#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 -0.25 0.17 1.61 0.15 -1.26 -5.19 113.70 108.93 2e7c s SER 2 Ca 0.00 0.29 -0.23 0.00 0.70 0.00 0.00 55.95 56.72 2e7c s SER 2 Cb 0.00 0.23 0.07 0.00 -1.71 0.00 0.00 66.02 64.61 2e7c s SER 2 CO 0.00 -0.22 0.60 -0.55 1.20 0.00 0.00 173.24 174.27 2e7c s SER 3 N -0.98 -0.55 0.00 5.45 0.15 -1.26 -5.18 113.70 111.33 2e7c s SER 3 Ca 0.02 -0.04 0.00 0.00 0.70 0.00 0.00 55.95 56.63 2e7c s SER 3 Cb -0.01 0.60 0.00 0.00 -1.71 0.00 0.00 66.02 64.90 2e7c s SER 3 CO -0.02 -0.99 0.00 0.61 1.20 0.00 0.00 173.24 174.04 2e7c n GLY 4 N -0.38 2.49 3.43 9.45 0.00 -1.26 -5.15 105.19 113.76 2e7c n GLY 4 Ca -0.16 -1.07 0.01 0.00 0.00 0.00 0.00 46.02 44.80 2e7c n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2e7c s SER 5 N 0.00 -0.75 -0.19 1.61 0.01 -1.26 -5.16 113.70 107.96 2e7c s SER 5 Ca 0.00 0.95 -0.10 0.00 1.31 0.00 0.00 55.95 58.11 2e7c s SER 5 Cb 0.00 1.82 0.07 0.00 0.21 0.00 0.00 66.02 68.12 2e7c s SER 5 CO 0.00 -0.14 0.45 -0.55 0.41 0.00 0.00 173.24 173.41 2e7c s SER 6 N 2.62 -0.54 0.00 2.44 0.15 -1.26 -5.15 113.70 111.96 2e7c s SER 6 Ca -0.02 1.00 0.00 0.00 0.70 0.00 0.00 55.95 57.63 2e7c s SER 6 Cb -0.08 0.98 0.00 0.00 -1.71 0.00 0.00 66.02 65.20 2e7c s SER 6 CO -0.18 -0.21 0.00 0.61 1.20 0.00 0.00 173.24 174.67 2e7c n GLY 7 N 4.49 3.74 3.12 9.45 0.00 -1.26 -5.13 105.19 119.59 2e7c n GLY 7 Ca -0.20 -0.30 -0.33 0.00 0.00 0.00 0.00 46.02 45.19 2e7c n GLY 7 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2e7c s THR 8 N -0.21 2.49 -1.01 2.61 -4.23 -1.26 -5.06 115.64 108.98 2e7c s THR 8 Ca 0.00 -1.47 -0.19 0.00 -1.18 0.00 0.00 61.69 58.84 2e7c s THR 8 Cb 0.00 -2.42 0.11 0.00 1.34 0.00 0.00 72.50 71.53 2e7c s THR 8 CO 0.00 -0.01 1.29 -0.76 -0.54 0.00 0.00 174.62 174.60 2e7c s LEU 9 N 1.18 4.54 -0.28 4.79 1.43 -1.26 -4.93 118.68 124.15 2e7c s LEU 9 Ca -0.06 -2.00 -0.02 0.00 -1.03 0.00 0.00 54.13 51.02 2e7c s LEU 9 Cb -0.19 -2.46 0.09 0.00 0.03 0.00 0.00 46.19 43.66 2e7c s LEU 9 CO -0.04 -1.16 0.09 0.00 0.23 0.00 0.00 176.35 175.47 2e7c s ALA 10 N 3.31 1.21 -0.28 4.21 0.00 -1.26 -5.10 121.76 123.85 2e7c s ALA 10 Ca 0.39 -1.34 -0.16 0.00 0.00 0.00 0.00 51.96 50.84 2e7c s ALA 10 Cb -0.03 -1.48 0.12 0.00 0.00 0.00 0.00 23.12 21.73 2e7c s ALA 10 CO -0.08 -1.57 0.85 -1.14 0.00 0.00 0.00 175.76 173.83 2e7c s GLN 11 N 1.78 0.53 1.21 0.00 0.74 -1.26 -5.18 119.66 117.48 2e7c s GLN 11 Ca 0.07 0.91 -0.19 0.00 0.05 0.00 0.00 55.36 56.20 2e7c s GLN 11 Cb -0.17 0.11 0.29 0.00 1.10 0.00 0.00 33.01 34.34 2e7c s GLN 11 CO -0.25 -0.11 1.11 -1.25 -0.55 0.00 0.00 175.29 174.24 2e7c s PRO 12 N 1.42 -1.27 -0.63 1.67 0.04 -1.26 -4.83 135.00 130.13 2e7c s PRO 12 Ca -0.09 -0.08 -0.26 0.00 0.04 0.00 0.00 61.00 60.61 2e7c s PRO 12 Cb -0.04 -1.59 -0.11 0.00 0.04 0.00 0.00 34.50 32.80 2e7c s PRO 12 CO -0.17 -3.74 2.42 1.55 0.04 0.00 0.00 177.00 177.10 2e7c n VAL 13 N -4.78 -0.05 -5.02 -0.36 3.14 -1.26 -4.92 118.33 105.08 2e7c n VAL 13 Ca 0.13 -0.66 -0.32 0.00 -2.96 0.00 0.00 64.34 60.53 2e7c n VAL 13 Cb 0.60 -2.37 -0.14 0.00 -1.06 0.00 0.00 33.84 30.86 2e7c n VAL 13 CO 0.00 0.00 0.00 -0.89 -6.46 0.00 0.00 176.83 169.48 2e7c s THR 14 N 12.98 2.74 -0.06 1.55 2.01 -1.26 -5.12 115.64 128.47 2e7c s THR 14 Ca 0.98 -0.85 0.02 0.00 0.31 0.00 0.00 61.69 62.16 2e7c s THR 14 Cb -0.20 -2.04 0.01 0.00 0.01 0.00 0.00 72.50 70.28 2e7c s THR 14 CO 0.20 0.59 -0.12 -0.63 -0.69 0.00 0.00 174.62 173.97 2e7c s ILE 15 N -0.66 1.12 -0.55 1.82 1.01 -1.26 -5.01 121.20 117.67 2e7c s ILE 15 Ca 0.10 -0.49 0.02 0.00 0.00 0.00 0.00 60.65 60.28 2e7c s ILE 15 Cb -0.11 -1.02 0.12 0.00 0.01 0.00 0.00 42.46 41.47 2e7c s ILE 15 CO 0.00 0.35 0.88 -1.14 0.00 0.00 0.00 174.94 175.03 2e7c n ARG 16 N 3.69 1.45 -4.35 2.79 3.00 -1.26 -4.83 116.66 117.16 2e7c n ARG 16 Ca -0.22 -0.49 -0.27 0.00 -0.00 0.00 0.00 57.85 56.87 2e7c n ARG 16 Cb 0.52 -1.45 -0.10 0.00 0.00 0.00 0.00 32.46 31.43 2e7c n ARG 16 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.63 176.42 2e7c s GLU 17 N -0.98 1.84 0.11 -0.14 8.01 -1.26 -5.12 118.70 121.17 2e7c s GLU 17 Ca 0.09 -1.39 -0.27 0.00 0.01 0.00 0.00 54.97 53.41 2e7c s GLU 17 Cb 0.07 -2.03 -0.07 0.00 -4.31 0.00 0.00 34.13 27.80 2e7c s GLU 17 CO 0.02 0.42 0.82 0.42 0.01 0.00 0.00 175.26 176.95 2e7c s ILE 18 N -1.74 4.51 0.12 -1.63 1.01 -1.26 -4.98 121.20 117.24 2e7c s ILE 18 Ca 0.24 1.78 -0.21 0.00 0.00 0.00 0.00 60.65 62.46 2e7c s ILE 18 Cb -0.08 -4.18 -0.07 0.00 0.01 0.00 0.00 42.46 38.13 2e7c s ILE 18 CO 0.13 0.42 1.73 0.00 0.00 0.00 0.00 174.94 177.22 2e7c h ALA 19 N 5.10 0.13 -2.26 9.38 0.00 -1.98 -3.44 119.26 126.19 2e7c h ALA 19 Ca -0.45 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.45 2e7c h ALA 19 Cb 1.21 0.06 -0.23 0.00 0.00 0.00 0.00 17.79 18.82 2e7c h ALA 19 CO 0.69 -0.44 -0.07 -2.00 0.00 0.00 0.00 179.25 177.44 2e7c s GLU 20 N -6.19 0.63 0.58 0.00 2.56 -1.22 -4.88 118.70 110.19 2e7c s GLU 20 Ca -0.13 0.98 -0.18 0.00 0.00 0.00 0.00 54.97 55.64 2e7c s GLU 20 Cb 0.09 0.17 -0.04 0.00 2.00 0.00 0.00 34.13 36.35 2e7c s GLU 20 CO 0.68 -0.13 1.12 -1.25 -0.56 0.00 0.00 175.26 175.12 2e7c s PRO 21 N 1.11 3.19 0.68 4.30 0.04 -1.26 -0.80 135.00 142.26 2e7c s PRO 21 Ca -0.06 1.54 -0.14 0.00 0.04 0.00 0.00 61.00 62.38 2e7c s PRO 21 Cb -0.06 -1.99 0.01 0.00 0.04 0.00 0.00 34.50 32.50 2e7c s PRO 21 CO -0.11 -0.96 1.11 -1.25 0.04 0.00 0.00 177.00 175.83 2e7c s PRO 22 N -3.53 2.71 -0.29 0.56 0.04 -1.26 -3.84 135.00 129.39 2e7c s PRO 22 Ca 0.71 1.35 -0.18 0.00 0.04 0.00 0.00 61.00 62.92 2e7c s PRO 22 Cb -0.23 -1.94 0.14 0.00 0.04 0.00 0.00 34.50 32.51 2e7c s PRO 22 CO 0.31 -1.32 0.99 0.21 0.04 0.00 0.00 177.00 177.24 2e7c s LYS 23 N -4.24 0.41 -0.57 4.56 2.20 -0.62 -4.92 119.74 116.56 2e7c s LYS 23 Ca 0.66 0.64 -0.10 0.00 -0.36 0.00 0.00 55.97 56.81 2e7c s LYS 23 Cb -0.20 0.12 0.15 0.00 -1.51 0.00 0.00 37.83 36.38 2e7c s LYS 23 CO 0.44 -0.07 0.46 0.42 -0.36 0.00 0.00 175.35 176.23 2e7c s ILE 24 N 1.05 4.51 -0.54 5.43 1.01 -1.26 -1.56 121.20 129.83 2e7c s ILE 24 Ca -0.06 -2.07 -0.28 0.00 0.00 0.00 0.00 60.65 58.24 2e7c s ILE 24 Cb -0.04 -3.92 0.02 0.00 0.01 0.00 0.00 42.46 38.54 2e7c s ILE 24 CO -0.13 -0.85 1.29 -0.13 0.00 0.00 0.00 174.94 175.12 2e7c s ARG 25 N 0.94 3.48 0.07 2.79 1.81 -0.43 -5.01 118.95 122.59 2e7c s ARG 25 Ca 0.09 0.44 -0.14 0.00 -1.72 0.00 0.00 55.73 54.41 2e7c s ARG 25 Cb -0.23 -4.04 -0.06 0.00 -0.45 0.00 0.00 34.95 30.17 2e7c s ARG 25 CO -0.02 -1.72 0.46 -0.51 -0.68 0.00 0.00 175.30 172.83 2e7c s LEU 26 N 5.33 4.42 0.00 2.53 1.43 -1.26 -3.49 118.68 127.63 2e7c s LEU 26 Ca 0.49 0.99 0.00 0.00 -1.03 0.00 0.00 54.13 54.57 2e7c s LEU 26 Cb -0.09 -2.90 0.00 0.00 0.03 0.00 0.00 46.19 43.23 2e7c s LEU 26 CO 0.27 0.22 0.00 -0.81 0.23 0.00 0.00 176.35 176.26 2e7c n PRO 27 N 1.31 0.10 0.00 1.29 -0.04 -1.26 -4.98 135.00 131.42 2e7c n PRO 27 Ca -0.10 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.44 2e7c n PRO 27 Cb 0.52 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 33.96 2e7c n PRO 27 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 2e7c n ARG 28 N -0.67 1.73 -0.02 0.54 0.63 -1.26 -4.19 116.66 113.41 2e7c n ARG 28 Ca 0.00 -0.62 0.11 0.00 -0.92 0.00 0.00 57.85 56.42 2e7c n ARG 28 Cb 0.00 -1.27 0.11 0.00 0.45 0.00 0.00 32.46 31.75 2e7c n ARG 28 CO 0.00 0.00 0.00 -2.39 -2.51 0.00 0.00 177.63 172.73 2e7c n HIS 29 N -0.41 0.05 0.05 -0.14 1.44 -1.26 -4.16 115.22 110.78 2e7c n HIS 29 Ca 0.06 -0.03 0.01 0.00 -2.01 0.00 0.00 57.72 55.75 2e7c n HIS 29 Cb 0.32 -0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.43 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 1.29 1.05 -0.03 2.39 4.77 -1.26 -4.26 117.00 120.95 2e7c n LEU 30 Ca 0.14 -0.98 -0.13 0.00 -0.03 0.00 0.00 56.01 55.01 2e7c n LEU 30 Cb 0.57 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.57 2e7c n LEU 30 CO 0.14 0.25 0.60 0.03 -1.33 0.00 0.00 177.39 177.08 2e7c h ARG 31 N 0.22 0.18 0.00 3.23 3.08 -1.73 -3.40 114.38 115.95 2e7c h ARG 31 Ca 0.00 -0.10 0.00 0.00 0.07 0.00 0.00 59.98 59.95 2e7c h ARG 31 Cb 0.05 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.10 2e7c h ARG 31 CO 0.00 0.65 -0.09 1.96 -1.07 0.00 0.00 179.97 181.42 2e7c h GLN 32 N -0.27 0.00 -1.80 0.04 4.20 -1.84 -3.50 115.11 111.95 2e7c h GLN 32 Ca 0.01 0.00 0.11 0.00 0.06 0.00 0.00 58.65 58.82 2e7c h GLN 32 Cb 0.62 0.00 -0.20 0.00 0.30 0.00 0.00 27.48 28.20 2e7c h GLN 32 CO 0.02 0.00 0.55 0.99 -0.67 0.00 0.00 178.83 179.72 2e7c s THR 33 N -1.25 0.00 -0.55 -0.54 2.01 -1.26 -4.90 115.64 109.15 2e7c s THR 33 Ca -0.03 0.00 -0.10 0.00 0.31 0.00 0.00 61.69 61.88 2e7c s THR 33 Cb 0.00 -1.00 0.14 0.00 0.01 0.00 0.00 72.50 71.65 2e7c s THR 33 CO 0.04 0.00 0.44 -0.47 -0.69 0.00 0.00 174.62 173.94 2e7c s TYR 34 N -1.90 3.45 -0.22 4.92 5.04 -1.14 -4.67 117.35 122.84 2e7c s TYR 34 Ca 0.01 -1.93 -0.21 0.00 -2.44 0.00 0.00 57.07 52.50 2e7c s TYR 34 Cb -0.01 -3.55 -0.02 0.00 0.35 0.00 0.00 41.96 38.74 2e7c s TYR 34 CO -0.02 -0.98 0.66 0.42 -1.34 0.00 0.00 175.55 174.29 2e7c s ILE 35 N 1.03 4.98 -0.02 3.14 -1.09 -1.26 -1.71 121.20 126.26 2e7c s ILE 35 Ca 0.09 1.23 -0.12 0.00 -2.23 0.00 0.00 60.65 59.62 2e7c s ILE 35 Cb -0.24 -3.97 0.02 0.00 -1.58 0.00 0.00 42.46 36.69 2e7c s ILE 35 CO -0.02 0.06 0.26 -0.13 -1.23 0.00 0.00 174.94 173.87 2e7c s ARG 36 N 2.25 0.56 0.64 2.79 1.81 -1.09 -5.04 118.95 120.87 2e7c s ARG 36 Ca 0.29 -0.16 -0.12 0.00 -1.72 0.00 0.00 55.73 54.02 2e7c s ARG 36 Cb -0.16 0.25 -0.02 0.00 -0.45 0.00 0.00 34.95 34.57 2e7c s ARG 36 CO 0.09 -0.14 1.04 0.15 -0.68 0.00 0.00 175.30 175.76 2e7c s LYS 37 N -1.12 3.35 0.70 3.54 1.02 -1.26 -1.65 119.74 124.32 2e7c s LYS 37 Ca -0.12 0.87 -0.11 0.00 0.02 0.00 0.00 55.97 56.64 2e7c s LYS 37 Cb -0.05 -2.05 0.01 0.00 -0.52 0.00 0.00 37.83 35.22 2e7c s LYS 37 CO 0.03 -0.77 1.06 0.14 -0.92 0.00 0.00 175.35 174.89 2e7c s VAL 38 N -3.04 3.97 0.00 3.17 -7.23 -0.53 -3.74 120.40 112.99 2e7c s VAL 38 Ca 0.57 0.64 0.00 0.00 -1.81 0.00 0.00 61.98 61.38 2e7c s VAL 38 Cb -0.12 -3.40 0.00 0.00 0.56 0.00 0.00 36.38 33.41 2e7c s VAL 38 CO 0.52 -0.84 0.00 0.61 -0.31 0.00 0.00 175.10 175.08 2e7c n GLY 39 N -2.07 1.16 3.32 2.32 0.00 -1.23 -4.82 105.19 103.87 2e7c n GLY 39 Ca 0.07 -0.03 -0.30 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.81 -0.16 1.61 0.41 -1.25 -4.21 118.70 112.30 2e7c s GLU 40 Ca 0.00 0.18 -0.09 0.00 -0.41 0.00 0.00 54.97 54.65 2e7c s GLU 40 Cb 0.00 -1.39 -0.05 0.00 -1.78 0.00 0.00 34.13 30.92 2e7c s GLU 40 CO 0.00 -4.81 0.15 -0.65 -0.49 0.00 0.00 175.26 169.46 2e7c s GLN 41 N -5.04 3.85 -0.56 1.61 -0.21 -1.26 -2.25 119.66 115.80 2e7c s GLN 41 Ca 0.69 -0.15 -0.21 0.00 0.02 0.00 0.00 55.36 55.71 2e7c s GLN 41 Cb -0.14 -3.31 0.07 0.00 1.00 0.00 0.00 33.01 30.63 2e7c s GLN 41 CO 0.58 0.52 0.77 -0.51 -2.12 0.00 0.00 175.29 174.53 2e7c s LEU 42 N -0.29 4.79 -0.31 2.90 1.43 -1.19 -4.94 118.68 121.07 2e7c s LEU 42 Ca 0.12 -0.94 -0.09 0.00 -1.03 0.00 0.00 54.13 52.19 2e7c s LEU 42 Cb -0.12 -2.48 -0.00 0.00 0.03 0.00 0.00 46.19 43.62 2e7c s LEU 42 CO 0.01 -1.11 0.13 0.54 0.23 0.00 0.00 176.35 176.15 2e7c s ASN 43 N 3.13 5.43 -0.09 2.29 4.22 -1.26 -3.48 114.94 125.18 2e7c s ASN 43 Ca 0.18 -0.58 0.01 0.00 -2.14 0.00 0.00 52.86 50.33 2e7c s ASN 43 Cb -0.19 -1.97 0.02 0.00 1.28 0.00 0.00 41.25 40.40 2e7c s ASN 43 CO 0.12 -0.20 -0.09 -0.76 -2.04 0.00 0.00 177.10 174.12 2e7c s LEU 44 N 1.58 1.38 -0.47 3.54 1.43 -0.98 -5.00 118.68 120.16 2e7c s LEU 44 Ca 0.04 -0.30 0.03 0.00 -1.03 0.00 0.00 54.13 52.87 2e7c s LEU 44 Cb -0.17 -0.84 0.12 0.00 0.03 0.00 0.00 46.19 45.34 2e7c s LEU 44 CO 0.05 -0.06 0.21 -0.69 0.23 0.00 0.00 176.35 176.10 2e7c s VAL 45 N 1.28 2.61 -0.50 -1.59 1.01 -1.26 -1.74 120.40 120.21 2e7c s VAL 45 Ca -0.03 -2.98 -0.14 0.00 0.00 0.00 0.00 61.98 58.83 2e7c s VAL 45 Cb -0.14 -2.83 0.11 0.00 0.00 0.00 0.00 36.38 33.52 2e7c s VAL 45 CO -0.04 -0.74 0.43 -0.69 0.00 0.00 0.00 175.10 174.06 2e7c s VAL 46 N 0.11 4.98 0.50 2.92 1.01 -1.15 -4.86 120.40 123.91 2e7c s VAL 46 Ca 0.15 -1.43 -0.21 0.00 0.00 0.00 0.00 61.98 60.49 2e7c s VAL 46 Cb -0.23 -4.13 -0.07 0.00 0.00 0.00 0.00 36.38 31.94 2e7c s VAL 46 CO -0.03 -0.75 1.15 -2.16 0.00 0.00 0.00 175.10 173.31 2e7c s PRO 47 N 1.56 3.57 0.05 2.72 0.04 -1.23 -3.12 135.00 138.59 2e7c s PRO 47 Ca 0.04 1.71 -0.05 0.00 0.04 0.00 0.00 61.00 62.73 2e7c s PRO 47 Cb -0.27 -2.23 -0.01 0.00 0.04 0.00 0.00 34.50 32.03 2e7c s PRO 47 CO 0.03 -0.69 0.09 -0.59 0.04 0.00 0.00 177.00 175.89 2e7c s PHE 48 N -1.64 0.25 0.15 0.56 -0.12 -1.25 -1.31 117.98 114.61 2e7c s PHE 48 Ca 0.68 -0.63 0.09 0.00 -0.05 0.00 0.00 56.93 57.02 2e7c s PHE 48 Cb -0.27 -0.17 -0.04 0.00 -0.63 0.00 0.00 43.02 41.92 2e7c s PHE 48 CO 0.31 -0.41 -0.21 -0.65 -0.05 0.00 0.00 175.22 174.21 2e7c s GLN 49 N -3.13 1.28 0.00 1.99 -1.52 -0.60 -4.68 119.66 112.99 2e7c s GLN 49 Ca -0.00 -1.34 0.00 0.00 -1.95 0.00 0.00 55.36 52.07 2e7c s GLN 49 Cb 0.02 -1.50 0.00 0.00 -0.22 0.00 0.00 33.01 31.31 2e7c s GLN 49 CO -0.07 0.33 0.00 0.41 -0.25 0.00 0.00 175.29 175.71 2e7c n GLY 50 N 0.62 3.44 3.31 3.09 0.00 -1.25 -1.59 105.19 112.81 2e7c n GLY 50 Ca -0.16 -0.87 -0.10 0.00 0.00 0.00 0.00 46.02 44.90 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 -2.16 1.05 -0.02 1.61 1.02 0.02 -4.42 119.74 116.84 2e7c s LYS 51 Ca 0.00 -0.82 -0.25 0.00 0.02 0.00 0.00 55.97 54.92 2e7c s LYS 51 Cb 0.00 0.44 -0.19 0.00 -0.52 0.00 0.00 37.83 37.55 2e7c s LYS 51 CO 0.00 -0.40 1.23 -1.00 -0.92 0.00 0.00 175.35 174.26 2e7c h PRO 52 N 2.45 -0.06 -3.07 -1.68 0.13 -1.94 -3.22 132.00 124.61 2e7c h PRO 52 Ca -0.33 0.00 -0.60 0.00 -0.87 0.00 0.00 66.00 64.20 2e7c h PRO 52 Cb 1.24 0.01 -0.40 0.00 0.13 0.00 0.00 31.00 31.99 2e7c h PRO 52 CO 0.48 0.40 -0.75 0.50 -0.23 0.00 0.00 178.00 178.41 2e7c s ARG 53 N -4.22 1.14 -0.06 0.86 3.52 -1.26 -5.06 118.95 113.87 2e7c s ARG 53 Ca -0.15 -1.80 -0.30 0.00 -0.13 0.00 0.00 55.73 53.35 2e7c s ARG 53 Cb 0.02 -2.21 -0.05 0.00 -1.56 0.00 0.00 34.95 31.15 2e7c s ARG 53 CO 0.64 -1.13 1.50 -1.25 -0.81 0.00 0.00 175.30 174.25 2e7c s PRO 54 N 0.62 4.22 0.21 5.12 0.04 -1.26 -4.95 135.00 139.00 2e7c s PRO 54 Ca 0.16 2.02 -0.30 0.00 0.04 0.00 0.00 61.00 62.92 2e7c s PRO 54 Cb -0.23 -3.81 -0.08 0.00 0.04 0.00 0.00 34.50 30.42 2e7c s PRO 54 CO -0.04 -0.74 1.01 -1.14 0.04 0.00 0.00 177.00 176.14 2e7c s GLN 55 N 3.41 4.72 -0.11 4.56 2.00 -0.49 -4.90 119.66 128.85 2e7c s GLN 55 Ca 0.67 1.60 -0.06 0.00 -2.00 0.00 0.00 55.36 55.57 2e7c s GLN 55 Cb -0.30 -3.28 -0.04 0.00 0.80 0.00 0.00 33.01 30.19 2e7c s GLN 55 CO 0.25 0.29 0.11 0.08 -0.50 0.00 0.00 175.29 175.53 2e7c s VAL 56 N -0.73 5.25 -0.10 1.34 1.01 -1.26 -0.42 120.40 125.49 2e7c s VAL 56 Ca 0.45 0.11 0.01 0.00 0.00 0.00 0.00 61.98 62.54 2e7c s VAL 56 Cb -0.27 -3.27 0.02 0.00 0.00 0.00 0.00 36.38 32.85 2e7c s VAL 56 CO 0.34 0.62 -0.10 -0.69 0.00 0.00 0.00 175.10 175.27 2e7c s VAL 57 N -1.00 1.14 -0.14 2.92 1.01 0.40 -4.94 120.40 119.80 2e7c s VAL 57 Ca 0.15 -0.40 -0.03 0.00 0.00 0.00 0.00 61.98 61.70 2e7c s VAL 57 Cb -0.12 -1.11 -0.03 0.00 0.00 0.00 0.00 36.38 35.13 2e7c s VAL 57 CO 0.04 0.38 -0.04 0.26 0.00 0.00 0.00 175.10 175.73 2e7c s TRP 58 N 1.33 3.02 -0.10 5.22 0.52 -1.26 -1.87 118.94 125.80 2e7c s TRP 58 Ca -0.02 -0.21 -0.17 0.00 0.02 0.00 0.00 56.10 55.72 2e7c s TRP 58 Cb -0.14 -1.90 0.04 0.00 -1.15 0.00 0.00 33.47 30.32 2e7c s TRP 58 CO -0.05 0.06 0.43 0.95 0.02 0.00 0.00 176.95 178.37 2e7c s THR 59 N 0.08 0.02 -0.92 2.01 -4.23 -0.91 -4.39 115.64 107.29 2e7c s THR 59 Ca -0.00 -0.16 -0.03 0.00 -1.18 0.00 0.00 61.69 60.31 2e7c s THR 59 Cb -0.13 -0.67 0.23 0.00 1.34 0.00 0.00 72.50 73.26 2e7c s THR 59 CO 0.03 -0.09 0.83 -0.75 -0.54 0.00 0.00 174.62 174.09 2e7c s LYS 60 N -0.50 3.41 0.00 3.99 2.20 -1.03 0.34 119.74 128.15 2e7c s LYS 60 Ca -0.06 -3.26 0.00 0.00 -0.36 0.00 0.00 55.97 52.28 2e7c s LYS 60 Cb -0.03 -4.04 0.00 0.00 -1.51 0.00 0.00 37.83 32.24 2e7c s LYS 60 CO 0.03 -1.26 0.00 0.41 -0.36 0.00 0.00 175.35 174.17 2e7c n GLY 61 N 2.40 2.82 0.00 5.54 0.00 -1.14 -4.32 105.19 110.49 2e7c n GLY 61 Ca 0.22 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.17 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 0.00 3.57 -0.02 0.00 -1.26 -5.06 105.19 102.41 2e7c n GLY 62 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 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 -1.85 0.25 4.61 0.00 -1.26 -5.14 121.76 118.37 2e7c s ALA 63 Ca 0.00 1.57 -0.30 0.00 0.00 0.00 0.00 51.96 53.24 2e7c s ALA 63 Cb 0.00 -0.57 -0.09 0.00 0.00 0.00 0.00 23.12 22.46 2e7c s ALA 63 CO 0.00 -0.33 1.27 -1.25 0.00 0.00 0.00 175.76 175.45 2e7c s PRO 64 N -0.76 4.43 0.61 0.00 0.04 -1.26 -2.47 135.00 135.58 2e7c s PRO 64 Ca -0.05 2.05 -0.18 0.00 0.04 0.00 0.00 61.00 62.86 2e7c s PRO 64 Cb -0.01 -3.16 -0.04 0.00 0.04 0.00 0.00 34.50 31.32 2e7c s PRO 64 CO 0.04 -0.15 1.00 1.28 0.04 0.00 0.00 177.00 179.21 2e7c n LEU 65 N 1.90 3.94 0.33 -3.56 4.77 -1.26 -4.82 117.00 118.31 2e7c n LEU 65 Ca 0.03 0.81 0.17 0.00 -0.03 0.00 0.00 56.01 56.99 2e7c n LEU 65 Cb 0.43 -1.41 0.92 0.00 -2.33 0.00 0.00 43.42 41.04 2e7c n LEU 65 CO 0.57 -1.77 1.14 0.44 -1.33 0.00 0.00 177.39 176.44 2e7c h ASP 66 N 0.48 0.00 -4.77 -1.43 5.19 -1.97 -3.44 116.42 110.48 2e7c h ASP 66 Ca -0.49 0.00 -0.11 0.00 -0.62 0.00 0.00 57.03 55.81 2e7c h ASP 66 Cb 1.36 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.85 2e7c h ASP 66 CO 0.51 0.00 -0.15 0.35 -3.12 0.00 0.00 179.24 176.83 2e7c n THR 67 N -2.93 -0.21 -0.06 0.35 -2.24 -1.26 -4.71 114.28 103.22 2e7c n THR 67 Ca -0.02 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.67 2e7c n THR 67 Cb 0.29 -0.61 -0.05 0.00 -2.10 0.00 0.00 70.33 67.87 2e7c n THR 67 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2e7c n SER 68 N -1.66 2.44 -0.01 3.42 2.88 -1.26 -4.79 113.62 114.63 2e7c n SER 68 Ca -0.04 0.00 0.02 0.00 -1.33 0.00 0.00 58.87 57.52 2e7c n SER 68 Cb 0.53 -0.23 -0.07 0.00 -0.75 0.00 0.00 64.21 63.70 2e7c n SER 68 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2e7c n ARG 69 N -3.04 1.02 -2.99 -1.46 1.74 -1.26 -5.00 116.66 105.68 2e7c n ARG 69 Ca -0.21 -0.06 -0.40 0.00 -0.77 0.00 0.00 57.85 56.42 2e7c n ARG 69 Cb 0.69 -1.20 -0.05 0.00 -1.02 0.00 0.00 32.46 30.88 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 -2.47 4.59 -0.72 1.55 1.01 -1.26 -4.70 120.40 118.39 2e7c s VAL 70 Ca -0.03 1.65 0.02 0.00 0.00 0.00 0.00 61.98 63.62 2e7c s VAL 70 Cb 0.04 -4.12 0.18 0.00 0.00 0.00 0.00 36.38 32.48 2e7c s VAL 70 CO 0.35 0.43 0.53 -1.00 0.00 0.00 0.00 175.10 175.40 2e7c s HIS 71 N -0.51 3.57 -0.33 5.22 3.76 -1.23 -4.69 115.29 121.09 2e7c s HIS 71 Ca 0.37 -3.14 -0.25 0.00 -0.15 0.00 0.00 55.06 51.89 2e7c s HIS 71 Cb -0.22 -2.95 0.01 0.00 1.11 0.00 0.00 32.58 30.53 2e7c s HIS 71 CO 0.24 -0.67 0.86 0.08 -0.85 0.00 0.00 174.74 174.40 2e7c s VAL 72 N -1.04 4.70 -0.57 -0.90 1.01 -1.26 -3.93 120.40 118.41 2e7c s VAL 72 Ca 0.23 1.25 -0.13 0.00 0.00 0.00 0.00 61.98 63.33 2e7c s VAL 72 Cb -0.11 -4.23 0.14 0.00 0.00 0.00 0.00 36.38 32.18 2e7c s VAL 72 CO -0.11 -0.36 0.50 -0.13 0.00 0.00 0.00 175.10 175.00 2e7c s ARG 73 N 3.18 2.92 0.07 2.72 0.52 -0.90 -5.00 118.95 122.46 2e7c s ARG 73 Ca 0.35 -1.88 -0.16 0.00 -0.52 0.00 0.00 55.73 53.53 2e7c s ARG 73 Cb -0.13 -4.19 -0.06 0.00 0.52 0.00 0.00 34.95 31.09 2e7c s ARG 73 CO 0.14 -1.28 0.49 0.99 0.02 0.00 0.00 175.30 175.67 2e7c s THR 74 N 1.23 4.90 -0.01 0.02 2.01 -1.26 -2.04 115.64 120.48 2e7c s THR 74 Ca 0.07 0.91 0.01 0.00 0.31 0.00 0.00 61.69 62.99 2e7c s THR 74 Cb -0.25 -3.77 0.01 0.00 0.01 0.00 0.00 72.50 68.50 2e7c s THR 74 CO -0.00 0.46 -0.02 -0.94 -0.69 0.00 0.00 174.62 173.42 2e7c s SER 75 N -1.32 0.43 0.38 3.53 1.04 -0.80 -4.99 113.70 111.98 2e7c s SER 75 Ca 0.30 -0.05 0.31 0.00 0.48 0.00 0.00 55.95 56.98 2e7c s SER 75 Cb -0.17 -0.13 1.25 0.00 0.10 0.00 0.00 66.02 67.07 2e7c s SER 75 CO 0.17 -0.01 1.23 -0.67 0.98 0.00 0.00 173.24 174.93 2e7c n ASP 76 N 3.47 0.10 0.00 7.02 2.03 -1.26 -1.35 116.55 126.56 2e7c n ASP 76 Ca -0.19 0.97 0.00 0.00 0.52 0.00 0.00 54.79 56.10 2e7c n ASP 76 Cb 0.55 -0.48 0.00 0.00 -0.72 0.00 0.00 41.12 40.47 2e7c n ASP 76 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 2e7c n PHE 77 N -3.98 0.00 -4.22 -0.67 3.01 -1.26 -4.86 117.46 105.49 2e7c n PHE 77 Ca 0.33 0.00 -0.12 0.00 1.01 0.00 0.00 57.45 58.66 2e7c n PHE 77 Cb 1.37 -0.26 -0.10 0.00 -0.01 0.00 0.00 39.48 40.48 2e7c n PHE 77 CO 0.00 0.00 0.00 0.16 1.01 0.00 0.00 176.76 177.93 2e7c s ASP 78 N -2.02 1.11 0.09 4.37 1.47 -0.46 -3.82 116.67 117.42 2e7c s ASP 78 Ca 0.00 -1.14 -0.01 0.00 1.18 0.00 0.00 52.55 52.58 2e7c s ASP 78 Cb 0.00 0.13 -0.04 0.00 -0.34 0.00 0.00 42.92 42.67 2e7c s ASP 78 CO 0.00 -0.56 0.26 0.28 0.68 0.00 0.00 175.17 175.83 2e7c s THR 79 N -3.69 5.33 -0.02 2.11 -1.32 -1.18 -1.91 115.64 114.97 2e7c s THR 79 Ca 0.21 -0.34 0.02 0.00 -1.21 0.00 0.00 61.69 60.37 2e7c s THR 79 Cb 0.06 -3.65 -0.00 0.00 -1.51 0.00 0.00 72.50 67.40 2e7c s THR 79 CO 0.02 0.08 -0.08 -0.69 -2.21 0.00 0.00 174.62 171.74 2e7c s VAL 80 N -1.58 0.70 -0.08 5.08 1.01 -0.87 -2.93 120.40 121.73 2e7c s VAL 80 Ca 0.36 -0.34 0.04 0.00 0.00 0.00 0.00 61.98 62.04 2e7c s VAL 80 Cb -0.13 -0.62 -0.00 0.00 0.00 0.00 0.00 36.38 35.64 2e7c s VAL 80 CO 0.27 0.21 -0.23 0.12 0.00 0.00 0.00 175.10 175.48 2e7c s PHE 81 N 0.05 2.43 0.02 5.22 5.36 -0.71 -2.12 117.98 128.23 2e7c s PHE 81 Ca -0.01 -0.91 0.01 0.00 -0.96 0.00 0.00 56.93 55.06 2e7c s PHE 81 Cb -0.06 -1.62 -0.02 0.00 -0.34 0.00 0.00 43.02 40.98 2e7c s PHE 81 CO 0.00 -0.35 -0.05 0.12 -1.46 0.00 0.00 175.22 173.48 2e7c s PHE 82 N 0.21 0.44 -0.12 10.12 5.36 -1.24 -2.31 117.98 130.44 2e7c s PHE 82 Ca -0.14 -0.37 -0.06 0.00 -0.96 0.00 0.00 56.93 55.40 2e7c s PHE 82 Cb -0.17 -0.28 0.05 0.00 -0.34 0.00 0.00 43.02 42.29 2e7c s PHE 82 CO 0.07 -0.09 0.28 0.08 -1.46 0.00 0.00 175.22 174.10 2e7c s VAL 83 N -0.99 -0.18 0.07 3.12 1.01 -1.23 -3.47 120.40 118.72 2e7c s VAL 83 Ca -0.08 0.18 -0.14 0.00 0.00 0.00 0.00 61.98 61.94 2e7c s VAL 83 Cb -0.07 -0.44 -0.04 0.00 0.00 0.00 0.00 36.38 35.83 2e7c s VAL 83 CO -0.00 0.08 1.25 -0.09 0.00 0.00 0.00 175.10 176.33 2e7c h ARG 84 N 7.57 -0.08 -4.78 2.72 2.43 -1.87 -3.16 114.38 117.21 2e7c h ARG 84 Ca -0.31 0.01 -0.47 0.00 -0.81 0.00 0.00 59.98 58.39 2e7c h ARG 84 Cb 1.14 0.02 -0.31 0.00 -0.42 0.00 0.00 29.97 30.40 2e7c h ARG 84 CO 0.28 -0.05 -0.80 1.14 -1.51 0.00 0.00 179.97 179.02 2e7c s GLN 85 N -4.16 1.26 -1.09 0.20 -2.07 -1.26 -4.04 119.66 108.50 2e7c s GLN 85 Ca -0.06 -0.40 -0.16 0.00 -1.82 0.00 0.00 55.36 52.93 2e7c s GLN 85 Cb 0.04 -1.13 0.16 0.00 -1.09 0.00 0.00 33.01 30.99 2e7c s GLN 85 CO 0.28 0.14 1.29 0.00 -1.32 0.00 0.00 175.29 175.68 2e7c s ALA 86 N 0.20 3.77 0.21 2.60 0.00 -0.96 -4.77 121.76 122.82 2e7c s ALA 86 Ca -0.04 -3.14 -0.28 0.00 0.00 0.00 0.00 51.96 48.49 2e7c s ALA 86 Cb -0.10 -4.07 -0.09 0.00 0.00 0.00 0.00 23.12 18.86 2e7c s ALA 86 CO 0.01 -2.83 0.89 0.00 0.00 0.00 0.00 175.76 173.83 2e7c s ALA 87 N 1.91 3.37 0.35 0.00 0.00 -1.26 -3.50 121.76 122.64 2e7c s ALA 87 Ca 0.38 0.53 0.28 0.00 0.00 0.00 0.00 51.96 53.15 2e7c s ALA 87 Cb -0.04 -3.13 1.16 0.00 0.00 0.00 0.00 23.12 21.11 2e7c s ALA 87 CO -0.04 0.23 1.15 0.54 0.00 0.00 0.00 175.76 177.64 2e7c n ARG 88 N 1.57 -0.02 -0.01 0.00 1.74 -1.26 0.19 116.66 118.87 2e7c n ARG 88 Ca -0.03 0.89 -0.10 0.00 -0.77 0.00 0.00 57.85 57.83 2e7c n ARG 88 Cb 0.48 -1.83 -0.04 0.00 -1.02 0.00 0.00 32.46 30.04 2e7c n ARG 88 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2e7c h SER 89 N 0.00 0.03 -0.91 0.55 0.87 -1.98 -2.40 113.55 109.71 2e7c h SER 89 Ca 0.66 0.02 0.17 0.00 -1.23 0.00 0.00 61.79 61.41 2e7c h SER 89 Cb 2.31 0.02 -0.10 0.00 -0.44 0.00 0.00 62.40 64.18 2e7c h SER 89 CO -0.24 0.04 0.50 0.44 -0.53 0.00 0.00 176.83 177.03 2e7c h ASP 90 N 0.09 0.60 -0.90 6.23 5.19 0.17 -3.43 116.42 124.38 2e7c h ASP 90 Ca 0.05 0.10 -0.60 0.00 -0.62 0.00 0.00 57.03 55.97 2e7c h ASP 90 Cb 0.04 0.00 0.10 0.00 0.18 0.00 0.00 39.33 39.65 2e7c h ASP 90 CO -0.06 0.22 -0.48 -0.24 -3.12 0.00 0.00 179.24 175.56 2e7c n SER 91 N -4.85 -1.14 0.00 6.45 2.88 -0.91 -4.82 113.62 111.24 2e7c n SER 91 Ca 0.20 1.00 0.00 0.00 -1.33 0.00 0.00 58.87 58.74 2e7c n SER 91 Cb 0.50 -0.85 0.00 0.00 -0.75 0.00 0.00 64.21 63.12 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 1.79 -0.56 2.93 0.46 0.00 -0.80 -5.03 105.19 103.99 2e7c n GLY 92 Ca 0.16 -0.64 -0.30 0.00 0.00 0.00 0.00 46.02 45.23 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 -1.58 1.61 -0.33 1.61 2.12 -1.26 -0.69 118.70 120.18 2e7c s GLU 93 Ca 0.00 -0.95 -0.22 0.00 0.36 0.00 0.00 54.97 54.16 2e7c s GLU 93 Cb 0.00 -2.55 -0.00 0.00 0.26 0.00 0.00 34.13 31.84 2e7c s GLU 93 CO 0.00 -0.59 0.70 0.71 -0.54 0.00 0.00 175.26 175.54 2e7c s TYR 94 N 1.42 3.18 -0.29 5.30 1.51 0.28 -2.88 117.35 125.86 2e7c s TYR 94 Ca -0.05 0.58 -0.15 0.00 -1.01 0.00 0.00 57.07 56.43 2e7c s TYR 94 Cb -0.19 -3.15 -0.03 0.00 -0.11 0.00 0.00 41.96 38.48 2e7c s TYR 94 CO -0.06 -0.58 0.38 -2.00 -1.11 0.00 0.00 175.55 172.18 2e7c s GLU 95 N 2.80 3.88 -0.27 -0.62 2.12 0.15 -0.44 118.70 126.32 2e7c s GLU 95 Ca 0.28 -0.08 -0.06 0.00 0.36 0.00 0.00 54.97 55.46 2e7c s GLU 95 Cb -0.14 -3.70 -0.00 0.00 0.26 0.00 0.00 34.13 30.54 2e7c s GLU 95 CO 0.14 -0.37 0.06 -1.17 -0.54 0.00 0.00 175.26 173.37 2e7c s LEU 96 N 2.09 3.57 0.02 2.70 2.96 0.62 -2.13 118.68 128.51 2e7c s LEU 96 Ca 0.15 -0.52 0.08 0.00 -0.22 0.00 0.00 54.13 53.61 2e7c s LEU 96 Cb -0.16 -1.87 -0.02 0.00 0.50 0.00 0.00 46.19 44.64 2e7c s LEU 96 CO 0.11 -0.12 -0.23 -0.44 -1.32 0.00 0.00 176.35 174.35 2e7c s SER 97 N 1.53 2.69 -0.17 3.68 0.01 -0.78 0.11 113.70 120.76 2e7c s SER 97 Ca 0.04 -0.49 -0.02 0.00 1.31 0.00 0.00 55.95 56.79 2e7c s SER 97 Cb -0.16 -0.26 -0.01 0.00 0.21 0.00 0.00 66.02 65.79 2e7c s SER 97 CO 0.02 0.23 -0.07 -0.69 0.41 0.00 0.00 173.24 173.13 2e7c s VAL 98 N -0.69 3.37 0.02 3.43 1.01 0.19 -0.45 120.40 127.28 2e7c s VAL 98 Ca 0.09 -0.52 -0.06 0.00 0.00 0.00 0.00 61.98 61.48 2e7c s VAL 98 Cb -0.09 -2.48 -0.05 0.00 0.00 0.00 0.00 36.38 33.76 2e7c s VAL 98 CO 0.01 0.47 0.28 -1.58 0.00 0.00 0.00 175.10 174.28 2e7c s GLN 99 N 0.84 3.59 0.07 2.72 0.74 0.44 -0.28 119.66 127.78 2e7c s GLN 99 Ca -0.02 -0.08 -0.04 0.00 0.05 0.00 0.00 55.36 55.27 2e7c s GLN 99 Cb -0.15 -3.06 -0.02 0.00 1.10 0.00 0.00 33.01 30.88 2e7c s GLN 99 CO 0.01 0.63 0.06 0.42 -0.55 0.00 0.00 175.29 175.87 2e7c s ILE 100 N -1.33 0.18 0.04 -2.34 -1.09 0.30 -1.39 121.20 115.57 2e7c s ILE 100 Ca 0.29 -1.56 -0.07 0.00 -2.23 0.00 0.00 60.65 57.07 2e7c s ILE 100 Cb -0.13 -1.47 -0.02 0.00 -1.58 0.00 0.00 42.46 39.26 2e7c s ILE 100 CO 0.17 -0.84 0.78 -0.62 -1.23 0.00 0.00 174.94 173.20 2e7c n GLU 101 N 0.03 -0.10 -0.49 2.79 -0.58 -1.26 -2.46 120.64 118.57 2e7c n GLU 101 Ca -0.14 0.77 0.06 0.00 -0.42 0.00 0.00 57.16 57.43 2e7c n GLU 101 Cb 0.62 -1.15 0.12 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 -3.43 1.59 -4.07 1.62 5.15 -1.26 -5.05 115.26 109.81 2e7c n ASN 102 Ca 0.00 -3.02 -0.07 0.00 -0.60 0.00 0.00 54.58 50.89 2e7c n ASN 102 Cb 0.06 -0.41 -0.10 0.00 -0.53 0.00 0.00 39.78 38.81 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 -2.14 0.60 -0.27 1.20 -1.94 -1.03 -5.17 119.30 110.55 2e7c s MET 103 Ca 0.29 -1.15 -0.23 0.00 -1.71 0.00 0.00 55.69 52.89 2e7c s MET 103 Cb 0.27 0.21 0.07 0.00 2.01 0.00 0.00 34.83 37.39 2e7c s MET 103 CO -0.03 -0.11 0.71 0.21 -0.01 0.00 0.00 175.02 175.78 2e7c s LYS 104 N -3.69 0.80 0.26 2.03 2.36 -1.26 0.11 119.74 120.35 2e7c s LYS 104 Ca 0.05 1.03 0.09 0.00 -2.55 0.00 0.00 55.97 54.59 2e7c s LYS 104 Cb 0.06 0.35 -0.05 0.00 -1.05 0.00 0.00 37.83 37.14 2e7c s LYS 104 CO -0.09 -0.11 -0.13 -0.51 1.55 0.00 0.00 175.35 176.06 2e7c s ASP 105 N 0.62 3.02 0.13 1.43 1.11 0.61 -4.96 116.67 118.63 2e7c s ASP 105 Ca -0.02 -1.08 0.03 0.00 0.18 0.00 0.00 52.55 51.65 2e7c s ASP 105 Cb -0.05 -0.21 -0.04 0.00 1.07 0.00 0.00 42.92 43.69 2e7c s ASP 105 CO -0.03 -0.16 -0.07 0.42 1.18 0.00 0.00 175.17 176.51 2e7c s THR 106 N -2.82 0.86 -0.18 -1.27 -4.23 -1.26 -0.64 115.64 106.10 2e7c s THR 106 Ca 0.27 -1.99 -0.27 0.00 -1.18 0.00 0.00 61.69 58.52 2e7c s THR 106 Cb -0.00 -1.81 0.07 0.00 1.34 0.00 0.00 72.50 72.09 2e7c s THR 106 CO 0.11 -0.77 0.70 0.00 -0.54 0.00 0.00 174.62 174.13 2e7c s ALA 107 N -3.52 -1.77 -0.07 3.99 0.00 0.12 -4.87 121.76 115.63 2e7c s ALA 107 Ca 0.15 1.74 0.03 0.00 0.00 0.00 0.00 51.96 53.88 2e7c s ALA 107 Cb 0.04 -0.71 -0.02 0.00 0.00 0.00 0.00 23.12 22.44 2e7c s ALA 107 CO -0.01 -0.35 -0.15 0.99 0.00 0.00 0.00 175.76 176.24 2e7c s THR 108 N -0.25 3.00 -0.08 0.00 2.01 -1.26 -0.27 115.64 118.80 2e7c s THR 108 Ca -0.04 -0.73 -0.00 0.00 0.31 0.00 0.00 61.69 61.23 2e7c s THR 108 Cb -0.03 -2.19 0.02 0.00 0.01 0.00 0.00 72.50 70.31 2e7c s THR 108 CO 0.05 0.57 -0.04 -0.63 -0.69 0.00 0.00 174.62 173.88 2e7c s ILE 109 N -0.43 0.64 -0.19 1.82 1.01 0.41 -4.96 121.20 119.50 2e7c s ILE 109 Ca 0.05 -0.09 -0.12 0.00 0.00 0.00 0.00 60.65 60.50 2e7c s ILE 109 Cb -0.12 -0.71 -0.05 0.00 0.01 0.00 0.00 42.46 41.59 2e7c s ILE 109 CO 0.02 0.29 0.21 -0.13 0.00 0.00 0.00 174.94 175.32 2e7c s ARG 110 N 1.56 4.20 -0.14 2.79 0.52 -1.26 0.99 118.95 127.61 2e7c s ARG 110 Ca -0.00 -0.09 0.02 0.00 -0.52 0.00 0.00 55.73 55.14 2e7c s ARG 110 Cb -0.13 -3.44 0.02 0.00 0.52 0.00 0.00 34.95 31.91 2e7c s ARG 110 CO -0.04 0.24 -0.18 0.42 0.02 0.00 0.00 175.30 175.75 2e7c s ILE 111 N 0.52 1.78 -0.11 1.52 1.01 0.14 -2.87 121.20 123.19 2e7c s ILE 111 Ca 0.12 -0.79 0.01 0.00 0.00 0.00 0.00 60.65 59.98 2e7c s ILE 111 Cb -0.12 -1.61 -0.02 0.00 0.01 0.00 0.00 42.46 40.72 2e7c s ILE 111 CO 0.01 0.49 -0.13 -0.60 0.00 0.00 0.00 174.94 174.71 2e7c s ARG 112 N 1.08 3.14 -0.15 2.79 3.52 -0.69 -1.90 118.95 126.75 2e7c s ARG 112 Ca -0.03 -0.69 -0.01 0.00 -0.13 0.00 0.00 55.73 54.88 2e7c s ARG 112 Cb -0.14 -2.56 -0.01 0.00 -1.56 0.00 0.00 34.95 30.67 2e7c s ARG 112 CO -0.05 0.33 -0.11 0.08 -0.81 0.00 0.00 175.30 174.73 2e7c s VAL 113 N 0.05 3.12 0.03 7.11 1.01 -1.26 -2.68 120.40 127.78 2e7c s VAL 113 Ca -0.05 -0.62 0.06 0.00 0.00 0.00 0.00 61.98 61.37 2e7c s VAL 113 Cb -0.14 -2.34 -0.03 0.00 0.00 0.00 0.00 36.38 33.87 2e7c s VAL 113 CO 0.04 0.51 -0.15 0.68 0.00 0.00 0.00 175.10 176.17 2e7c s VAL 114 N 0.59 2.98 0.62 2.92 -7.23 -0.66 -4.85 120.40 114.78 2e7c s VAL 114 Ca -0.07 -1.10 -0.16 0.00 -1.81 0.00 0.00 61.98 58.85 2e7c s VAL 114 Cb -0.15 -2.27 -0.02 0.00 0.56 0.00 0.00 36.38 34.50 2e7c s VAL 114 CO 0.03 0.34 1.09 -1.61 -0.31 0.00 0.00 175.10 174.64 2e7c s GLU 115 N -1.45 3.06 -0.64 4.82 2.02 -1.26 -1.46 118.70 123.79 2e7c s GLU 115 Ca 0.15 1.33 -0.27 0.00 0.02 0.00 0.00 54.97 56.20 2e7c s GLU 115 Cb -0.11 -1.99 0.04 0.00 0.10 0.00 0.00 34.13 32.17 2e7c s GLU 115 CO 0.06 -1.03 1.17 0.21 0.02 0.00 0.00 175.26 175.68 2e7c s LYS 116 N -4.02 3.33 0.04 1.61 2.20 -1.26 -4.82 119.74 116.82 2e7c s LYS 116 Ca 0.66 -0.10 -0.06 0.00 -0.36 0.00 0.00 55.97 56.10 2e7c s LYS 116 Cb -0.19 -4.10 -0.01 0.00 -1.51 0.00 0.00 37.83 32.03 2e7c s LYS 116 CO 0.38 -1.83 0.12 0.00 -0.36 0.00 0.00 175.35 173.66 2e7c s ALA 117 N 5.01 -0.13 0.00 3.13 0.00 -1.26 -5.13 121.76 123.38 2e7c s ALA 117 Ca 0.36 -0.49 0.00 0.00 0.00 0.00 0.00 51.96 51.83 2e7c s ALA 117 Cb -0.09 0.26 0.00 0.00 0.00 0.00 0.00 23.12 23.29 2e7c s ALA 117 CO 0.19 -0.33 0.00 0.41 0.00 0.00 0.00 175.76 176.03