0.00 29.97 29.54 2e7c h ARG 84 CO 0.46 -0.46 -0.83 -0.65 2.80 0.00 0.00 179.97 181.29 2e7c s GLN 85 N -5.89 2.13 -1.19 0.20 -0.21 -1.26 -3.92 119.66 109.52 2e7c s GLN 85 Ca -0.16 -0.55 -0.09 0.00 0.02 0.00 0.00 55.36 54.57 2e7c s GLN 85 Cb 0.07 -1.73 0.22 0.00 1.00 0.00 0.00 33.01 32.57 2e7c s GLN 85 CO 0.63 0.04 1.54 0.00 -2.12 0.00 0.00 175.29 175.38 2e7c n ALA 86 N 3.84 4.71 -1.65 6.09 0.00 -0.78 -4.81 120.51 127.91 2e7c n ALA 86 Ca -0.21 -4.45 -0.33 0.00 0.00 0.00 0.00 53.44 48.44 2e7c n ALA 86 Cb 0.52 -2.79 0.02 0.00 0.00 0.00 0.00 19.45 17.20 2e7c n ALA 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2e7c s ALA 87 N -0.20 2.67 0.60 0.00 0.00 -1.26 -3.59 121.76 119.97 2e7c s ALA 87 Ca 0.37 0.51 0.33 0.00 0.00 0.00 0.00 51.96 53.17 2e7c s ALA 87 Cb 0.02 -3.27 1.14 0.00 0.00 0.00 0.00 23.12 21.00 2e7c s ALA 87 CO 0.01 -0.89 1.39 0.00 0.00 0.00 0.00 175.76 176.28 2e7c h ARG 88 N 0.53 0.00 -0.31 0.00 -0.00 -1.95 1.27 114.38 113.93 2e7c h ARG 88 Ca -0.47 0.00 -0.08 0.00 -0.50 0.00 0.00 59.98 58.92 2e7c h ARG 88 Cb 1.23 0.00 -0.01 0.00 0.00 0.00 0.00 29.97 31.19 2e7c h ARG 88 CO 0.57 0.00 -0.12 0.77 0.00 0.00 0.00 179.97 181.18 2e7c h SER 89 N 0.00 0.64 -0.83 7.04 0.02 -1.98 -3.09 113.55 115.36 2e7c h SER 89 Ca 0.59 -0.39 0.17 0.00 -0.84 0.00 0.00 61.79 61.32 2e7c h SER 89 Cb 3.08 -0.18 -0.11 0.00 0.14 0.00 0.00 62.40 65.34 2e7c h SER 89 CO -0.01 0.89 0.35 0.44 -1.14 0.00 0.00 176.83 177.37 2e7c h ASP 90 N 0.39 0.33 -3.15 3.07 5.19 0.13 -3.42 116.42 118.96 2e7c h ASP 90 Ca 0.07 0.13 -0.58 0.00 -0.62 0.00 0.00 57.03 56.03 2e7c h ASP 90 Cb 0.64 0.10 0.14 0.00 0.18 0.00 0.00 39.33 40.39 2e7c h ASP 90 CO 0.04 0.08 0.11 -0.24 -3.12 0.00 0.00 179.24 176.11 2e7c n SER 91 N -5.00 1.00 0.00 6.45 2.88 -1.17 -4.82 113.62 112.96 2e7c n SER 91 Ca 0.18 0.97 0.00 0.00 -1.33 0.00 0.00 58.87 58.69 2e7c n SER 91 Cb 0.51 -1.35 0.00 0.00 -0.75 0.00 0.00 64.21 62.62 2e7c n SER 91 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2e7c n GLY 92 N 1.25 -0.52 2.73 0.46 0.00 -0.09 -4.97 105.19 104.05 2e7c n GLY 92 Ca 0.10 -0.31 -0.29 0.00 0.00 0.00 0.00 46.02 45.53 2e7c n GLY 92 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2e7c s GLU 93 N -1.24 0.70 -0.36 1.61 2.12 -1.26 -0.66 118.70 119.62 2e7c s GLU 93 Ca 0.00 -0.83 -0.23 0.00 0.36 0.00 0.00 54.97 54.27 2e7c s GLU 93 Cb 0.00 -1.99 0.01 0.00 0.26 0.00 0.00 34.13 32.41 2e7c s GLU 93 CO 0.00 -0.87 0.77 0.71 -0.54 0.00 0.00 175.26 175.34 2e7c s TYR 94 N 1.72 3.12 -0.24 5.30 1.51 0.20 -2.70 117.35 126.26 2e7c s TYR 94 Ca 0.06 0.55 -0.11 0.00 -1.01 0.00 0.00 57.07 56.56 2e7c s TYR 94 Cb -0.17 -3.37 -0.05 0.00 -0.11 0.00 0.00 41.96 38.26 2e7c s TYR 94 CO -0.20 -0.72 0.19 -2.00 -1.11 0.00 0.00 175.55 171.71 2e7c s GLU 95 N 3.06 4.06 -0.06 -0.62 -6.30 0.11 0.37 118.70 119.31 2e7c s GLU 95 Ca 0.31 -0.24 0.02 0.00 -2.50 0.00 0.00 54.97 52.56 2e7c s GLU 95 Cb -0.13 -3.56 -0.03 0.00 0.00 0.00 0.00 34.13 30.41 2e7c s GLU 95 CO 0.16 0.01 -0.11 -1.17 0.02 0.00 0.00 175.26 174.17 2e7c s LEU 96 N 1.21 2.91 0.05 2.70 2.96 0.14 -1.72 118.68 126.94 2e7c s LEU 96 Ca 0.08 -0.14 -0.01 0.00 -0.22 0.00 0.00 54.13 53.85 2e7c s LEU 96 Cb -0.14 -1.61 -0.04 0.00 0.50 0.00 0.00 46.19 44.90 2e7c s LEU 96 CO 0.06 0.34 -0.03 -0.94 -1.32 0.00 0.00 176.35 174.45 2e7c s SER 97 N -0.66 0.54 -0.21 3.68 1.04 -1.00 0.17 113.70 117.27 2e7c s SER 97 Ca 0.10 -1.00 -0.02 0.00 0.48 0.00 0.00 55.95 55.51 2e7c s SER 97 Cb -0.11 0.19 0.06 0.00 0.10 0.00 0.00 66.02 66.26 2e7c s SER 97 CO 0.01 -0.59 0.02 -0.69 0.98 0.00 0.00 173.24 172.97 2e7c s VAL 98 N -3.90 0.76 -0.14 5.02 1.01 0.61 -1.81 120.40 121.95 2e7c s VAL 98 Ca 0.07 -0.74 -0.19 0.00 0.00 0.00 0.00 61.98 61.12 2e7c s VAL 98 Cb 0.08 -1.23 -0.04 0.00 0.00 0.00 0.00 36.38 35.19 2e7c s VAL 98 CO -0.10 -0.21 0.54 -1.58 0.00 0.00 0.00 175.10 173.75 2e7c s GLN 99 N 1.75 4.30 0.26 2.72 0.74 -1.22 -0.09 119.66 128.12 2e7c s GLN 99 Ca -0.02 0.53 0.10 0.00 0.05 0.00 0.00 55.36 56.02 2e7c s GLN 99 Cb -0.17 -3.49 -0.05 0.00 1.10 0.00 0.00 33.01 30.40 2e7c s GLN 99 CO -0.08 0.02 -0.17 0.42 -0.55 0.00 0.00 175.29 174.92 2e7c s ILE 100 N 1.07 2.17 0.09 -2.34 -1.09 0.22 -1.32 121.20 120.00 2e7c s ILE 100 Ca 0.28 -2.32 -0.15 0.00 -2.23 0.00 0.00 60.65 56.23 2e7c s ILE 100 Cb -0.16 -2.23 -0.02 0.00 -1.58 0.00 0.00 42.46 38.47 2e7c s ILE 100 CO 0.11 -0.45 0.79 -0.62 -1.23 0.00 0.00 174.94 173.54 2e7c n GLU 101 N -0.54 -0.21 0.00 2.79 -0.58 -1.26 -3.04 120.64 117.79 2e7c n GLU 101 Ca -0.06 0.78 0.00 0.00 -0.42 0.00 0.00 57.16 57.45 2e7c n GLU 101 Cb 0.60 -1.14 0.00 0.00 -0.57 0.00 0.00 31.44 30.33 2e7c n GLU 101 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 2e7c n ASN 102 N -4.65 3.36 -4.97 1.62 5.15 -1.26 -5.07 115.26 109.44 2e7c n ASN 102 Ca 0.02 -0.04 -0.21 0.00 -0.60 0.00 0.00 54.58 53.75 2e7c n ASN 102 Cb 0.14 0.74 0.01 0.00 -0.53 0.00 0.00 39.78 40.15 2e7c n ASN 102 CO 0.00 0.00 0.00 -0.04 1.40 0.00 0.00 177.26 178.62 2e7c s MET 103 N -1.42 2.97 0.01 1.20 -1.94 -1.17 -5.12 119.30 113.83 2e7c s MET 103 Ca 0.00 -0.76 -0.29 0.00 -1.71 0.00 0.00 55.69 52.93 2e7c s MET 103 Cb 0.00 -2.64 0.07 0.00 2.01 0.00 0.00 34.83 34.27 2e7c s MET 103 CO 0.00 -0.24 0.66 0.21 -0.01 0.00 0.00 175.02 175.64 2e7c s LYS 104 N -4.45 1.12 0.05 2.03 2.20 -1.26 0.71 119.74 120.14 2e7c s LYS 104 Ca 0.49 0.05 -0.02 0.00 -0.36 0.00 0.00 55.97 56.14 2e7c s LYS 104 Cb -0.10 0.52 -0.04 0.00 -1.51 0.00 0.00 37.83 36.71 2e7c s LYS 104 CO 0.35 -0.39 -0.01 0.34 -0.36 0.00 0.00 175.35 175.28 2e7c s ASP 105 N -1.63 0.46 0.11 1.43 -1.08 0.88 -4.94 116.67 111.90 2e7c s ASP 105 Ca -0.08 -0.98 -0.05 0.00 -0.52 0.00 0.00 52.55 50.93 2e7c s ASP 105 Cb -0.00 0.21 -0.02 0.00 -1.46 0.00 0.00 42.92 41.65 2e7c s ASP 105 CO 0.03 -0.61 0.13 0.42 0.52 0.00 0.00 175.17 175.66 2e7c s THR 106 N -3.92 0.13 -0.15 1.71 -4.23 -1.26 -0.29 115.64 107.63 2e7c s THR 106 Ca 0.07 -1.57 -0.29 0.00 -1.18 0.00 0.00 61.69 58.72 2e7c s THR 106 Cb 0.08 -1.69 0.11 0.00 1.34 0.00 0.00 72.50 72.34 2e7c s THR 106 CO -0.10 -0.60 0.91 0.00 -0.54 0.00 0.00 174.62 174.29 2e7c s ALA 107 N -3.95 -1.89 -0.05 3.99 0.00 0.46 -4.90 121.76 115.42 2e7c s ALA 107 Ca 0.13 1.58 0.05 0.00 0.00 0.00 0.00 51.96 53.72 2e7c s ALA 107 Cb 0.06 -0.65 -0.01 0.00 0.00 0.00 0.00 23.12 22.53 2e7c s ALA 107 CO -0.05 -0.32 -0.20 0.99 0.00 0.00 0.00 175.76 176.18 2e7c s THR 108 N -0.89 1.70 0.08 0.00 2.01 -1.26 0.28 115.64 117.56 2e7c s THR 108 Ca -0.03 -0.86 0.08 0.00 0.31 0.00 0.00 61.69 61.19 2e7c s THR 108 Cb -0.01 -1.45 -0.03 0.00 0.01 0.00 0.00 72.50 71.02 2e7c s THR 108 CO 0.03 0.48 -0.23 -0.63 -0.69 0.00 0.00 174.62 173.58 2e7c s ILE 109 N 0.00 1.84 -0.17 1.82 1.01 0.16 -4.97 121.20 120.90 2e7c s ILE 109 Ca -0.05 -1.44 0.01 0.00 0.00 0.00 0.00 60.65 59.16 2e7c s ILE 109 Cb -0.13 -1.63 0.01 0.00 0.01 0.00 0.00 42.46 40.72 2e7c s ILE 109 CO 0.03 0.11 -0.17 -0.13 0.00 0.00 0.00 174.94 174.78 2e7c s ARG 110 N -1.59 3.12 -0.05 2.79 0.52 -1.26 -0.63 118.95 121.84 2e7c s ARG 110 Ca 0.09 -0.79 0.06 0.00 -0.52 0.00 0.00 55.73 54.57 2e7c s ARG 110 Cb -0.10 -2.60 -0.01 0.00 0.52 0.00 0.00 34.95 32.76 2e7c s ARG 110 CO 0.03 -0.08 -0.25 0.42 0.02 0.00 0.00 175.30 175.45 2e7c s ILE 111 N 1.02 2.00 -0.07 1.52 1.01 0.17 -2.81 121.20 124.04 2e7c s ILE 111 Ca -0.02 -1.04 0.03 0.00 0.00 0.00 0.00 60.65 59.62 2e7c s ILE 111 Cb -0.15 -1.69 0.01 0.00 0.01 0.00 0.00 42.46 40.64 2e7c s ILE 111 CO -0.05 0.56 -0.16 -0.60 0.00 0.00 0.00 174.94 174.69 2e7c s ARG 112 N -0.21 2.14 -0.11 2.79 3.52 0.13 -0.91 118.95 126.30 2e7c s ARG 112 Ca -0.02 -0.58 -0.01 0.00 -0.13 0.00 0.00 55.73 54.99 2e7c s ARG 112 Cb -0.13 -1.70 -0.03 0.00 -1.56 0.00 0.00 34.95 31.53 2e7c s ARG 112 CO 0.03 0.10 -0.07 0.08 -0.81 0.00 0.00 175.30 174.62 2e7c s VAL 113 N 0.50 3.60 0.13 7.11 1.01 -1.26 -2.04 120.40 129.45 2e7c s VAL 113 Ca -0.15 -0.49 0.10 0.00 0.00 0.00 0.00 61.98 61.45 2e7c s VAL 113 Cb -0.16 -2.52 -0.04 0.00 0.00 0.00 0.00 36.38 33.66 2e7c s VAL 113 CO 0.05 0.54 -0.22 0.68 0.00 0.00 0.00 175.10 176.16 2e7c s VAL 114 N -0.13 2.56 0.45 2.92 -7.23 -0.18 -4.89 120.40 113.90 2e7c s VAL 114 Ca 0.01 -1.68 -0.18 0.00 -1.81 0.00 0.00 61.98 58.32 2e7c s VAL 114 Cb -0.13 -2.17 -0.09 0.00 0.56 0.00 0.00 36.38 34.55 2e7c s VAL 114 CO 0.03 0.06 0.93 -1.61 -0.31 0.00 0.00 175.10 174.20 2e7c s GLU 115 N -2.20 4.06 0.35 4.82 2.02 -1.26 -1.30 118.70 125.19 2e7c s GLU 115 Ca 0.17 0.97 -0.26 0.00 0.02 0.00 0.00 54.97 55.86 2e7c s GLU 115 Cb -0.10 -2.20 -0.09 0.00 0.10 0.00 0.00 34.13 31.84 2e7c s GLU 115 CO 0.09 -0.11 1.10 0.21 0.02 0.00 0.00 175.26 176.56 2e7c s LYS 116 N -3.57 4.32 0.09 1.61 2.20 -1.26 -4.86 119.74 118.26 2e7c s LYS 116 Ca 0.59 1.71 -0.34 0.00 -0.36 0.00 0.00 55.97 57.57 2e7c s LYS 116 Cb -0.10 -2.82 -0.13 0.00 -1.51 0.00 0.00 37.83 33.27 2e7c s LYS 116 CO 0.22 -0.05 1.68 0.00 -0.36 0.00 0.00 175.35 176.84 2e7c n ALA 117 N 0.44 1.32 0.00 3.13 0.00 -1.26 -5.12 120.51 119.02 2e7c n ALA 117 Ca 0.02 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.86 2e7c n ALA 117 Cb 0.47 -2.41 0.00 0.00 0.00 0.00 0.00 19.45 17.51 2e7c n ALA 117 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91