#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 0.87 0.41 1.61 0.15 -1.26 -5.16 113.70 110.32 2e7c s SER 2 Ca 0.00 0.02 0.08 0.00 0.70 0.00 0.00 55.95 56.75 2e7c s SER 2 Cb 0.00 0.68 0.01 0.00 -1.71 0.00 0.00 66.02 65.00 2e7c s SER 2 CO 0.00 -0.31 0.55 -0.94 1.20 0.00 0.00 173.24 173.74 2e7c s SER 3 N 2.41 5.65 -0.02 5.45 1.04 -1.26 -5.12 113.70 121.85 2e7c s SER 3 Ca 0.08 -0.41 0.07 0.00 0.48 0.00 0.00 55.95 56.17 2e7c s SER 3 Cb -0.15 -0.72 -0.02 0.00 0.10 0.00 0.00 66.02 65.23 2e7c s SER 3 CO -0.13 -0.72 -0.24 -0.83 0.98 0.00 0.00 173.24 172.30 2e7c s GLY 4 N -4.32 1.20 -0.22 7.32 0.00 -1.26 -5.12 107.32 104.92 2e7c s GLY 4 Ca 0.53 -1.04 -0.29 0.00 0.00 0.00 0.00 44.72 43.92 2e7c s GLY 4 CO 0.32 -0.84 1.16 -1.35 0.00 0.00 0.00 173.10 172.39 2e7c s SER 5 N -0.52 -0.24 0.28 1.64 1.04 -1.26 -5.18 113.70 109.46 2e7c s SER 5 Ca 0.08 0.29 0.09 0.00 0.48 0.00 0.00 55.95 56.89 2e7c s SER 5 Cb -0.10 0.24 -0.04 0.00 0.10 0.00 0.00 66.02 66.22 2e7c s SER 5 CO -0.00 -0.20 0.09 -0.44 0.98 0.00 0.00 173.24 173.66 2e7c s SER 6 N -0.90 4.83 0.00 7.02 0.01 -1.26 -5.12 113.70 118.28 2e7c s SER 6 Ca 0.03 -0.58 0.00 0.00 1.31 0.00 0.00 55.95 56.71 2e7c s SER 6 Cb -0.01 -0.95 0.00 0.00 0.21 0.00 0.00 66.02 65.27 2e7c s SER 6 CO -0.03 -0.09 0.00 0.61 0.41 0.00 0.00 173.24 174.13 2e7c n GLY 7 N -1.04 3.47 3.32 3.44 0.00 -1.26 -5.18 105.19 107.94 2e7c n GLY 7 Ca -0.06 -0.89 -0.09 0.00 0.00 0.00 0.00 46.02 44.98 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 -2.00 0.07 -0.21 2.61 -1.32 -1.26 -5.15 115.64 108.38 2e7c s THR 8 Ca 0.00 -1.36 -0.06 0.00 -1.21 0.00 0.00 61.69 59.05 2e7c s THR 8 Cb 0.00 -1.79 -0.03 0.00 -1.51 0.00 0.00 72.50 69.17 2e7c s THR 8 CO 0.00 -0.33 0.03 -0.76 -2.21 0.00 0.00 174.62 171.35 2e7c s LEU 9 N -2.96 3.41 -0.30 9.08 1.43 -1.26 -5.06 118.68 123.02 2e7c s LEU 9 Ca 0.16 -0.15 -0.16 0.00 -1.03 0.00 0.00 54.13 52.94 2e7c s LEU 9 Cb 0.03 -1.88 0.17 0.00 0.03 0.00 0.00 46.19 44.55 2e7c s LEU 9 CO -0.01 0.05 1.07 0.00 0.23 0.00 0.00 176.35 177.69 2e7c s ALA 10 N 1.07 -2.69 0.28 4.21 0.00 -1.26 -5.15 121.76 118.24 2e7c s ALA 10 Ca 0.03 2.04 -0.27 0.00 0.00 0.00 0.00 51.96 53.76 2e7c s ALA 10 Cb -0.14 -2.00 -0.15 0.00 0.00 0.00 0.00 23.12 20.83 2e7c s ALA 10 CO 0.02 -0.72 0.79 0.00 0.00 0.00 0.00 175.76 175.85 2e7c n GLN 11 N 4.35 0.82 -1.16 0.00 10.64 -1.26 -4.94 117.38 125.84 2e7c n GLN 11 Ca -0.12 0.29 -0.28 0.00 -1.83 0.00 0.00 57.00 55.05 2e7c n GLN 11 Cb 0.55 -1.54 0.18 0.00 -0.86 0.00 0.00 30.24 28.57 2e7c n GLN 11 CO 0.00 0.00 0.00 -1.25 -1.83 0.00 0.00 177.06 173.98 2e7c s PRO 12 N -1.39 0.31 -0.22 2.61 0.04 -1.26 -5.05 135.00 130.03 2e7c s PRO 12 Ca 0.61 0.48 0.00 0.00 0.04 0.00 0.00 61.00 62.13 2e7c s PRO 12 Cb -0.75 -1.73 0.03 0.00 0.04 0.00 0.00 34.50 32.09 2e7c s PRO 12 CO 0.58 -2.81 -0.13 0.08 0.04 0.00 0.00 177.00 174.77 2e7c s VAL 13 N -2.97 2.42 -0.30 -0.36 1.01 -1.26 -5.10 120.40 113.85 2e7c s VAL 13 Ca 0.66 -1.09 -0.13 0.00 0.00 0.00 0.00 61.98 61.42 2e7c s VAL 13 Cb -0.19 -2.18 -0.04 0.00 0.00 0.00 0.00 36.38 33.98 2e7c s VAL 13 CO 0.58 0.30 0.25 -0.89 0.00 0.00 0.00 175.10 175.34 2e7c s THR 14 N 1.27 5.27 -0.20 3.92 2.01 -1.26 -5.05 115.64 121.60 2e7c s THR 14 Ca 0.00 0.15 -0.15 0.00 0.31 0.00 0.00 61.69 62.00 2e7c s THR 14 Cb -0.16 -3.63 0.06 0.00 0.01 0.00 0.00 72.50 68.78 2e7c s THR 14 CO -0.08 0.14 0.51 -0.63 -0.69 0.00 0.00 174.62 173.87 2e7c s ILE 15 N 1.84 -0.01 0.46 1.82 1.01 -1.26 -5.15 121.20 119.92 2e7c s ILE 15 Ca 0.09 0.02 -0.23 0.00 0.00 0.00 0.00 60.65 60.53 2e7c s ILE 15 Cb -0.16 -0.72 -0.09 0.00 0.01 0.00 0.00 42.46 41.49 2e7c s ILE 15 CO 0.11 0.01 0.96 0.54 0.00 0.00 0.00 174.94 176.55 2e7c n ARG 16 N 3.33 1.20 -4.18 2.79 3.00 -1.26 -5.00 116.66 116.54 2e7c n ARG 16 Ca -0.17 0.44 -0.30 0.00 -0.01 0.00 0.00 57.85 57.81 2e7c n ARG 16 Cb 0.56 -2.03 -0.09 0.00 0.00 0.00 0.00 32.46 30.91 2e7c n ARG 16 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.63 175.63 2e7c s GLU 17 N -2.14 2.34 0.46 5.56 2.12 -1.26 -5.10 118.70 120.68 2e7c s GLU 17 Ca 0.66 -0.95 -0.21 0.00 0.36 0.00 0.00 54.97 54.82 2e7c s GLU 17 Cb -0.52 -2.41 -0.09 0.00 0.26 0.00 0.00 34.13 31.36 2e7c s GLU 17 CO 0.55 0.52 1.03 0.42 -0.54 0.00 0.00 175.26 177.23 2e7c s ILE 18 N -1.32 3.85 -0.14 -3.70 1.01 -1.26 -5.00 121.20 114.64 2e7c s ILE 18 Ca 0.24 1.22 -0.24 0.00 0.00 0.00 0.00 60.65 61.87 2e7c s ILE 18 Cb -0.11 -3.53 -0.25 0.00 0.01 0.00 0.00 42.46 38.58 2e7c s ILE 18 CO 0.16 -0.18 0.61 0.00 0.00 0.00 0.00 174.94 175.53 2e7c h ALA 19 N 1.85 0.08 -2.99 9.38 0.00 -2.00 -3.48 119.26 122.11 2e7c h ALA 19 Ca -0.49 -0.79 -0.17 0.00 0.00 0.00 0.00 54.91 53.45 2e7c h ALA 19 Cb 1.21 0.27 -0.28 0.00 0.00 0.00 0.00 17.79 19.00 2e7c h ALA 19 CO 0.60 0.34 -0.43 -2.00 0.00 0.00 0.00 179.25 177.76 2e7c s GLU 20 N -2.32 0.27 0.58 0.00 2.12 -1.22 -4.89 118.70 113.24 2e7c s GLU 20 Ca -0.21 0.51 -0.18 0.00 0.36 0.00 0.00 54.97 55.45 2e7c s GLU 20 Cb 0.01 -0.02 -0.04 0.00 0.26 0.00 0.00 34.13 34.34 2e7c s GLU 20 CO 0.69 -0.12 1.12 -1.25 -0.54 0.00 0.00 175.26 175.16 2e7c s PRO 21 N 0.91 3.17 0.29 4.30 0.04 -1.26 -1.27 135.00 141.19 2e7c s PRO 21 Ca -0.06 1.54 -0.29 0.00 0.04 0.00 0.00 61.00 62.22 2e7c s PRO 21 Cb -0.07 -1.99 -0.10 0.00 0.04 0.00 0.00 34.50 32.38 2e7c s PRO 21 CO -0.06 -0.98 1.24 -1.25 0.04 0.00 0.00 177.00 175.99 2e7c s PRO 22 N -3.55 4.45 -0.17 0.56 0.04 -1.26 -3.85 135.00 131.21 2e7c s PRO 22 Ca 0.71 2.06 -0.05 0.00 0.04 0.00 0.00 61.00 63.75 2e7c s PRO 22 Cb -0.23 -3.13 0.08 0.00 0.04 0.00 0.00 34.50 31.26 2e7c s PRO 22 CO 0.32 -0.07 0.33 0.21 0.04 0.00 0.00 177.00 177.82 2e7c s LYS 23 N -1.38 0.23 -0.77 4.56 2.47 -0.74 -4.88 119.74 119.23 2e7c s LYS 23 Ca 0.49 0.79 -0.19 0.00 -1.56 0.00 0.00 55.97 55.51 2e7c s LYS 23 Cb -0.37 -0.02 0.13 0.00 -1.46 0.00 0.00 37.83 36.11 2e7c s LYS 23 CO 0.47 -0.33 0.92 0.42 0.16 0.00 0.00 175.35 176.98 2e7c s ILE 24 N 2.50 4.85 -0.57 5.43 1.01 -1.26 -0.84 121.20 132.31 2e7c s ILE 24 Ca 0.02 -1.38 -0.27 0.00 0.00 0.00 0.00 60.65 59.01 2e7c s ILE 24 Cb -0.13 -4.63 -0.01 0.00 0.01 0.00 0.00 42.46 37.71 2e7c s ILE 24 CO -0.11 -1.31 1.70 -0.13 0.00 0.00 0.00 174.94 175.09 2e7c s ARG 25 N 2.45 2.94 -0.19 2.79 1.81 -0.72 -4.97 118.95 123.06 2e7c s ARG 25 Ca 0.22 0.63 -0.18 0.00 -1.72 0.00 0.00 55.73 54.68 2e7c s ARG 25 Cb -0.13 -4.28 -0.03 0.00 -0.45 0.00 0.00 34.95 30.05 2e7c s ARG 25 CO -0.02 -2.36 0.50 -0.51 -0.68 0.00 0.00 175.30 172.23 2e7c s LEU 26 N 7.76 4.16 0.92 2.53 1.43 -1.26 -3.91 118.68 130.32 2e7c s LEU 26 Ca 0.63 0.67 -0.12 0.00 -1.03 0.00 0.00 54.13 54.28 2e7c s LEU 26 Cb -0.13 -2.69 0.14 0.00 0.03 0.00 0.00 46.19 43.54 2e7c s LEU 26 CO 0.23 -0.15 1.09 -2.16 0.23 0.00 0.00 176.35 175.59 2e7c s PRO 27 N 1.51 1.04 0.42 1.29 0.04 -1.26 -4.93 135.00 133.11 2e7c s PRO 27 Ca 0.24 0.74 0.23 0.00 0.04 0.00 0.00 61.00 62.25 2e7c s PRO 27 Cb -0.15 -1.79 0.75 0.00 0.04 0.00 0.00 34.50 33.35 2e7c s PRO 27 CO 0.10 -2.37 1.75 -0.09 0.04 0.00 0.00 177.00 176.43 2e7c h ARG 28 N -1.64 0.00 0.00 4.56 2.43 -1.98 -2.68 114.38 115.08 2e7c h ARG 28 Ca -0.51 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.66 2e7c h ARG 28 Cb 1.30 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.85 2e7c h ARG 28 CO 0.55 0.24 0.00 -2.39 -1.51 0.00 0.00 179.97 176.86 2e7c n HIS 29 N -3.31 0.00 0.53 2.20 1.44 -1.26 -2.92 115.22 111.90 2e7c n HIS 29 Ca 0.01 0.00 0.06 0.00 -2.01 0.00 0.00 57.72 55.78 2e7c n HIS 29 Cb 0.48 -0.42 -0.08 0.00 0.12 0.00 0.00 29.99 30.09 2e7c n HIS 29 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2e7c n LEU 30 N -1.42 0.53 -1.18 2.39 4.77 -1.02 -4.47 117.00 116.60 2e7c n LEU 30 Ca 0.09 -0.44 -0.04 0.00 -0.03 0.00 0.00 56.01 55.59 2e7c n LEU 30 Cb 0.28 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.41 2e7c n LEU 30 CO 0.23 0.13 0.61 0.54 -1.33 0.00 0.00 177.39 177.58 2e7c n ARG 31 N -1.38 1.28 -3.59 3.23 1.74 -1.12 -4.63 116.66 112.18 2e7c n ARG 31 Ca 0.02 -0.55 -0.15 0.00 -0.77 0.00 0.00 57.85 56.40 2e7c n ARG 31 Cb 0.22 -1.26 -0.07 0.00 -1.02 0.00 0.00 32.46 30.33 2e7c n ARG 31 CO 0.00 0.00 0.00 1.14 -1.52 0.00 0.00 177.63 177.25 2e7c s GLN 32 N -0.68 0.86 -0.58 5.56 -2.07 -1.26 -5.08 119.66 116.40 2e7c s GLN 32 Ca 0.10 0.67 -0.35 0.00 -1.82 0.00 0.00 55.36 53.96 2e7c s GLN 32 Cb 0.09 0.41 -0.18 0.00 -1.09 0.00 0.00 33.01 32.24 2e7c s GLN 32 CO 0.02 -0.17 2.05 2.41 -1.32 0.00 0.00 175.29 178.28 2e7c n THR 33 N 1.96 0.00 -1.89 3.63 -1.04 -1.26 -4.73 114.28 110.95 2e7c n THR 33 Ca -0.15 0.00 -0.37 0.00 -2.04 0.00 0.00 64.05 61.49 2e7c n THR 33 Cb 0.56 -0.44 -0.03 0.00 -1.82 0.00 0.00 70.33 68.59 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 6.14 1.48 -0.22 -1.42 5.04 -0.92 -4.85 117.35 122.60 2e7c s TYR 34 Ca 1.11 1.04 -0.24 0.00 -2.44 0.00 0.00 57.07 56.53 2e7c s TYR 34 Cb -1.26 -3.92 -0.01 0.00 0.35 0.00 0.00 41.96 37.12 2e7c s TYR 34 CO 0.54 -2.33 0.81 0.42 -1.34 0.00 0.00 175.55 173.65 2e7c s ILE 35 N 10.19 4.87 0.17 3.14 -1.09 -1.26 -0.58 121.20 136.64 2e7c s ILE 35 Ca 0.77 1.55 -0.03 0.00 -2.23 0.00 0.00 60.65 60.71 2e7c s ILE 35 Cb -0.14 -4.11 -0.03 0.00 -1.58 0.00 0.00 42.46 36.61 2e7c s ILE 35 CO 0.21 -0.03 0.15 -0.13 -1.23 0.00 0.00 174.94 173.92 2e7c s ARG 36 N 2.56 1.12 0.32 2.79 1.81 -0.70 -5.01 118.95 121.84 2e7c s ARG 36 Ca 0.35 -1.46 0.06 0.00 -1.72 0.00 0.00 55.73 52.97 2e7c s ARG 36 Cb -0.16 0.29 -0.01 0.00 -0.45 0.00 0.00 34.95 34.62 2e7c s ARG 36 CO 0.09 -0.37 0.45 0.15 -0.68 0.00 0.00 175.30 174.94 2e7c s LYS 37 N -4.08 3.17 0.40 3.54 1.02 -1.26 -0.17 119.74 122.36 2e7c s LYS 37 Ca 0.29 -0.97 -0.23 0.00 0.02 0.00 0.00 55.97 55.07 2e7c s LYS 37 Cb 0.06 -2.83 -0.10 0.00 -0.52 0.00 0.00 37.83 34.45 2e7c s LYS 37 CO 0.06 0.13 1.00 0.08 -0.92 0.00 0.00 175.35 175.70 2e7c s VAL 38 N -2.14 4.00 0.00 3.17 1.01 -0.52 -3.68 120.40 122.24 2e7c s VAL 38 Ca 0.43 1.45 0.00 0.00 0.00 0.00 0.00 61.98 63.86 2e7c s VAL 38 Cb -0.09 -3.71 0.00 0.00 0.00 0.00 0.00 36.38 32.58 2e7c s VAL 38 CO 0.31 -0.07 0.00 0.61 0.00 0.00 0.00 175.10 175.95 2e7c n GLY 39 N 0.09 1.59 3.49 4.51 0.00 -1.16 -4.79 105.19 108.93 2e7c n GLY 39 Ca 0.05 -0.21 -0.33 0.00 0.00 0.00 0.00 46.02 45.53 2e7c n GLY 39 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2e7c n GLU 40 N 0.00 -0.19 -3.19 1.61 -0.58 -1.24 -4.05 120.64 113.00 2e7c n GLU 40 Ca 0.00 -0.00 -0.39 0.00 -0.42 0.00 0.00 57.16 56.35 2e7c n GLU 40 Cb 0.00 -2.00 -0.05 0.00 -0.57 0.00 0.00 31.44 28.82 2e7c n GLU 40 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 2e7c s GLN 41 N -3.73 4.35 0.24 3.49 -0.21 -1.26 -2.04 119.66 120.51 2e7c s GLN 41 Ca 0.61 0.71 -0.16 0.00 0.02 0.00 0.00 55.36 56.55 2e7c s GLN 41 Cb -0.24 -3.39 -0.08 0.00 1.00 0.00 0.00 33.01 30.30 2e7c s GLN 41 CO 0.63 0.25 0.67 -0.51 -2.12 0.00 0.00 175.29 174.21 2e7c s LEU 42 N 0.23 4.23 -0.25 2.90 1.43 -1.11 -4.92 118.68 121.19 2e7c s LEU 42 Ca 0.32 1.25 -0.02 0.00 -1.03 0.00 0.00 54.13 54.65 2e7c s LEU 42 Cb -0.17 -3.70 0.12 0.00 0.03 0.00 0.00 46.19 42.48 2e7c s LEU 42 CO 0.16 -0.04 0.31 0.21 0.23 0.00 0.00 176.35 177.21 2e7c s ASN 43 N -1.94 1.07 -0.14 2.29 2.47 -1.25 -3.17 114.94 114.27 2e7c s ASN 43 Ca 0.46 -0.29 0.01 0.00 0.42 0.00 0.00 52.86 53.46 2e7c s ASN 43 Cb -0.14 0.69 0.02 0.00 -1.45 0.00 0.00 41.25 40.38 2e7c s ASN 43 CO 0.19 -0.34 -0.15 -0.76 -3.72 0.00 0.00 177.10 172.32 2e7c s LEU 44 N 2.42 1.72 -0.44 3.21 1.43 0.08 -4.98 118.68 122.12 2e7c s LEU 44 Ca 0.10 -0.49 0.01 0.00 -1.03 0.00 0.00 54.13 52.72 2e7c s LEU 44 Cb -0.15 -1.18 0.12 0.00 0.03 0.00 0.00 46.19 45.01 2e7c s LEU 44 CO -0.22 -0.04 0.20 -0.69 0.23 0.00 0.00 176.35 175.83 2e7c s VAL 45 N 1.37 2.89 -0.49 -1.59 1.01 -1.26 -0.42 120.40 121.91 2e7c s VAL 45 Ca 0.02 -2.52 -0.13 0.00 0.00 0.00 0.00 61.98 59.36 2e7c s VAL 45 Cb -0.13 -3.01 0.11 0.00 0.00 0.00 0.00 36.38 33.34 2e7c s VAL 45 CO -0.09 -0.71 0.40 -0.69 0.00 0.00 0.00 175.10 174.01 2e7c s VAL 46 N 0.62 4.80 0.31 2.92 1.01 -1.19 -4.90 120.40 123.98 2e7c s VAL 46 Ca 0.12 -1.47 -0.29 0.00 0.00 0.00 0.00 61.98 60.34 2e7c s VAL 46 Cb -0.22 -4.03 -0.10 0.00 0.00 0.00 0.00 36.38 32.03 2e7c s VAL 46 CO -0.05 -0.73 1.22 -2.16 0.00 0.00 0.00 175.10 173.39 2e7c s PRO 47 N 1.52 4.45 -0.01 2.72 0.04 -1.25 -3.56 135.00 138.91 2e7c s PRO 47 Ca 0.04 2.05 0.04 0.00 0.04 0.00 0.00 61.00 63.17 2e7c s PRO 47 Cb -0.27 -3.10 -0.01 0.00 0.04 0.00 0.00 34.50 31.16 2e7c s PRO 47 CO 0.03 -0.04 -0.14 -0.59 0.04 0.00 0.00 177.00 176.30 2e7c s PHE 48 N -1.16 1.21 0.26 0.56 -0.12 -1.26 -1.76 117.98 115.71 2e7c s PHE 48 Ca 0.47 -0.24 0.08 0.00 -0.05 0.00 0.00 56.93 57.20 2e7c s PHE 48 Cb -0.37 -0.77 -0.04 0.00 -0.63 0.00 0.00 43.02 41.21 2e7c s PHE 48 CO 0.48 -0.02 0.08 -0.65 -0.05 0.00 0.00 175.22 175.07 2e7c s GLN 49 N -0.39 2.56 0.00 1.99 -1.52 -0.02 -4.77 119.66 117.51 2e7c s GLN 49 Ca 0.05 -1.26 0.00 0.00 -1.95 0.00 0.00 55.36 52.19 2e7c s GLN 49 Cb -0.05 -2.33 0.00 0.00 -0.22 0.00 0.00 33.01 30.41 2e7c s GLN 49 CO -0.00 0.38 0.00 0.41 -0.25 0.00 0.00 175.29 175.83 2e7c n GLY 50 N -1.01 2.83 3.37 3.09 0.00 -1.25 -1.78 105.19 110.44 2e7c n GLY 50 Ca -0.07 -1.62 -0.11 0.00 0.00 0.00 0.00 46.02 44.21 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 -1.94 1.18 -0.00 1.61 1.02 -0.39 -4.54 119.74 116.67 2e7c s LYS 51 Ca 0.00 -0.56 -0.24 0.00 0.02 0.00 0.00 55.97 55.19 2e7c s LYS 51 Cb 0.00 0.53 -0.18 0.00 -0.52 0.00 0.00 37.83 37.66 2e7c s LYS 51 CO 0.00 -0.49 1.29 -1.00 -0.92 0.00 0.00 175.35 174.23 2e7c h PRO 52 N 2.19 0.11 -3.07 -1.68 0.13 -1.95 -3.23 132.00 124.50 2e7c h PRO 52 Ca -0.34 -0.06 -0.59 0.00 -0.87 0.00 0.00 66.00 64.14 2e7c h PRO 52 Cb 1.28 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 32.02 2e7c h PRO 52 CO 0.42 0.57 -0.77 0.50 -0.23 0.00 0.00 178.00 178.49 2e7c s ARG 53 N -4.27 0.83 -0.01 0.86 3.00 -1.26 -5.07 118.95 113.02 2e7c s ARG 53 Ca -0.15 -1.40 -0.30 0.00 -1.00 0.00 0.00 55.73 52.87 2e7c s ARG 53 Cb 0.03 -1.88 -0.06 0.00 0.00 0.00 0.00 34.95 33.04 2e7c s ARG 53 CO 0.70 -1.10 1.46 -1.25 0.00 0.00 0.00 175.30 175.11 2e7c s PRO 54 N 1.10 4.25 0.59 5.12 0.04 -1.26 -4.95 135.00 139.90 2e7c s PRO 54 Ca 0.14 2.02 -0.17 0.00 0.04 0.00 0.00 61.00 63.03 2e7c s PRO 54 Cb -0.21 -3.65 -0.03 0.00 0.04 0.00 0.00 34.50 30.65 2e7c s PRO 54 CO -0.11 -0.64 1.09 -1.14 0.04 0.00 0.00 177.00 176.23 2e7c s GLN 55 N 2.74 3.20 -0.22 4.56 0.74 0.25 -4.88 119.66 126.05 2e7c s GLN 55 Ca 0.66 1.36 0.02 0.00 0.05 0.00 0.00 55.36 57.44 2e7c s GLN 55 Cb -0.32 -2.01 0.04 0.00 1.10 0.00 0.00 33.01 31.83 2e7c s GLN 55 CO 0.27 -0.92 -0.14 0.08 -0.55 0.00 0.00 175.29 174.02 2e7c s VAL 56 N -2.24 2.01 -0.11 1.34 1.01 -1.26 -2.02 120.40 119.13 2e7c s VAL 56 Ca 0.67 -1.25 -0.03 0.00 0.00 0.00 0.00 61.98 61.37 2e7c s VAL 56 Cb -0.19 -2.01 -0.03 0.00 0.00 0.00 0.00 36.38 34.15 2e7c s VAL 56 CO 0.35 0.22 -0.00 -0.69 0.00 0.00 0.00 175.10 174.97 2e7c s VAL 57 N 1.23 4.26 -0.12 2.92 1.01 0.21 -5.00 120.40 124.91 2e7c s VAL 57 Ca -0.02 -0.25 0.03 0.00 0.00 0.00 0.00 61.98 61.73 2e7c s VAL 57 Cb -0.17 -2.82 0.01 0.00 0.00 0.00 0.00 36.38 33.40 2e7c s VAL 57 CO -0.09 0.56 -0.21 0.26 0.00 0.00 0.00 175.10 175.63 2e7c s TRP 58 N -0.46 2.45 0.01 5.22 0.52 -1.26 -2.18 118.94 123.24 2e7c s TRP 58 Ca 0.08 -1.14 -0.04 0.00 0.02 0.00 0.00 56.10 55.02 2e7c s TRP 58 Cb -0.12 -1.68 -0.01 0.00 -1.15 0.00 0.00 33.47 30.52 2e7c s TRP 58 CO 0.02 -0.52 0.07 0.95 0.02 0.00 0.00 176.95 177.49 2e7c s THR 59 N 0.70 0.09 -0.72 2.01 -4.23 -0.74 -3.62 115.64 109.12 2e7c s THR 59 Ca -0.11 -0.73 0.02 0.00 -1.18 0.00 0.00 61.69 59.69 2e7c s THR 59 Cb -0.16 -0.34 0.18 0.00 1.34 0.00 0.00 72.50 73.51 2e7c s THR 59 CO 0.02 -0.40 0.54 -0.75 -0.54 0.00 0.00 174.62 173.48 2e7c s LYS 60 N -1.32 2.66 0.00 3.99 2.47 0.28 -0.02 119.74 127.80 2e7c s LYS 60 Ca -0.14 -3.11 0.00 0.00 -1.56 0.00 0.00 55.97 51.16 2e7c s LYS 60 Cb -0.08 -3.62 0.00 0.00 -1.46 0.00 0.00 37.83 32.67 2e7c s LYS 60 CO 0.00 -1.24 0.00 0.41 0.16 0.00 0.00 175.35 174.69 2e7c n GLY 61 N 2.46 3.15 0.00 5.54 0.00 -1.13 -4.04 105.19 111.18 2e7c n GLY 61 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 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 -1.23 0.10 3.69 -0.02 0.00 -1.26 -5.09 105.19 101.38 2e7c n GLY 62 Ca 0.00 0.00 -0.32 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 0.00 3.31 0.53 4.61 0.00 -1.26 -5.02 121.76 123.93 2e7c s ALA 63 Ca 0.00 -1.01 -0.20 0.00 0.00 0.00 0.00 51.96 50.75 2e7c s ALA 63 Cb 0.00 -1.30 -0.06 0.00 0.00 0.00 0.00 23.12 21.76 2e7c s ALA 63 CO 0.00 0.67 1.13 -1.25 0.00 0.00 0.00 175.76 176.32 2e7c s PRO 64 N -1.87 3.40 0.35 0.00 0.04 -1.26 -0.56 135.00 135.11 2e7c s PRO 64 Ca 0.22 1.63 -0.27 0.00 0.04 0.00 0.00 61.00 62.62 2e7c s PRO 64 Cb -0.12 -2.05 -0.12 0.00 0.04 0.00 0.00 34.50 32.26 2e7c s PRO 64 CO 0.14 -0.81 1.20 1.28 0.04 0.00 0.00 177.00 178.84 2e7c n LEU 65 N -1.21 3.14 0.19 -3.56 4.77 -1.24 -4.80 117.00 114.29 2e7c n LEU 65 Ca 0.11 1.17 0.17 0.00 -0.03 0.00 0.00 56.01 57.43 2e7c n LEU 65 Cb 0.51 -1.43 0.67 0.00 -2.33 0.00 0.00 43.42 40.84 2e7c n LEU 65 CO 0.43 -0.80 1.15 0.44 -1.33 0.00 0.00 177.39 177.27 2e7c h ASP 66 N 2.26 0.00 -6.08 -1.43 5.19 -1.97 -3.44 116.42 110.95 2e7c h ASP 66 Ca -0.45 0.00 -0.42 0.00 -0.62 0.00 0.00 57.03 55.54 2e7c h ASP 66 Cb 1.30 0.00 -0.17 0.00 0.18 0.00 0.00 39.33 40.64 2e7c h ASP 66 CO 0.61 0.00 -0.62 0.35 -3.12 0.00 0.00 179.24 176.46 2e7c n THR 67 N -3.20 -0.61 0.00 0.35 -2.24 -1.26 -4.74 114.28 102.59 2e7c n THR 67 Ca 0.04 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.82 2e7c n THR 67 Cb 0.64 -1.20 0.00 0.00 -2.10 0.00 0.00 70.33 67.67 2e7c n THR 67 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2e7c n SER 68 N -2.29 3.70 -0.00 3.42 3.41 -1.26 -4.83 113.62 115.77 2e7c n SER 68 Ca 0.04 0.00 0.02 0.00 -0.26 0.00 0.00 58.87 58.67 2e7c n SER 68 Cb 0.50 0.09 -0.03 0.00 -0.26 0.00 0.00 64.21 64.51 2e7c n SER 68 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 2e7c n ARG 69 N -2.27 1.14 -3.28 4.33 1.85 -1.26 -5.02 116.66 112.15 2e7c n ARG 69 Ca 0.00 -0.03 -0.37 0.00 -1.00 0.00 0.00 57.85 56.45 2e7c n ARG 69 Cb 0.44 -1.01 -0.06 0.00 -1.05 0.00 0.00 32.46 30.78 2e7c n ARG 69 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 2e7c s VAL 70 N -2.08 4.76 -0.49 8.89 1.01 -1.26 -4.74 120.40 126.49 2e7c s VAL 70 Ca -0.01 1.09 -0.07 0.00 0.00 0.00 0.00 61.98 62.99 2e7c s VAL 70 Cb 0.02 -3.84 0.13 0.00 0.00 0.00 0.00 36.38 32.69 2e7c s VAL 70 CO 0.15 0.41 0.34 -2.28 0.00 0.00 0.00 175.10 173.72 2e7c s HIS 71 N -1.28 3.48 -0.38 5.22 2.46 -1.21 -4.75 115.29 118.83 2e7c s HIS 71 Ca 0.34 -2.09 -0.12 0.00 0.47 0.00 0.00 55.06 53.65 2e7c s HIS 71 Cb -0.18 -3.42 0.02 0.00 -0.13 0.00 0.00 32.58 28.87 2e7c s HIS 71 CO 0.19 -0.97 0.22 0.08 -2.47 0.00 0.00 174.74 171.79 2e7c s VAL 72 N 1.11 4.73 -0.60 0.89 1.01 -1.26 -3.27 120.40 123.01 2e7c s VAL 72 Ca 0.08 -0.79 -0.11 0.00 0.00 0.00 0.00 61.98 61.16 2e7c s VAL 72 Cb -0.24 -3.63 0.15 0.00 0.00 0.00 0.00 36.38 32.67 2e7c s VAL 72 CO -0.02 -0.23 0.51 -0.60 0.00 0.00 0.00 175.10 174.75 2e7c s ARG 73 N 1.59 2.91 -0.15 2.72 6.06 -0.92 -5.00 118.95 126.16 2e7c s ARG 73 Ca 0.03 -2.05 -0.19 0.00 -2.50 0.00 0.00 55.73 51.02 2e7c s ARG 73 Cb -0.19 -4.12 -0.04 0.00 0.06 0.00 0.00 34.95 30.66 2e7c s ARG 73 CO 0.07 -1.25 0.51 0.99 -2.50 0.00 0.00 175.30 173.12 2e7c s THR 74 N 0.89 5.15 -0.07 4.11 2.01 -1.26 -1.97 115.64 124.49 2e7c s THR 74 Ca 0.10 0.98 0.04 0.00 0.31 0.00 0.00 61.69 63.12 2e7c s THR 74 Cb -0.22 -3.84 -0.02 0.00 0.01 0.00 0.00 72.50 68.43 2e7c s THR 74 CO -0.02 0.26 -0.18 -0.55 -0.69 0.00 0.00 174.62 173.44 2e7c s SER 75 N 0.84 3.71 0.26 3.53 0.15 0.58 -4.97 113.70 117.80 2e7c s SER 75 Ca 0.26 -0.33 0.12 0.00 0.70 0.00 0.00 55.95 56.71 2e7c s SER 75 Cb -0.15 -0.99 0.89 0.00 -1.71 0.00 0.00 66.02 64.05 2e7c s SER 75 CO 0.10 0.28 1.14 -0.67 1.20 0.00 0.00 173.24 175.29 2e7c n ASP 76 N 2.76 0.18 0.23 5.45 -0.08 -1.26 0.03 116.55 123.86 2e7c n ASP 76 Ca -0.17 1.21 -0.10 0.00 -1.51 0.00 0.00 54.79 54.22 2e7c n ASP 76 Cb 0.52 -0.56 -0.05 0.00 2.34 0.00 0.00 41.12 43.38 2e7c n ASP 76 CO 0.00 0.00 0.00 -0.26 0.12 0.00 0.00 177.20 177.06 2e7c h PHE 77 N 0.00 -0.59 -3.88 -0.67 0.04 -1.94 -3.48 116.94 106.43 2e7c h PHE 77 Ca 0.58 -0.01 -0.10 0.00 2.80 0.00 0.00 57.97 61.23 2e7c h PHE 77 Cb 1.48 0.20 -0.12 0.00 2.20 0.00 0.00 35.95 39.70 2e7c h PHE 77 CO -0.08 -0.37 -0.32 0.16 -0.60 0.00 0.00 178.31 177.10 2e7c s ASP 78 N -4.29 0.04 0.22 2.17 -4.77 0.10 -4.18 116.67 105.96 2e7c s ASP 78 Ca -0.09 -0.86 0.03 0.00 -3.30 0.00 0.00 52.55 48.33 2e7c s ASP 78 Cb 0.01 0.44 -0.03 0.00 -1.09 0.00 0.00 42.92 42.24 2e7c s ASP 78 CO 0.28 -0.89 0.35 0.28 0.70 0.00 0.00 175.17 175.89 2e7c s THR 79 N -3.96 5.26 -0.01 2.11 -1.32 -1.23 -0.31 115.64 116.17 2e7c s THR 79 Ca 0.17 -0.80 0.00 0.00 -1.21 0.00 0.00 61.69 59.85 2e7c s THR 79 Cb 0.03 -3.81 0.01 0.00 -1.51 0.00 0.00 72.50 67.22 2e7c s THR 79 CO -0.00 -0.26 0.00 -0.69 -2.21 0.00 0.00 174.62 171.46 2e7c s VAL 80 N -1.92 0.07 -0.08 5.08 1.01 -0.83 -3.15 120.40 120.58 2e7c s VAL 80 Ca 0.35 0.06 0.05 0.00 0.00 0.00 0.00 61.98 62.43 2e7c s VAL 80 Cb -0.10 -0.13 -0.01 0.00 0.00 0.00 0.00 36.38 36.14 2e7c s VAL 80 CO 0.29 0.07 -0.24 0.12 0.00 0.00 0.00 175.10 175.35 2e7c s PHE 81 N 0.53 2.52 0.05 5.22 5.36 0.44 -2.16 117.98 129.95 2e7c s PHE 81 Ca -0.05 -0.84 -0.08 0.00 -0.96 0.00 0.00 56.93 55.00 2e7c s PHE 81 Cb -0.07 -1.66 -0.00 0.00 -0.34 0.00 0.00 43.02 40.94 2e7c s PHE 81 CO -0.01 -0.29 0.16 0.12 -1.46 0.00 0.00 175.22 173.73 2e7c s PHE 82 N 0.07 0.14 -0.08 10.12 2.19 -1.20 -0.74 117.98 128.47 2e7c s PHE 82 Ca -0.10 -0.46 -0.06 0.00 0.33 0.00 0.00 56.93 56.64 2e7c s PHE 82 Cb -0.16 -0.08 0.03 0.00 -1.31 0.00 0.00 43.02 41.50 2e7c s PHE 82 CO 0.06 -0.44 0.21 0.08 1.83 0.00 0.00 175.22 176.96 2e7c s VAL 83 N -2.99 -0.02 0.12 3.12 1.01 -1.19 -3.34 120.40 117.11 2e7c s VAL 83 Ca -0.02 0.08 -0.30 0.00 0.00 0.00 0.00 61.98 61.75 2e7c s VAL 83 Cb 0.01 -0.31 -0.08 0.00 0.00 0.00 0.00 36.38 36.00 2e7c s VAL 83 CO -0.06 0.03 1.58 -0.09 0.00 0.00 0.00 175.10 176.56 2e7c h ARG 84 N 6.57 -0.55 -3.85 2.72 2.43 -1.89 -2.94 114.38 116.86 2e7c h ARG 84 Ca -0.34 0.04 -0.42 0.00 -0.81 0.00 0.00 59.98 58.45 2e7c h ARG 84 Cb 1.17 0.12 -0.36 0.00 -0.42 0.00 0.00 29.97 30.49 2e7c h ARG 84 CO 0.39 -0.36 -0.77 1.14 -1.51 0.00 0.00 179.97 178.85 2e7c s GLN 85 N -5.89 0.70 -0.94 0.20 -2.07 -1.26 -4.14 119.66 106.26 2e7c s GLN 85 Ca -0.16 0.01 -0.23 0.00 -1.82 0.00 0.00 55.36 53.16 2e7c s GLN 85 Cb 0.08 -0.90 0.06 0.00 -1.09 0.00 0.00 33.01 31.16 2e7c s GLN 85 CO 0.64 -0.20 1.36 0.00 -1.32 0.00 0.00 175.29 175.77 2e7c s ALA 86 N 1.45 2.81 0.34 2.60 0.00 -0.86 -4.77 121.76 123.33 2e7c s ALA 86 Ca -0.03 -2.15 -0.27 0.00 0.00 0.00 0.00 51.96 49.52 2e7c s ALA 86 Cb -0.13 -4.40 -0.09 0.00 0.00 0.00 0.00 23.12 18.50 2e7c s ALA 86 CO -0.03 -3.45 1.05 0.00 0.00 0.00 0.00 175.76 173.34 2e7c s ALA 87 N 4.80 3.23 0.56 0.00 0.00 -1.26 -2.96 121.76 126.13 2e7c s ALA 87 Ca 0.41 0.76 0.38 0.00 0.00 0.00 0.00 51.96 53.51 2e7c s ALA 87 Cb -0.03 -3.28 1.49 0.00 0.00 0.00 0.00 23.12 21.30 2e7c s ALA 87 CO -0.05 -0.14 1.68 0.00 0.00 0.00 0.00 175.76 177.25 2e7c h ARG 88 N 3.14 0.00 0.38 0.00 3.08 -1.94 0.12 114.38 119.16 2e7c h ARG 88 Ca -0.47 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 59.56 2e7c h ARG 88 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.27 2e7c h ARG 88 CO 0.65 0.00 -0.18 0.77 -1.07 0.00 0.00 179.97 180.13 2e7c h SER 89 N 0.00 -0.44 -0.94 7.04 0.02 -1.94 -2.89 113.55 114.40 2e7c h SER 89 Ca 0.60 -0.08 0.36 0.00 -0.84 0.00 0.00 61.79 61.83 2e7c h SER 89 Cb 2.60 0.11 -0.13 0.00 0.14 0.00 0.00 62.40 65.12 2e7c h SER 89 CO -0.01 -0.18 0.56 0.47 -1.14 0.00 0.00 176.83 176.53 2e7c n ASP 90 N -5.24 0.23 -4.28 3.07 9.92 0.43 -4.42 116.55 116.26 2e7c n ASP 90 Ca -0.10 1.25 -0.58 0.00 -0.53 0.00 0.00 54.79 54.83 2e7c n ASP 90 Cb 0.26 -0.61 -0.12 0.00 -0.64 0.00 0.00 41.12 40.01 2e7c n ASP 90 CO 0.00 0.00 0.00 -1.54 0.13 0.00 0.00 177.20 175.79 2e7c n SER 91 N -4.61 0.76 0.00 -2.24 3.41 -1.09 -4.68 113.62 105.16 2e7c n SER 91 Ca 0.32 0.62 0.00 0.00 -0.26 0.00 0.00 58.87 59.55 2e7c n SER 91 Cb 1.14 -0.92 0.00 0.00 -0.26 0.00 0.00 64.21 64.17 2e7c n SER 91 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2e7c n GLY 92 N 7.37 2.36 2.85 5.00 0.00 -0.83 -4.98 105.19 116.96 2e7c n GLY 92 Ca 0.56 -0.02 -0.23 0.00 0.00 0.00 0.00 46.02 46.32 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 4.93 0.93 -0.30 1.61 -6.30 -1.26 -1.68 118.70 116.63 2e7c s GLU 93 Ca 0.00 -0.06 -0.11 0.00 -2.50 0.00 0.00 54.97 52.31 2e7c s GLU 93 Cb 0.00 -1.10 -0.03 0.00 0.00 0.00 0.00 34.13 33.01 2e7c s GLU 93 CO 0.00 -0.22 0.18 0.71 0.02 0.00 0.00 175.26 175.95 2e7c s TYR 94 N 1.56 3.19 -0.26 5.30 1.51 0.98 -2.82 117.35 126.81 2e7c s TYR 94 Ca -0.00 -0.24 -0.11 0.00 -1.01 0.00 0.00 57.07 55.71 2e7c s TYR 94 Cb -0.13 -2.38 -0.05 0.00 -0.11 0.00 0.00 41.96 39.29 2e7c s TYR 94 CO -0.04 -0.32 0.17 -2.00 -1.11 0.00 0.00 175.55 172.25 2e7c s GLU 95 N 1.69 4.01 -0.22 -0.62 2.12 0.97 -0.17 118.70 126.48 2e7c s GLU 95 Ca 0.06 -0.30 -0.04 0.00 0.36 0.00 0.00 54.97 55.05 2e7c s GLU 95 Cb -0.17 -3.60 -0.01 0.00 0.26 0.00 0.00 34.13 30.61 2e7c s GLU 95 CO 0.08 -0.06 -0.02 -1.17 -0.54 0.00 0.00 175.26 173.55 2e7c s LEU 96 N 1.42 3.00 -0.04 2.70 0.20 0.30 -1.80 118.68 124.46 2e7c s LEU 96 Ca 0.07 -0.35 0.06 0.00 0.69 0.00 0.00 54.13 54.60 2e7c s LEU 96 Cb -0.15 -1.77 -0.01 0.00 -0.43 0.00 0.00 46.19 43.83 2e7c s LEU 96 CO 0.08 -0.02 -0.22 -0.44 -0.29 0.00 0.00 176.35 175.46 2e7c s SER 97 N 1.47 2.71 -0.25 3.68 0.01 -0.93 -0.05 113.70 120.35 2e7c s SER 97 Ca 0.06 -0.44 -0.09 0.00 1.31 0.00 0.00 55.95 56.79 2e7c s SER 97 Cb -0.14 -0.57 -0.04 0.00 0.21 0.00 0.00 66.02 65.48 2e7c s SER 97 CO -0.02 0.24 0.11 -0.69 0.41 0.00 0.00 173.24 173.29 2e7c s VAL 98 N -0.27 4.79 -0.04 3.43 1.01 0.03 -0.62 120.40 128.73 2e7c s VAL 98 Ca 0.01 -0.01 -0.16 0.00 0.00 0.00 0.00 61.98 61.82 2e7c s VAL 98 Cb -0.11 -3.24 -0.05 0.00 0.00 0.00 0.00 36.38 32.98 2e7c s VAL 98 CO 0.02 0.33 0.42 -1.58 0.00 0.00 0.00 175.10 174.29 2e7c s GLN 99 N 1.39 4.07 0.09 2.72 0.74 -0.86 -0.66 119.66 127.16 2e7c s GLN 99 Ca 0.06 0.40 0.01 0.00 0.05 0.00 0.00 55.36 55.88 2e7c s GLN 99 Cb -0.15 -3.30 -0.04 0.00 1.10 0.00 0.00 33.01 30.62 2e7c s GLN 99 CO 0.05 0.51 -0.06 0.42 -0.55 0.00 0.00 175.29 175.66 2e7c s ILE 100 N -0.48 0.61 0.03 -2.34 -1.09 0.16 -0.59 121.20 117.50 2e7c s ILE 100 Ca 0.24 -1.92 -0.05 0.00 -2.23 0.00 0.00 60.65 56.69 2e7c s ILE 100 Cb -0.16 -1.67 -0.01 0.00 -1.58 0.00 0.00 42.46 39.04 2e7c s ILE 100 CO 0.12 -0.88 0.75 -0.62 -1.23 0.00 0.00 174.94 173.08 2e7c n GLU 101 N -0.02 -0.08 -0.17 2.79 -0.58 -1.26 -2.66 120.64 118.66 2e7c n GLU 101 Ca -0.12 0.75 0.07 0.00 -0.42 0.00 0.00 57.16 57.43 2e7c n GLU 101 Cb 0.61 -1.11 0.09 0.00 -0.57 0.00 0.00 31.44 30.46 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 -3.23 1.69 -4.24 1.62 5.15 -1.26 -5.05 115.26 109.94 2e7c n ASN 102 Ca 0.00 -2.69 -0.14 0.00 -0.60 0.00 0.00 54.58 51.16 2e7c n ASN 102 Cb 0.05 -0.33 -0.10 0.00 -0.53 0.00 0.00 39.78 38.86 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 -1.96 1.03 -0.01 1.20 -1.94 -1.09 -5.17 119.30 111.36 2e7c s MET 103 Ca 0.21 -1.44 -0.22 0.00 -1.71 0.00 0.00 55.69 52.52 2e7c s MET 103 Cb 0.18 -0.52 0.05 0.00 2.01 0.00 0.00 34.83 36.55 2e7c s MET 103 CO 0.02 0.04 0.49 0.21 -0.01 0.00 0.00 175.02 175.76 2e7c s LYS 104 N -3.78 0.90 0.09 2.03 2.36 -1.26 0.37 119.74 120.45 2e7c s LYS 104 Ca 0.17 -0.06 0.01 0.00 -2.55 0.00 0.00 55.97 53.54 2e7c s LYS 104 Cb 0.03 0.41 -0.04 0.00 -1.05 0.00 0.00 37.83 37.18 2e7c s LYS 104 CO -0.00 -0.28 -0.06 -0.51 1.55 0.00 0.00 175.35 176.05 2e7c s ASP 105 N -1.46 1.03 0.09 1.43 1.11 0.17 -4.94 116.67 114.09 2e7c s ASP 105 Ca -0.10 -1.01 0.00 0.00 0.18 0.00 0.00 52.55 51.62 2e7c s ASP 105 Cb -0.02 0.11 -0.04 0.00 1.07 0.00 0.00 42.92 44.04 2e7c s ASP 105 CO 0.05 -0.49 -0.03 0.42 1.18 0.00 0.00 175.17 176.30 2e7c s THR 106 N -3.67 0.41 -0.05 -1.27 -4.23 -1.26 -0.79 115.64 104.78 2e7c s THR 106 Ca 0.11 -1.88 -0.30 0.00 -1.18 0.00 0.00 61.69 58.44 2e7c s THR 106 Cb 0.06 -1.70 0.09 0.00 1.34 0.00 0.00 72.50 72.29 2e7c s THR 106 CO -0.06 -0.84 0.78 0.00 -0.54 0.00 0.00 174.62 173.96 2e7c s ALA 107 N -3.81 -1.80 0.12 3.99 0.00 0.93 -4.90 121.76 116.28 2e7c s ALA 107 Ca 0.12 1.26 0.10 0.00 0.00 0.00 0.00 51.96 53.45 2e7c s ALA 107 Cb 0.07 -0.04 -0.04 0.00 0.00 0.00 0.00 23.12 23.11 2e7c s ALA 107 CO -0.05 -0.43 -0.24 0.99 0.00 0.00 0.00 175.76 176.03 2e7c s THR 108 N -1.66 2.48 -0.04 0.00 2.01 -1.26 -0.54 115.64 116.62 2e7c s THR 108 Ca -0.06 -1.63 -0.01 0.00 0.31 0.00 0.00 61.69 60.30 2e7c s THR 108 Cb -0.00 -2.10 0.03 0.00 0.01 0.00 0.00 72.50 70.44 2e7c s THR 108 CO 0.03 0.12 0.07 -0.63 -0.69 0.00 0.00 174.62 173.52 2e7c s ILE 109 N -1.07 -0.10 -0.18 1.82 1.01 0.77 -4.94 121.20 118.51 2e7c s ILE 109 Ca 0.15 0.30 -0.15 0.00 0.00 0.00 0.00 60.65 60.96 2e7c s ILE 109 Cb -0.10 -0.15 -0.04 0.00 0.01 0.00 0.00 42.46 42.18 2e7c s ILE 109 CO 0.07 0.13 0.34 -0.13 0.00 0.00 0.00 174.94 175.35 2e7c s ARG 110 N 1.59 4.22 -0.09 2.79 0.52 -1.26 -0.02 118.95 126.70 2e7c s ARG 110 Ca -0.03 0.15 0.02 0.00 -0.52 0.00 0.00 55.73 55.35 2e7c s ARG 110 Cb -0.12 -3.48 0.01 0.00 0.52 0.00 0.00 34.95 31.88 2e7c s ARG 110 CO -0.04 0.10 -0.15 0.42 0.02 0.00 0.00 175.30 175.66 2e7c s ILE 111 N 0.88 1.39 -0.07 1.52 1.01 -0.68 -2.16 121.20 123.09 2e7c s ILE 111 Ca 0.18 -0.60 0.04 0.00 0.00 0.00 0.00 60.65 60.27 2e7c s ILE 111 Cb -0.14 -1.27 0.00 0.00 0.01 0.00 0.00 42.46 41.06 2e7c s ILE 111 CO 0.06 0.42 -0.19 -0.60 0.00 0.00 0.00 174.94 174.63 2e7c s ARG 112 N 0.84 2.30 -0.13 2.79 3.52 0.25 -1.96 118.95 126.56 2e7c s ARG 112 Ca -0.10 -0.68 0.01 0.00 -0.13 0.00 0.00 55.73 54.83 2e7c s ARG 112 Cb -0.15 -1.85 -0.01 0.00 -1.56 0.00 0.00 34.95 31.38 2e7c s ARG 112 CO 0.01 0.17 -0.16 0.08 -0.81 0.00 0.00 175.30 174.59 2e7c s VAL 113 N 0.31 2.72 -0.04 7.11 1.01 -1.26 -1.71 120.40 128.53 2e7c s VAL 113 Ca -0.12 -0.78 0.06 0.00 0.00 0.00 0.00 61.98 61.14 2e7c s VAL 113 Cb -0.15 -2.12 -0.02 0.00 0.00 0.00 0.00 36.38 34.09 2e7c s VAL 113 CO 0.05 0.53 -0.23 0.68 0.00 0.00 0.00 175.10 176.13 2e7c s VAL 114 N 0.43 2.23 0.11 2.92 -7.23 0.76 -4.82 120.40 114.81 2e7c s VAL 114 Ca -0.12 -1.02 -0.31 0.00 -1.81 0.00 0.00 61.98 58.72 2e7c s VAL 114 Cb -0.16 -1.81 -0.07 0.00 0.56 0.00 0.00 36.38 34.90 2e7c s VAL 114 CO 0.06 0.58 1.25 -1.83 -0.31 0.00 0.00 175.10 174.84 2e7c s GLU 115 N -0.39 4.42 0.50 4.82 -1.05 -1.26 -1.44 118.70 124.30 2e7c s GLU 115 Ca 0.03 1.88 -0.21 0.00 -0.15 0.00 0.00 54.97 56.53 2e7c s GLU 115 Cb -0.12 -3.29 -0.09 0.00 -0.44 0.00 0.00 34.13 30.19 2e7c s GLU 115 CO 0.01 -0.26 0.75 0.36 0.95 0.00 0.00 175.26 177.08 2e7c n LYS 116 N 3.50 0.84 -3.32 -4.83 2.85 -1.26 -4.90 118.16 111.04 2e7c n LYS 116 Ca 0.08 0.31 -0.30 0.00 -1.05 0.00 0.00 58.31 57.36 2e7c n LYS 116 Cb 0.45 -1.85 -0.04 0.00 -0.65 0.00 0.00 35.03 32.94 2e7c n LYS 116 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2e7c s ALA 117 N -1.50 3.59 0.00 0.58 0.00 -1.26 -5.08 121.76 118.09 2e7c s ALA 117 Ca 0.67 -0.46 0.00 0.00 0.00 0.00 0.00 51.96 52.17 2e7c s ALA 117 Cb -0.51 -2.36 0.00 0.00 0.00 0.00 0.00 23.12 20.25 2e7c s ALA 117 CO 0.54 0.30 0.00 0.41 0.00 0.00 0.00 175.76 177.01