#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k2e s ILE 2 N 0.00 4.90 0.32 3.17 1.01 -1.26 -1.05 121.20 128.29 1k2e s ILE 2 Ca 0.00 1.64 0.03 0.00 0.00 0.00 0.00 60.65 62.32 1k2e s ILE 2 Cb 0.00 -4.13 -0.04 0.00 0.01 0.00 0.00 42.46 38.30 1k2e s ILE 2 CO 0.00 0.27 0.11 0.68 0.00 0.00 0.00 174.94 176.00 1k2e s VAL 3 N 0.55 0.65 0.04 2.92 -7.23 -0.39 -2.06 120.40 114.87 1k2e s VAL 3 Ca 0.41 -2.00 -0.08 0.00 -1.81 0.00 0.00 61.98 58.50 1k2e s VAL 3 Cb -0.19 -2.58 -0.00 0.00 0.56 0.00 0.00 36.38 34.16 1k2e s VAL 3 CO 0.22 0.00 0.16 0.28 -0.31 0.00 0.00 175.10 175.45 1k2e s THR 4 N -3.50 0.12 0.05 5.32 -1.32 -0.19 -1.38 115.64 114.73 1k2e s THR 4 Ca 0.34 -0.98 -0.01 0.00 -1.21 0.00 0.00 61.69 59.84 1k2e s THR 4 Cb 0.06 -0.94 -0.04 0.00 -1.51 0.00 0.00 72.50 70.08 1k2e s THR 4 CO 0.15 -0.54 -0.03 -0.44 -2.21 0.00 0.00 174.62 171.55 1k2e s SER 5 N -2.16 0.50 -0.05 8.08 0.01 -0.84 -0.82 113.70 118.42 1k2e s SER 5 Ca -0.04 -0.91 0.03 0.00 1.31 0.00 0.00 55.95 56.34 1k2e s SER 5 Cb -0.01 0.17 0.00 0.00 0.21 0.00 0.00 66.02 66.40 1k2e s SER 5 CO -0.05 -0.54 -0.15 -0.83 0.41 0.00 0.00 173.24 172.09 1k2e s GLY 6 N -2.67 0.86 -0.31 3.44 0.00 0.00 -0.88 107.32 107.76 1k2e s GLY 6 Ca 0.03 -0.58 -0.07 0.00 0.00 0.00 0.00 44.72 44.10 1k2e s GLY 6 CO -0.08 -0.17 0.10 0.14 0.00 0.00 0.00 173.10 173.09 1k2e s VAL 7 N 0.27 4.08 -0.22 1.40 1.01 0.30 -3.95 120.40 123.28 1k2e s VAL 7 Ca -0.08 -0.73 0.01 0.00 0.00 0.00 0.00 61.98 61.18 1k2e s VAL 7 Cb -0.13 -3.14 0.03 0.00 0.00 0.00 0.00 36.38 33.14 1k2e s VAL 7 CO 0.03 0.02 -0.14 -0.22 0.00 0.00 0.00 175.10 174.79 1k2e s LEU 8 N 1.51 2.78 -0.12 3.92 2.96 -1.26 -1.33 118.68 127.14 1k2e s LEU 8 Ca 0.02 -0.92 0.02 0.00 -0.22 0.00 0.00 54.13 53.03 1k2e s LEU 8 Cb -0.18 -1.55 0.01 0.00 0.50 0.00 0.00 46.19 44.98 1k2e s LEU 8 CO 0.03 -0.09 -0.19 -0.69 -1.32 0.00 0.00 176.35 174.10 1k2e s VAL 9 N 1.24 1.79 -0.03 1.68 1.01 -1.26 -1.80 120.40 123.04 1k2e s VAL 9 Ca -0.00 -0.83 0.01 0.00 0.00 0.00 0.00 61.98 61.15 1k2e s VAL 9 Cb -0.16 -1.60 0.02 0.00 0.00 0.00 0.00 36.38 34.65 1k2e s VAL 9 CO -0.08 0.50 -0.01 -1.61 0.00 0.00 0.00 175.10 173.90 1k2e s GLU 10 N 0.80 0.35 -1.43 2.72 2.02 -0.10 -4.90 118.70 118.18 1k2e s GLU 10 Ca -0.09 0.03 -0.02 0.00 0.02 0.00 0.00 54.97 54.91 1k2e s GLU 10 Cb -0.16 -0.49 0.02 0.00 0.10 0.00 0.00 34.13 33.60 1k2e s GLU 10 CO 0.00 -0.10 0.48 0.09 0.02 0.00 0.00 175.26 175.75 1k2e n ASN 11 N 3.98 -0.73 -0.37 -0.19 3.02 -1.26 -1.35 115.26 118.36 1k2e n ASN 11 Ca -0.25 -0.99 -0.05 0.00 -0.03 0.00 0.00 54.58 53.26 1k2e n ASN 11 Cb 0.51 -3.12 -0.02 0.00 -0.61 0.00 0.00 39.78 36.54 1k2e n ASN 11 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1k2e n GLY 12 N -1.90 0.66 3.24 7.41 0.00 -1.26 -5.00 105.19 108.34 1k2e n GLY 12 Ca -0.27 -0.21 -0.24 0.00 0.00 0.00 0.00 46.02 45.30 1k2e n GLY 12 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1k2e s LYS 13 N -1.88 1.23 -0.06 1.61 1.02 -0.46 -1.32 119.74 119.89 1k2e s LYS 13 Ca 0.00 -0.98 0.04 0.00 0.02 0.00 0.00 55.97 55.05 1k2e s LYS 13 Cb 0.00 -1.37 -0.02 0.00 -0.52 0.00 0.00 37.83 35.92 1k2e s LYS 13 CO 0.00 0.34 -0.16 0.54 -0.92 0.00 0.00 175.35 175.15 1k2e s VAL 14 N -0.93 2.91 -0.40 3.17 0.11 -0.00 -0.92 120.40 124.34 1k2e s VAL 14 Ca 0.06 -0.77 -0.25 0.00 -2.93 0.00 0.00 61.98 58.09 1k2e s VAL 14 Cb -0.09 -2.14 0.02 0.00 -1.53 0.00 0.00 36.38 32.64 1k2e s VAL 14 CO 0.02 0.58 0.87 -0.22 -3.33 0.00 0.00 175.10 173.02 1k2e s LEU 15 N -0.55 4.06 0.26 2.54 2.96 -0.75 -0.51 118.68 126.69 1k2e s LEU 15 Ca 0.08 0.33 0.11 0.00 -0.22 0.00 0.00 54.13 54.43 1k2e s LEU 15 Cb -0.11 -3.15 -0.05 0.00 0.50 0.00 0.00 46.19 43.38 1k2e s LEU 15 CO 0.01 -0.87 -0.20 -0.76 -1.32 0.00 0.00 176.35 173.21 1k2e s LEU 16 N 3.42 2.56 0.19 -0.68 1.43 -0.43 -4.46 118.68 120.71 1k2e s LEU 16 Ca 0.35 -1.00 0.07 0.00 -1.03 0.00 0.00 54.13 52.52 1k2e s LEU 16 Cb -0.12 -1.07 -0.05 0.00 0.03 0.00 0.00 46.19 44.98 1k2e s LEU 16 CO 0.20 0.04 -0.14 0.68 0.23 0.00 0.00 176.35 177.37 1k2e s VAL 17 N -2.39 1.61 0.10 -1.59 -7.23 0.10 -0.61 120.40 110.40 1k2e s VAL 17 Ca 0.28 -2.17 -0.30 0.00 -1.81 0.00 0.00 61.98 57.97 1k2e s VAL 17 Cb -0.05 -1.99 -0.06 0.00 0.56 0.00 0.00 36.38 34.83 1k2e s VAL 17 CO 0.13 -0.63 1.14 -0.54 -0.31 0.00 0.00 175.10 174.90 1k2e s LYS 18 N -3.65 4.51 0.25 4.82 1.02 -1.26 -0.94 119.74 124.48 1k2e s LYS 18 Ca 0.21 1.72 -0.31 0.00 0.02 0.00 0.00 55.97 57.61 1k2e s LYS 18 Cb -0.00 -3.33 -0.12 0.00 -0.52 0.00 0.00 37.83 33.86 1k2e s LYS 18 CO 0.05 -0.10 1.63 1.58 -0.92 0.00 0.00 175.35 177.59 1k2e n HIS 19 N 3.28 2.72 -0.19 3.18 -0.00 0.16 -4.82 115.22 119.55 1k2e n HIS 19 Ca 0.06 0.18 0.13 0.00 -0.00 0.00 0.00 57.72 58.10 1k2e n HIS 19 Cb 0.47 -2.61 0.45 0.00 -0.00 0.00 0.00 29.99 28.30 1k2e n HIS 19 CO 0.00 0.00 0.00 0.87 -0.00 0.00 0.00 176.34 177.21 1k2e h LYS 20 N 5.60 0.51 0.00 1.57 1.57 -1.92 -0.11 116.57 123.79 1k2e h LYS 20 Ca -0.45 -0.03 -0.23 0.00 -1.87 0.00 0.00 60.65 58.07 1k2e h LYS 20 Cb 1.22 -0.12 -0.04 0.00 0.08 0.00 0.00 32.23 33.37 1k2e h LYS 20 CO 0.86 0.34 -1.86 0.54 -0.57 0.00 0.00 179.45 178.76 1k2e n ARG 21 N -4.50 1.67 -0.00 3.15 1.74 -1.26 -4.73 116.66 112.72 1k2e n ARG 21 Ca 0.15 0.01 0.10 0.00 -0.77 0.00 0.00 57.85 57.34 1k2e n ARG 21 Cb 0.48 -1.32 -0.13 0.00 -1.02 0.00 0.00 32.46 30.47 1k2e n ARG 21 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1k2e n LEU 22 N -2.56 0.71 0.00 0.55 4.77 -1.22 -4.99 117.00 114.26 1k2e n LEU 22 Ca -0.22 -0.35 0.00 0.00 -0.03 0.00 0.00 56.01 55.41 1k2e n LEU 22 Cb 0.88 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.97 1k2e n LEU 22 CO 0.24 0.18 0.00 0.61 -1.33 0.00 0.00 177.39 177.09 1k2e n GLY 23 N 1.43 1.58 3.55 -0.72 0.00 -0.06 -4.89 105.19 106.08 1k2e n GLY 23 Ca 0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.67 1k2e n GLY 23 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1k2e n VAL 24 N 0.00 2.83 -2.45 1.61 0.24 -1.26 -3.12 118.33 116.18 1k2e n VAL 24 Ca 0.00 -0.45 -0.41 0.00 -2.04 0.00 0.00 64.34 61.44 1k2e n VAL 24 Cb 0.00 -0.95 -0.04 0.00 -1.47 0.00 0.00 33.84 31.38 1k2e n VAL 24 CO 0.00 0.00 0.00 -0.31 -2.14 0.00 0.00 176.83 174.38 1k2e s TYR 25 N -1.71 3.52 0.11 6.34 1.51 -0.62 -0.67 117.35 125.84 1k2e s TYR 25 Ca 0.72 1.57 -0.11 0.00 -1.01 0.00 0.00 57.07 58.23 1k2e s TYR 25 Cb -0.39 -3.34 0.01 0.00 -0.11 0.00 0.00 41.96 38.13 1k2e s TYR 25 CO 0.51 -0.81 0.28 -1.50 -1.11 0.00 0.00 175.55 172.92 1k2e s ILE 26 N -0.49 0.10 0.53 2.71 2.07 -0.12 -0.31 121.20 125.70 1k2e s ILE 26 Ca 0.49 -0.99 -0.19 0.00 -1.41 0.00 0.00 60.65 58.54 1k2e s ILE 26 Cb -0.31 -1.35 -0.06 0.00 0.13 0.00 0.00 42.46 40.86 1k2e s ILE 26 CO 0.38 -0.48 1.11 -0.72 -1.91 0.00 0.00 174.94 173.32 1k2e s TYR 27 N -3.86 2.73 0.59 3.50 -0.85 -1.26 -0.72 117.35 117.49 1k2e s TYR 27 Ca 0.06 1.55 -0.20 0.00 -0.52 0.00 0.00 57.07 57.96 1k2e s TYR 27 Cb 0.03 -3.24 -0.03 0.00 0.38 0.00 0.00 41.96 39.10 1k2e s TYR 27 CO -0.10 -1.43 1.28 -2.14 -1.52 0.00 0.00 175.55 171.64 1k2e s PRO 28 N -3.30 2.93 0.00 -3.49 0.02 -1.25 -4.75 135.00 125.16 1k2e s PRO 28 Ca 0.72 2.02 0.00 0.00 0.02 0.00 0.00 61.00 63.75 1k2e s PRO 28 Cb -0.22 -2.02 0.00 0.00 0.02 0.00 0.00 34.50 32.27 1k2e s PRO 28 CO 0.26 -1.29 0.00 0.41 -0.33 0.00 0.00 177.00 176.05 1k2e n GLY 29 N 0.70 -1.44 0.00 0.52 0.00 -1.26 -0.82 105.19 102.89 1k2e n GLY 29 Ca 0.13 -1.06 0.00 0.00 0.00 0.00 0.00 46.02 45.09 1k2e n GLY 29 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1k2e n GLY 30 N -0.08 -1.47 3.77 -0.02 0.00 -0.00 -4.94 105.19 102.44 1k2e n GLY 30 Ca 0.00 -1.09 -0.38 0.00 0.00 0.00 0.00 46.02 44.55 1k2e n GLY 30 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1k2e s HIS 31 N -2.85 2.75 -0.14 1.61 3.76 -1.26 -1.02 115.29 118.13 1k2e s HIS 31 Ca 0.00 1.49 -0.26 0.00 -0.15 0.00 0.00 55.06 56.14 1k2e s HIS 31 Cb 0.00 -3.51 -0.02 0.00 1.11 0.00 0.00 32.58 30.16 1k2e s HIS 31 CO 0.00 -1.88 0.84 0.08 -0.85 0.00 0.00 174.74 172.93 1k2e s VAL 32 N -1.45 4.89 0.89 -0.90 1.01 -0.88 -4.84 120.40 119.13 1k2e s VAL 32 Ca 0.64 1.68 -0.11 0.00 0.00 0.00 0.00 61.98 64.18 1k2e s VAL 32 Cb -0.33 -4.15 0.12 0.00 0.00 0.00 0.00 36.38 32.03 1k2e s VAL 32 CO 0.40 0.06 1.09 -1.61 0.00 0.00 0.00 175.10 175.04 1k2e s GLU 33 N 1.89 1.32 0.20 2.72 2.02 -1.26 -4.94 118.70 120.65 1k2e s GLU 33 Ca 0.40 0.86 -0.17 0.00 0.02 0.00 0.00 54.97 56.08 1k2e s GLU 33 Cb -0.17 -1.81 0.19 0.00 0.10 0.00 0.00 34.13 32.44 1k2e s GLU 33 CO 0.15 -2.21 1.60 0.45 0.02 0.00 0.00 175.26 175.27 1k2e h HIS 34 N -1.53 -0.63 -0.64 1.61 3.86 -2.02 -2.64 115.15 113.17 1k2e h HIS 34 Ca -0.49 0.06 -0.44 0.00 -1.16 0.00 0.00 60.37 58.35 1k2e h HIS 34 Cb 1.28 0.37 -0.28 0.00 1.06 0.00 0.00 27.41 29.83 1k2e h HIS 34 CO 0.44 -0.33 -0.26 -1.71 0.86 0.00 0.00 177.93 176.92 1k2e n ASN 35 N -5.44 4.55 -4.53 2.45 5.15 -1.26 -5.00 115.26 111.17 1k2e n ASN 35 Ca 0.06 -3.78 -0.26 0.00 -0.60 0.00 0.00 54.58 50.00 1k2e n ASN 35 Cb 0.35 -0.56 -0.10 0.00 -0.53 0.00 0.00 39.78 38.94 1k2e n ASN 35 CO 0.00 0.00 0.00 -1.83 1.40 0.00 0.00 177.26 176.83 1k2e s GLU 36 N -3.52 1.92 0.53 1.20 -1.05 -1.00 -5.13 118.70 111.65 1k2e s GLU 36 Ca 0.51 -1.39 -0.06 0.00 -0.15 0.00 0.00 54.97 53.88 1k2e s GLU 36 Cb 0.43 -2.05 -0.02 0.00 -0.44 0.00 0.00 34.13 32.05 1k2e s GLU 36 CO 0.01 0.41 0.84 0.95 0.95 0.00 0.00 175.26 178.42 1k2e s THR 37 N -1.83 4.42 0.49 1.83 -4.23 -1.26 -4.65 115.64 110.40 1k2e s THR 37 Ca 0.25 0.15 0.14 0.00 -1.18 0.00 0.00 61.69 61.06 1k2e s THR 37 Cb -0.08 -3.71 0.25 0.00 1.34 0.00 0.00 72.50 70.30 1k2e s THR 37 CO 0.14 -0.72 2.10 -0.65 -0.54 0.00 0.00 174.62 174.95 1k2e h PRO 38 N 0.05 0.07 -0.08 3.99 0.11 -1.98 0.43 132.00 134.59 1k2e h PRO 38 Ca -0.46 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.63 1k2e h PRO 38 Cb 1.22 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 1k2e h PRO 38 CO 0.61 0.09 0.02 0.82 -0.21 0.00 0.00 178.00 179.34 1k2e h ILE 39 N 0.07 1.19 -0.54 4.15 1.08 -1.99 -0.82 117.51 120.64 1k2e h ILE 39 Ca 0.02 -0.58 -0.08 0.00 -0.39 0.00 0.00 64.86 63.83 1k2e h ILE 39 Cb 0.07 1.42 -0.02 0.00 -3.07 0.00 0.00 36.82 35.22 1k2e h ILE 39 CO 0.00 0.16 0.03 -0.33 -0.69 0.00 0.00 178.15 177.32 1k2e h GLU 40 N -0.07 0.91 -0.44 2.37 5.08 -1.80 -2.91 114.58 117.71 1k2e h GLU 40 Ca 0.03 -0.25 -0.03 0.00 -1.00 0.00 0.00 59.36 58.11 1k2e h GLU 40 Cb 0.24 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.37 1k2e h GLU 40 CO 0.00 0.89 0.15 0.00 -1.00 0.00 0.00 179.01 179.05 1k2e h ALA 41 N 1.18 0.57 -0.51 3.43 0.00 -0.77 -1.24 119.26 121.91 1k2e h ALA 41 Ca 0.16 -0.16 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 1k2e h ALA 41 Cb 0.47 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1k2e h ALA 41 CO 0.02 0.20 -0.06 -0.24 0.00 0.00 0.00 179.25 179.17 1k2e h VAL 42 N 0.56 1.26 -0.01 0.00 3.04 -1.09 0.82 116.25 120.83 1k2e h VAL 42 Ca 0.14 -1.16 0.00 0.00 -1.01 0.00 0.00 66.70 64.67 1k2e h VAL 42 Cb 0.24 0.93 -0.00 0.00 -2.01 0.00 0.00 31.29 30.45 1k2e h VAL 42 CO -0.01 0.41 0.01 0.11 -1.01 0.00 0.00 177.57 177.08 1k2e h LYS 43 N 0.83 0.02 0.17 4.17 1.57 -1.36 -0.89 116.57 121.07 1k2e h LYS 43 Ca 0.14 -0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.92 1k2e h LYS 43 Cb 0.58 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.88 1k2e h LYS 43 CO 0.04 0.01 -0.09 -0.09 -0.57 0.00 0.00 179.45 178.74 1k2e h ARG 44 N 0.02 -0.24 -0.88 3.15 2.43 -1.02 -2.11 114.38 115.72 1k2e h ARG 44 Ca 0.00 0.02 0.02 0.00 -0.81 0.00 0.00 59.98 59.21 1k2e h ARG 44 Cb -0.00 0.05 -0.05 0.00 -0.42 0.00 0.00 29.97 29.56 1k2e h ARG 44 CO -0.00 -0.16 0.58 0.93 -1.51 0.00 0.00 179.97 179.81 1k2e h GLU 45 N -0.25 1.13 -0.28 0.20 3.07 -0.79 -0.45 114.58 117.22 1k2e h GLU 45 Ca -0.02 -0.07 -0.03 0.00 -0.50 0.00 0.00 59.36 58.75 1k2e h GLU 45 Cb 0.20 -0.26 -0.01 0.00 -0.84 0.00 0.00 28.75 27.84 1k2e h GLU 45 CO 0.02 0.75 0.06 0.35 -1.40 0.00 0.00 179.01 178.80 1k2e h PHE 46 N 1.17 0.47 -0.09 4.33 3.57 -1.04 -0.55 116.94 124.80 1k2e h PHE 46 Ca 0.33 -0.06 -0.14 0.00 3.53 0.00 0.00 57.97 61.64 1k2e h PHE 46 Cb -0.09 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 38.50 1k2e h PHE 46 CO -0.01 0.53 -0.55 1.05 -2.23 0.00 0.00 178.31 177.10 1k2e h GLU 47 N 0.29 0.28 -0.24 1.11 4.11 -1.21 -0.75 114.58 118.16 1k2e h GLU 47 Ca 0.09 -0.17 -0.15 0.00 0.07 0.00 0.00 59.36 59.20 1k2e h GLU 47 Cb 0.29 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 1k2e h GLU 47 CO 0.00 0.76 -0.45 0.93 0.07 0.00 0.00 179.01 180.32 1k2e h GLU 48 N 0.22 0.62 0.00 1.06 5.08 -0.97 0.78 114.58 121.37 1k2e h GLU 48 Ca 0.00 -0.34 0.00 0.00 -1.00 0.00 0.00 59.36 58.02 1k2e h GLU 48 Cb 1.03 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.30 1k2e h GLU 48 CO 0.09 0.95 -0.52 0.93 -1.00 0.00 0.00 179.01 179.46 1k2e h GLU 49 N 0.50 0.00 0.00 2.33 5.08 -0.93 -3.41 114.58 118.15 1k2e h GLU 49 Ca 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1k2e h GLU 49 Cb 0.98 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.23 1k2e h GLU 49 CO 0.09 0.00 -0.28 0.25 -1.00 0.00 0.00 179.01 178.07 1k2e n THR 50 N -2.66 0.00 -0.23 1.13 -2.24 -0.30 -4.45 114.28 105.54 1k2e n THR 50 Ca 0.02 -0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 1k2e n THR 50 Cb 0.51 0.39 0.00 0.00 -2.10 0.00 0.00 70.33 69.13 1k2e n THR 50 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1k2e n GLY 51 N 0.79 1.63 3.81 3.38 0.00 0.26 0.09 105.19 115.15 1k2e n GLY 51 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 1k2e n GLY 51 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1k2e s ILE 52 N -2.90 5.11 -0.12 -0.61 1.01 -1.24 -1.49 121.20 120.95 1k2e s ILE 52 Ca 0.00 0.79 -0.15 0.00 0.00 0.00 0.00 60.65 61.29 1k2e s ILE 52 Cb 0.00 -3.70 -0.05 0.00 0.01 0.00 0.00 42.46 38.72 1k2e s ILE 52 CO 0.00 0.53 0.36 -0.69 0.00 0.00 0.00 174.94 175.14 1k2e s VAL 53 N -0.68 5.24 0.28 2.92 1.01 0.00 -3.08 120.40 126.09 1k2e s VAL 53 Ca 0.23 0.70 0.03 0.00 0.00 0.00 0.00 61.98 62.93 1k2e s VAL 53 Cb -0.16 -3.69 -0.06 0.00 0.00 0.00 0.00 36.38 32.47 1k2e s VAL 53 CO 0.11 0.40 0.05 0.68 0.00 0.00 0.00 175.10 176.35 1k2e s VAL 54 N 0.26 0.93 -0.07 2.92 -7.23 -1.26 -0.44 120.40 115.51 1k2e s VAL 54 Ca 0.20 -2.01 0.01 0.00 -1.81 0.00 0.00 61.98 58.37 1k2e s VAL 54 Cb -0.14 -2.62 0.02 0.00 0.56 0.00 0.00 36.38 34.20 1k2e s VAL 54 CO 0.07 -0.09 -0.07 -0.70 -0.31 0.00 0.00 175.10 174.00 1k2e s GLU 55 N -3.93 1.25 0.27 4.82 2.56 -0.13 -4.83 118.70 118.71 1k2e s GLU 55 Ca 0.35 -0.21 -0.29 0.00 0.00 0.00 0.00 54.97 54.81 1k2e s GLU 55 Cb 0.08 -1.22 -0.10 0.00 2.00 0.00 0.00 34.13 34.89 1k2e s GLU 55 CO 0.13 -0.12 1.29 -2.14 -0.56 0.00 0.00 175.26 173.86 1k2e s PRO 56 N 1.18 4.40 0.35 4.30 0.02 -1.26 -1.17 135.00 142.81 1k2e s PRO 56 Ca -0.06 2.12 0.00 0.00 0.02 0.00 0.00 61.00 63.08 1k2e s PRO 56 Cb -0.14 -3.13 0.00 0.00 0.02 0.00 0.00 34.50 31.25 1k2e s PRO 56 CO -0.02 -0.18 0.01 0.44 -0.33 0.00 0.00 177.00 176.93 1k2e n ILE 57 N 1.58 0.00 0.00 2.83 -5.35 -0.31 -4.91 119.36 113.20 1k2e n ILE 57 Ca 0.02 -1.64 0.00 0.00 -0.27 0.00 0.00 62.75 60.86 1k2e n ILE 57 Cb 0.42 0.32 0.00 0.00 -1.74 0.00 0.00 39.64 38.64 1k2e n ILE 57 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1k2e n GLY 58 N 0.82 3.65 3.77 3.28 0.00 -1.26 -4.36 105.19 111.09 1k2e n GLY 58 Ca -0.14 -1.37 -0.40 0.00 0.00 0.00 0.00 46.02 44.10 1k2e n GLY 58 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1k2e s PHE 59 N -2.00 2.61 -0.02 1.61 5.36 -1.26 -4.44 117.98 119.84 1k2e s PHE 59 Ca 0.00 1.26 -0.09 0.00 -0.96 0.00 0.00 56.93 57.14 1k2e s PHE 59 Cb 0.00 -3.90 0.01 0.00 -0.34 0.00 0.00 43.02 38.79 1k2e s PHE 59 CO 0.00 -2.75 0.19 -0.08 -1.46 0.00 0.00 175.22 171.12 1k2e s THR 60 N -1.17 0.06 -0.73 0.12 -1.32 -1.26 -1.56 115.64 109.77 1k2e s THR 60 Ca 0.56 -0.47 0.26 0.00 -1.21 0.00 0.00 61.69 60.83 1k2e s THR 60 Cb -0.44 -0.43 0.28 0.00 -1.51 0.00 0.00 72.50 70.40 1k2e s THR 60 CO 0.58 -0.26 1.78 -1.22 -2.21 0.00 0.00 174.62 173.28 1k2e n TYR 61 N 1.80 0.88 -0.48 9.09 4.02 -1.26 -4.94 117.16 126.28 1k2e n TYR 61 Ca -0.20 0.26 0.00 0.00 -0.01 0.00 0.00 57.90 57.95 1k2e n TYR 61 Cb 0.56 -0.92 0.00 0.00 -0.02 0.00 0.00 39.34 38.96 1k2e n TYR 61 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1k2e n GLY 62 N 1.23 0.73 3.70 2.72 0.00 -1.26 -5.04 105.19 107.27 1k2e n GLY 62 Ca 0.05 -0.32 -0.42 0.00 0.00 0.00 0.00 46.02 45.33 1k2e n GLY 62 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1k2e s ILE 63 N -2.00 3.58 -0.29 -0.61 1.01 -1.26 -4.95 121.20 116.68 1k2e s ILE 63 Ca 0.00 1.08 -0.14 0.00 0.00 0.00 0.00 60.65 61.59 1k2e s ILE 63 Cb 0.00 -3.69 0.11 0.00 0.01 0.00 0.00 42.46 38.88 1k2e s ILE 63 CO 0.00 0.05 0.70 -0.51 0.00 0.00 0.00 174.94 175.18 1k2e s ILE 64 N 1.66 -0.40 0.00 2.92 2.07 -1.26 -0.72 121.20 125.46 1k2e s ILE 64 Ca 0.63 0.00 0.00 0.00 -1.41 0.00 0.00 60.65 59.87 1k2e s ILE 64 Cb -0.33 -1.00 0.00 0.00 0.13 0.00 0.00 42.46 41.26 1k2e s ILE 64 CO 0.28 0.00 0.00 -0.90 -1.91 0.00 0.00 174.94 172.41 1k2e n ASP 65 N 4.75 0.00 0.18 4.50 5.68 -0.48 -5.01 116.55 126.16 1k2e n ASP 65 Ca -0.16 -0.69 0.14 0.00 -0.50 0.00 0.00 54.79 53.58 1k2e n ASP 65 Cb 0.55 0.00 0.58 0.00 -1.14 0.00 0.00 41.12 41.11 1k2e n ASP 65 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1k2e h GLU 66 N 0.00 0.00 0.00 0.11 3.07 -2.05 -3.15 114.58 112.55 1k2e h GLU 66 Ca 0.00 0.00 -0.07 0.00 -0.50 0.00 0.00 59.36 58.79 1k2e h GLU 66 Cb 0.00 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 27.90 1k2e h GLU 66 CO 0.00 0.00 -1.90 0.09 -1.40 0.00 0.00 179.01 175.80 1k2e n ASN 67 N -2.52 0.89 -3.55 1.42 3.02 -1.26 -5.05 115.26 108.21 1k2e n ASN 67 Ca 0.01 0.00 -0.11 0.00 -0.03 0.00 0.00 54.58 54.46 1k2e n ASN 67 Cb 0.23 1.61 -0.04 0.00 -0.61 0.00 0.00 39.78 40.97 1k2e n ASN 67 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1k2e s ALA 68 N -3.05 -1.89 -0.08 5.41 0.00 -1.19 -5.15 121.76 115.81 1k2e s ALA 68 Ca -0.07 1.39 0.02 0.00 0.00 0.00 0.00 51.96 53.30 1k2e s ALA 68 Cb 0.10 -0.30 0.01 0.00 0.00 0.00 0.00 23.12 22.94 1k2e s ALA 68 CO 0.73 -0.43 -0.13 0.54 0.00 0.00 0.00 175.76 176.47 1k2e s VAL 69 N -1.74 1.26 0.39 0.00 0.11 -1.26 -1.39 120.40 117.77 1k2e s VAL 69 Ca -0.01 -0.53 -0.26 0.00 -2.93 0.00 0.00 61.98 58.26 1k2e s VAL 69 Cb -0.01 -1.16 -0.09 0.00 -1.53 0.00 0.00 36.38 33.60 1k2e s VAL 69 CO -0.01 0.39 1.17 -0.70 -3.33 0.00 0.00 175.10 172.62 1k2e s GLU 70 N 0.83 4.12 0.17 1.54 2.12 0.10 -5.00 118.70 122.57 1k2e s GLU 70 Ca -0.11 1.84 0.08 0.00 0.36 0.00 0.00 54.97 57.14 1k2e s GLU 70 Cb -0.15 -2.73 -0.04 0.00 0.26 0.00 0.00 34.13 31.47 1k2e s GLU 70 CO 0.02 -0.26 -0.05 1.03 -0.54 0.00 0.00 175.26 175.46 1k2e s ARG 71 N -2.22 2.24 0.50 4.30 1.81 -1.26 -4.93 118.95 119.39 1k2e s ARG 71 Ca 0.56 -1.15 -0.23 0.00 -1.72 0.00 0.00 55.73 53.18 1k2e s ARG 71 Cb -0.31 -2.28 -0.06 0.00 -0.45 0.00 0.00 34.95 31.85 1k2e s ARG 71 CO 0.39 0.46 1.31 -1.25 -0.68 0.00 0.00 175.30 175.52 1k2e s PRO 72 N -2.80 3.45 0.29 3.54 0.04 -1.26 -4.88 135.00 133.37 1k2e s PRO 72 Ca 0.26 2.12 -0.29 0.00 0.04 0.00 0.00 61.00 63.13 1k2e s PRO 72 Cb -0.09 -2.39 -0.10 0.00 0.04 0.00 0.00 34.50 31.96 1k2e s PRO 72 CO 0.17 -0.91 1.21 -1.64 0.04 0.00 0.00 177.00 175.87 1k2e s MET 73 N -2.73 4.49 0.83 4.56 -1.94 -0.60 -4.90 119.30 119.00 1k2e s MET 73 Ca 0.67 2.00 -0.11 0.00 -1.71 0.00 0.00 55.69 56.55 1k2e s MET 73 Cb -0.37 -3.14 0.10 0.00 2.01 0.00 0.00 34.83 33.42 1k2e s MET 73 CO 0.45 -0.01 1.12 -2.14 -0.01 0.00 0.00 175.02 174.43 1k2e s PRO 74 N -1.42 1.69 0.17 2.03 0.02 -1.26 -4.16 135.00 132.07 1k2e s PRO 74 Ca 0.48 1.37 -0.11 0.00 0.02 0.00 0.00 61.00 62.76 1k2e s PRO 74 Cb -0.36 -1.82 0.07 0.00 0.02 0.00 0.00 34.50 32.41 1k2e s PRO 74 CO 0.46 -2.10 1.68 1.25 -0.33 0.00 0.00 177.00 177.96 1k2e h LEU 75 N -1.41 0.90 -7.00 -5.54 5.85 -0.79 -3.46 115.31 103.84 1k2e h LEU 75 Ca -0.44 -0.23 -0.02 0.00 0.84 0.00 0.00 57.88 58.04 1k2e h LEU 75 Cb 1.25 -0.24 -0.17 0.00 0.37 0.00 0.00 40.66 41.88 1k2e h LEU 75 CO 0.47 0.89 0.26 0.54 -0.34 0.00 0.00 178.44 180.26 1k2e s VAL 76 N -5.32 0.00 -0.20 1.05 0.11 -1.08 -5.05 120.40 109.91 1k2e s VAL 76 Ca -0.13 0.00 0.01 0.00 -2.93 0.00 0.00 61.98 58.94 1k2e s VAL 76 Cb 0.13 -1.00 0.03 0.00 -1.53 0.00 0.00 36.38 34.01 1k2e s VAL 76 CO 0.82 0.00 -0.17 -0.63 -3.33 0.00 0.00 175.10 171.79 1k2e s ILE 77 N -2.17 2.02 -0.08 7.04 1.01 -1.26 -1.94 121.20 125.82 1k2e s ILE 77 Ca -0.05 -1.07 0.03 0.00 0.00 0.00 0.00 60.65 59.56 1k2e s ILE 77 Cb -0.00 -1.91 -0.02 0.00 0.01 0.00 0.00 42.46 40.54 1k2e s ILE 77 CO 0.00 0.39 -0.17 -0.76 0.00 0.00 0.00 174.94 174.40 1k2e s LEU 78 N 1.27 2.53 -0.52 2.97 1.43 -0.68 -4.96 118.68 120.72 1k2e s LEU 78 Ca 0.02 -0.34 -0.16 0.00 -1.03 0.00 0.00 54.13 52.62 1k2e s LEU 78 Cb -0.15 -1.52 0.11 0.00 0.03 0.00 0.00 46.19 44.66 1k2e s LEU 78 CO -0.11 0.25 0.46 -0.70 0.23 0.00 0.00 176.35 176.48 1k2e s GLU 79 N -0.15 2.97 0.04 1.70 2.12 -1.26 -0.52 118.70 123.60 1k2e s GLU 79 Ca -0.02 -1.60 -0.13 0.00 0.36 0.00 0.00 54.97 53.59 1k2e s GLU 79 Cb -0.14 -4.24 -0.06 0.00 0.26 0.00 0.00 34.13 29.96 1k2e s GLU 79 CO 0.04 -1.23 0.41 -1.21 -0.54 0.00 0.00 175.26 172.73 1k2e s GLU 80 N 1.61 3.85 -0.20 4.30 2.02 0.42 -4.94 118.70 125.76 1k2e s GLU 80 Ca 0.03 0.31 -0.02 0.00 0.02 0.00 0.00 54.97 55.32 1k2e s GLU 80 Cb -0.28 -3.10 -0.00 0.00 0.10 0.00 0.00 34.13 30.84 1k2e s GLU 80 CO 0.04 0.62 -0.09 0.08 0.02 0.00 0.00 175.26 175.93 1k2e s VAL 81 N -1.24 3.06 -0.29 2.63 1.01 -1.26 -1.01 120.40 123.30 1k2e s VAL 81 Ca 0.29 -0.61 0.00 0.00 0.00 0.00 0.00 61.98 61.66 1k2e s VAL 81 Cb -0.15 -2.36 0.05 0.00 0.00 0.00 0.00 36.38 33.92 1k2e s VAL 81 CO 0.16 0.46 -0.04 -0.69 0.00 0.00 0.00 175.10 174.99 1k2e s VAL 82 N 1.22 2.68 -0.10 2.92 1.01 -0.21 -4.99 120.40 122.94 1k2e s VAL 82 Ca 0.02 -1.50 -0.15 0.00 0.00 0.00 0.00 61.98 60.36 1k2e s VAL 82 Cb -0.14 -2.56 -0.05 0.00 0.00 0.00 0.00 36.38 33.63 1k2e s VAL 82 CO -0.03 -0.09 0.37 -0.54 0.00 0.00 0.00 175.10 174.81 1k2e s LYS 83 N 1.19 4.13 0.11 2.72 1.02 -1.26 -0.67 119.74 126.98 1k2e s LYS 83 Ca -0.06 0.28 0.07 0.00 0.02 0.00 0.00 55.97 56.28 1k2e s LYS 83 Cb -0.20 -3.35 -0.04 0.00 -0.52 0.00 0.00 37.83 33.72 1k2e s LYS 83 CO -0.03 0.38 -0.18 0.71 -0.92 0.00 0.00 175.35 175.32 1k2e s TYR 84 N -0.05 1.63 0.41 3.18 1.51 -0.53 -5.00 117.35 118.50 1k2e s TYR 84 Ca 0.21 -0.46 0.14 0.00 -1.01 0.00 0.00 57.07 55.95 1k2e s TYR 84 Cb -0.15 -0.87 0.98 0.00 -0.11 0.00 0.00 41.96 41.81 1k2e s TYR 84 CO 0.09 0.19 1.92 -1.35 -1.11 0.00 0.00 175.55 175.29 1k2e h PRO 85 N 3.86 0.48 -0.04 -1.71 0.11 -2.04 -2.22 132.00 130.44 1k2e h PRO 85 Ca -0.43 -0.03 -0.19 0.00 0.11 0.00 0.00 66.00 65.46 1k2e h PRO 85 Cb 1.19 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 1k2e h PRO 85 CO 0.44 0.32 -0.79 0.93 -0.21 0.00 0.00 178.00 178.69 1k2e h GLU 86 N 0.49 0.32 -1.60 1.05 3.07 -2.01 -3.48 114.58 112.43 1k2e h GLU 86 Ca 0.38 -0.29 0.20 0.00 -0.50 0.00 0.00 59.36 59.14 1k2e h GLU 86 Cb 0.76 0.07 -0.20 0.00 -0.84 0.00 0.00 28.75 28.54 1k2e h GLU 86 CO -0.13 0.95 0.73 -2.00 -1.40 0.00 0.00 179.01 177.16 1k2e s GLU 87 N -3.47 0.42 -0.07 2.33 2.12 -0.83 -5.15 118.70 114.05 1k2e s GLU 87 Ca -0.05 -0.09 -0.03 0.00 0.36 0.00 0.00 54.97 55.16 1k2e s GLU 87 Cb 0.10 0.20 -0.04 0.00 0.26 0.00 0.00 34.13 34.65 1k2e s GLU 87 CO 0.83 -0.17 0.06 0.99 -0.54 0.00 0.00 175.26 176.44 1k2e s THR 88 N -2.19 4.76 -0.04 -1.70 2.01 -1.26 -1.45 115.64 115.78 1k2e s THR 88 Ca 0.07 -0.18 0.05 0.00 0.31 0.00 0.00 61.69 61.93 1k2e s THR 88 Cb -0.01 -3.08 -0.02 0.00 0.01 0.00 0.00 72.50 69.39 1k2e s THR 88 CO -0.05 0.52 -0.18 -1.00 -0.69 0.00 0.00 174.62 173.22 1k2e s HIS 89 N -1.03 2.58 -0.25 4.92 0.09 0.15 -4.97 115.29 116.77 1k2e s HIS 89 Ca 0.17 -0.26 -0.06 0.00 -0.00 0.00 0.00 55.06 54.91 1k2e s HIS 89 Cb -0.12 -1.59 -0.01 0.00 -0.00 0.00 0.00 32.58 30.87 1k2e s HIS 89 CO 0.07 0.10 0.03 0.42 -0.00 0.00 0.00 174.74 175.36 1k2e s ILE 90 N -0.67 3.86 -0.20 0.60 -1.09 -1.26 -1.05 121.20 121.39 1k2e s ILE 90 Ca 0.11 -0.45 -0.01 0.00 -2.23 0.00 0.00 60.65 58.06 1k2e s ILE 90 Cb -0.10 -2.85 0.01 0.00 -1.58 0.00 0.00 42.46 37.94 1k2e s ILE 90 CO 0.00 0.29 -0.14 -1.00 -1.23 0.00 0.00 174.94 172.86 1k2e s HIS 91 N 1.53 2.85 -0.70 3.97 3.76 -0.18 0.47 115.29 126.99 1k2e s HIS 91 Ca 0.05 -1.36 -0.18 0.00 -0.15 0.00 0.00 55.06 53.42 1k2e s HIS 91 Cb -0.15 -1.99 0.13 0.00 1.11 0.00 0.00 32.58 31.67 1k2e s HIS 91 CO 0.01 -0.70 0.80 0.12 -0.85 0.00 0.00 174.74 174.11 1k2e s PHE 92 N 1.35 3.16 -0.48 1.40 5.36 -0.21 -0.44 117.98 128.12 1k2e s PHE 92 Ca 0.05 -1.23 -0.21 0.00 -0.96 0.00 0.00 56.93 54.59 1k2e s PHE 92 Cb -0.14 -4.03 0.04 0.00 -0.34 0.00 0.00 43.02 38.55 1k2e s PHE 92 CO -0.09 -1.28 0.68 0.34 -1.46 0.00 0.00 175.22 173.41 1k2e s ASP 93 N 3.37 6.29 -0.63 6.13 -1.08 0.32 -1.26 116.67 129.80 1k2e s ASP 93 Ca 0.17 -0.56 -0.24 0.00 -0.52 0.00 0.00 52.55 51.40 1k2e s ASP 93 Cb -0.18 -2.33 0.05 0.00 -1.46 0.00 0.00 42.92 39.01 1k2e s ASP 93 CO 0.01 -0.89 1.00 -0.76 0.52 0.00 0.00 175.17 175.04 1k2e s LEU 94 N 2.92 4.13 -0.42 -1.34 1.43 -0.48 -1.69 118.68 123.22 1k2e s LEU 94 Ca 0.21 -0.69 -0.18 0.00 -1.03 0.00 0.00 54.13 52.43 1k2e s LEU 94 Cb -0.16 -2.58 0.02 0.00 0.03 0.00 0.00 46.19 43.50 1k2e s LEU 94 CO 0.16 -1.42 0.48 -0.63 0.23 0.00 0.00 176.35 175.18 1k2e s ILE 95 N 4.24 5.03 0.00 -0.59 1.01 -0.82 -1.98 121.20 128.10 1k2e s ILE 95 Ca 0.27 -0.23 -0.08 0.00 0.00 0.00 0.00 60.65 60.60 1k2e s ILE 95 Cb -0.14 -4.07 -0.05 0.00 0.01 0.00 0.00 42.46 38.21 1k2e s ILE 95 CO 0.14 -0.45 0.30 -0.31 0.00 0.00 0.00 174.94 174.62 1k2e s TYR 96 N 2.28 3.60 0.18 3.97 1.51 -0.06 -0.06 117.35 128.77 1k2e s TYR 96 Ca 0.14 0.66 -0.30 0.00 -1.01 0.00 0.00 57.07 56.57 1k2e s TYR 96 Cb -0.16 -2.05 -0.08 0.00 -0.11 0.00 0.00 41.96 39.56 1k2e s TYR 96 CO 0.15 0.62 1.00 -1.17 -1.11 0.00 0.00 175.55 175.03 1k2e s LEU 97 N -1.61 4.55 0.21 -1.29 2.96 -1.26 -0.54 118.68 121.69 1k2e s LEU 97 Ca 0.26 1.96 0.04 0.00 -0.22 0.00 0.00 54.13 56.18 1k2e s LEU 97 Cb -0.14 -3.60 -0.05 0.00 0.50 0.00 0.00 46.19 42.90 1k2e s LEU 97 CO 0.15 -0.04 -0.05 0.68 -1.32 0.00 0.00 176.35 175.76 1k2e s VAL 98 N -0.51 1.19 0.09 1.68 -7.23 -0.44 -1.17 120.40 114.00 1k2e s VAL 98 Ca 0.46 -2.06 0.08 0.00 -1.81 0.00 0.00 61.98 58.64 1k2e s VAL 98 Cb -0.26 -2.18 -0.03 0.00 0.56 0.00 0.00 36.38 34.46 1k2e s VAL 98 CO 0.33 -0.47 -0.21 -1.59 -0.31 0.00 0.00 175.10 172.84 1k2e s LYS 99 N -3.80 1.24 0.14 4.82 -2.85 -0.32 -4.55 119.74 114.42 1k2e s LYS 99 Ca 0.25 -1.11 -0.30 0.00 -1.00 0.00 0.00 55.97 53.81 1k2e s LYS 99 Cb 0.04 -1.48 -0.06 0.00 -2.06 0.00 0.00 37.83 34.26 1k2e s LYS 99 CO 0.06 0.36 1.01 0.50 0.10 0.00 0.00 175.35 177.38 1k2e s ARG 100 N -1.68 4.67 0.00 1.78 3.52 -1.26 -0.95 118.95 125.02 1k2e s ARG 100 Ca 0.07 1.54 0.00 0.00 -0.13 0.00 0.00 55.73 57.22 1k2e s ARG 100 Cb -0.10 -3.34 0.00 0.00 -1.56 0.00 0.00 34.95 29.95 1k2e s ARG 100 CO 0.04 0.17 0.37 1.33 -0.81 0.00 0.00 175.30 176.39 1k2e n VAL 101 N 2.64 0.12 -3.69 7.11 0.24 0.42 -4.90 118.33 120.26 1k2e n VAL 101 Ca 0.02 -0.30 0.00 0.00 -2.04 0.00 0.00 64.34 62.02 1k2e n VAL 101 Cb 0.48 1.33 0.00 0.00 -1.47 0.00 0.00 33.84 34.18 1k2e n VAL 101 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1k2e n GLY 102 N -0.06 -1.24 5.11 7.63 0.00 -1.10 -4.97 105.19 110.56 1k2e n GLY 102 Ca 0.00 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 44.94 1k2e n GLY 102 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1k2e n GLY 103 N 0.00 -2.11 3.39 -0.02 0.00 -1.26 -0.82 105.19 104.37 1k2e n GLY 103 Ca 0.00 -1.54 -0.14 0.00 0.00 0.00 0.00 46.02 44.33 1k2e n GLY 103 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1k2e s ASP 104 N -3.70 -0.48 -0.19 1.61 2.15 -0.56 -4.82 116.67 110.69 1k2e s ASP 104 Ca 0.00 0.77 -0.29 0.00 0.43 0.00 0.00 52.55 53.46 1k2e s ASP 104 Cb 0.00 0.79 -0.04 0.00 -0.30 0.00 0.00 42.92 43.37 1k2e s ASP 104 CO 0.00 -0.31 1.89 -0.22 -0.17 0.00 0.00 175.17 176.35 1k2e s LEU 105 N -0.34 3.80 -0.03 -1.34 2.96 -1.26 -3.67 118.68 118.80 1k2e s LEU 105 Ca -0.05 1.84 0.08 0.00 -0.22 0.00 0.00 54.13 55.78 1k2e s LEU 105 Cb -0.03 -3.52 -0.12 0.00 0.50 0.00 0.00 46.19 43.01 1k2e s LEU 105 CO 0.03 -1.50 0.14 0.29 -1.32 0.00 0.00 176.35 173.99 1k2e n LYS 106 N 8.08 1.02 -3.61 1.98 5.02 0.11 -5.00 118.16 125.77 1k2e n LYS 106 Ca 0.23 -0.05 -0.15 0.00 -2.02 0.00 0.00 58.31 56.31 1k2e n LYS 106 Cb 0.45 -1.20 -0.06 0.00 -0.02 0.00 0.00 35.03 34.19 1k2e n LYS 106 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 1k2e s ASN 107 N -3.28 -0.43 0.00 4.39 0.02 -1.16 -4.99 114.94 109.48 1k2e s ASN 107 Ca -0.03 0.31 0.00 0.00 -1.02 0.00 0.00 52.86 52.11 1k2e s ASN 107 Cb 0.04 0.46 0.00 0.00 0.02 0.00 0.00 41.25 41.77 1k2e s ASN 107 CO 0.34 -0.61 0.00 0.61 0.02 0.00 0.00 177.10 177.46 1k2e n GLY 108 N 0.79 1.72 2.85 0.66 0.00 -1.26 -4.29 105.19 105.65 1k2e n GLY 108 Ca -0.19 -2.05 -0.15 0.00 0.00 0.00 0.00 46.02 43.62 1k2e n GLY 108 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1k2e s GLU 109 N -1.99 0.20 -0.39 1.61 2.02 0.22 -4.98 118.70 115.39 1k2e s GLU 109 Ca 0.00 0.03 -0.29 0.00 0.02 0.00 0.00 54.97 54.73 1k2e s GLU 109 Cb 0.00 -0.32 0.02 0.00 0.10 0.00 0.00 34.13 33.93 1k2e s GLU 109 CO 0.00 -0.07 1.17 -1.58 0.02 0.00 0.00 175.26 174.80 1k2e s TRP 110 N 0.60 2.88 -0.31 1.61 0.52 -1.26 -1.31 118.94 121.66 1k2e s TRP 110 Ca -0.06 0.91 -0.13 0.00 0.02 0.00 0.00 56.10 56.84 1k2e s TRP 110 Cb -0.08 -4.07 -0.03 0.00 -1.15 0.00 0.00 33.47 28.13 1k2e s TRP 110 CO -0.01 -1.23 0.29 0.42 0.02 0.00 0.00 176.95 176.44 1k2e s ILE 111 N 4.24 5.24 0.09 2.03 -1.09 0.33 -4.85 121.20 127.18 1k2e s ILE 111 Ca 0.50 0.11 -0.31 0.00 -2.23 0.00 0.00 60.65 58.71 1k2e s ILE 111 Cb -0.11 -3.69 -0.09 0.00 -1.58 0.00 0.00 42.46 36.99 1k2e s ILE 111 CO 0.25 0.07 1.72 -0.62 -1.23 0.00 0.00 174.94 175.13 1k2e s ASP 112 N 1.72 6.53 0.61 3.58 -1.08 -1.26 -0.82 116.67 125.95 1k2e s ASP 112 Ca 0.10 2.59 0.38 0.00 -0.52 0.00 0.00 52.55 55.10 1k2e s ASP 112 Cb -0.16 -2.56 2.00 0.00 -1.46 0.00 0.00 42.92 40.73 1k2e s ASP 112 CO 0.11 -0.93 2.23 -0.37 0.52 0.00 0.00 175.17 176.73 1k2e h VAL 113 N 4.79 0.13 0.00 1.11 -1.51 -1.57 -0.21 116.25 119.00 1k2e h VAL 113 Ca -0.44 -0.20 0.00 0.00 -1.23 0.00 0.00 66.70 64.84 1k2e h VAL 113 Cb 1.21 1.17 0.00 0.00 -2.13 0.00 0.00 31.29 31.53 1k2e h VAL 113 CO 0.94 0.02 0.00 0.54 -1.23 0.00 0.00 177.57 177.83 1k2e n ARG 114 N -3.23 0.07 0.00 5.19 1.74 -1.26 -3.05 116.66 116.11 1k2e n ARG 114 Ca -0.02 0.19 0.07 0.00 -0.77 0.00 0.00 57.85 57.32 1k2e n ARG 114 Cb 0.15 -1.61 -0.01 0.00 -1.02 0.00 0.00 32.46 29.97 1k2e n ARG 114 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1k2e n GLU 115 N -1.74 1.86 0.31 5.56 1.02 -0.10 -4.70 120.64 122.86 1k2e n GLU 115 Ca 0.05 -0.64 0.20 0.00 -0.02 0.00 0.00 57.16 56.74 1k2e n GLU 115 Cb 0.28 -1.22 1.00 0.00 -0.02 0.00 0.00 31.44 31.47 1k2e n GLU 115 CO 0.00 0.00 0.00 0.97 1.18 0.00 0.00 177.13 179.28 1k2e h ILE 116 N 1.38 0.10 0.00 -3.67 2.10 -1.46 -1.54 117.51 114.42 1k2e h ILE 116 Ca 0.00 -0.21 0.00 0.00 1.08 0.00 0.00 64.86 65.73 1k2e h ILE 116 Cb 0.47 1.19 0.00 0.00 -1.09 0.00 0.00 36.82 37.39 1k2e h ILE 116 CO 0.00 0.02 0.00 0.47 -1.08 0.00 0.00 178.15 177.56 1k2e n ASP 117 N -3.19 0.00 -0.25 2.19 8.00 -1.26 -2.56 116.55 119.48 1k2e n ASP 117 Ca -0.02 -0.16 0.08 0.00 0.71 0.00 0.00 54.79 55.40 1k2e n ASP 117 Cb 0.16 -0.25 0.15 0.00 -0.02 0.00 0.00 41.12 41.16 1k2e n ASP 117 CO 0.00 0.00 0.00 -2.11 -0.39 0.00 0.00 177.20 174.70 1k2e n ARG 118 N -1.25 1.25 -5.28 -1.24 -4.01 -0.58 -5.01 116.66 100.54 1k2e n ARG 118 Ca 0.13 -2.64 -0.31 0.00 -1.04 0.00 0.00 57.85 53.98 1k2e n ARG 118 Cb 0.18 -1.44 -0.16 0.00 -3.04 0.00 0.00 32.46 28.00 1k2e n ARG 118 CO 0.00 0.00 0.00 0.42 -3.04 0.00 0.00 177.63 175.01 1k2e s ILE 119 N -2.73 2.07 -0.58 8.89 1.01 -1.06 -5.08 121.20 123.72 1k2e s ILE 119 Ca 0.31 -1.08 -0.28 0.00 0.00 0.00 0.00 60.65 59.60 1k2e s ILE 119 Cb 0.29 -1.73 0.03 0.00 0.01 0.00 0.00 42.46 41.06 1k2e s ILE 119 CO 0.00 0.58 1.17 -0.70 0.00 0.00 0.00 174.94 175.98 1k2e s GLU 120 N -0.41 3.50 0.27 2.79 2.12 -1.26 -4.98 118.70 120.73 1k2e s GLU 120 Ca 0.04 0.20 0.08 0.00 0.36 0.00 0.00 54.97 55.64 1k2e s GLU 120 Cb -0.12 -4.02 -0.04 0.00 0.26 0.00 0.00 34.13 30.22 1k2e s GLU 120 CO 0.01 -1.66 0.15 0.95 -0.54 0.00 0.00 175.26 174.17 1k2e s THR 121 N 4.85 4.05 0.72 -1.70 -4.23 -1.26 -1.58 115.64 116.49 1k2e s THR 121 Ca 0.42 -1.55 -0.15 0.00 -1.18 0.00 0.00 61.69 59.22 1k2e s THR 121 Cb -0.08 -3.22 0.04 0.00 1.34 0.00 0.00 72.50 70.58 1k2e s THR 121 CO 0.25 -0.34 1.21 0.12 -0.54 0.00 0.00 174.62 175.32 1k2e s PHE 122 N -2.21 2.07 0.39 3.99 5.36 0.57 -4.73 117.98 123.42 1k2e s PHE 122 Ca 0.33 1.59 -0.25 0.00 -0.96 0.00 0.00 56.93 57.64 1k2e s PHE 122 Cb -0.07 -3.47 -0.11 0.00 -0.34 0.00 0.00 43.02 39.03 1k2e s PHE 122 CO 0.24 -2.59 1.04 -2.30 -1.46 0.00 0.00 175.22 170.15 1k2e n PRO 123 N -2.67 1.44 -0.60 10.12 -0.02 -1.26 -2.69 135.00 139.32 1k2e n PRO 123 Ca 0.13 0.51 0.00 0.00 -2.02 0.00 0.00 63.50 62.13 1k2e n PRO 123 Cb 0.50 -2.05 0.00 0.00 -0.02 0.00 0.00 33.50 31.93 1k2e n PRO 123 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1k2e n ASN 124 N 0.64 0.00 -0.35 2.55 3.02 -1.26 -4.89 115.26 114.98 1k2e n ASN 124 Ca 0.09 0.00 0.03 0.00 -0.03 0.00 0.00 54.58 54.67 1k2e n ASN 124 Cb 0.38 -1.46 0.18 0.00 -0.61 0.00 0.00 39.78 38.26 1k2e n ASN 124 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 1k2e h VAL 125 N 0.00 1.03 -0.45 2.41 2.07 -1.88 -1.82 116.25 117.62 1k2e h VAL 125 Ca 0.00 -0.37 -0.12 0.00 0.82 0.00 0.00 66.70 67.04 1k2e h VAL 125 Cb 0.00 -0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 29.63 1k2e h VAL 125 CO 0.00 0.19 -0.17 0.03 0.02 0.00 0.00 177.57 177.64 1k2e h ARG 126 N 1.07 0.91 -0.57 1.57 3.08 -1.90 -0.51 114.38 118.02 1k2e h ARG 126 Ca 0.43 -0.38 -0.02 0.00 0.07 0.00 0.00 59.98 60.08 1k2e h ARG 126 Cb 0.24 -0.04 -0.03 0.00 0.08 0.00 0.00 29.97 30.23 1k2e h ARG 126 CO -0.19 1.03 0.29 0.87 -1.07 0.00 0.00 179.97 180.90 1k2e h LYS 127 N 0.74 0.81 -0.69 0.04 1.57 -1.92 -0.70 116.57 116.42 1k2e h LYS 127 Ca 0.11 -0.11 -0.05 0.00 -1.87 0.00 0.00 60.65 58.73 1k2e h LYS 127 Cb 0.73 -0.15 -0.03 0.00 0.08 0.00 0.00 32.23 32.86 1k2e h LYS 127 CO 0.06 0.64 0.24 0.28 -0.57 0.00 0.00 179.45 180.10 1k2e h VAL 128 N 0.77 1.25 -0.63 0.50 2.07 -1.15 -1.13 116.25 117.92 1k2e h VAL 128 Ca 0.20 -0.84 -0.05 0.00 0.82 0.00 0.00 66.70 66.83 1k2e h VAL 128 Cb 0.08 0.49 -0.03 0.00 -1.52 0.00 0.00 31.29 30.31 1k2e h VAL 128 CO -0.03 0.33 0.18 0.58 0.02 0.00 0.00 177.57 178.65 1k2e h VAL 129 N 1.01 1.24 -0.60 2.57 2.07 -0.80 -0.35 116.25 121.40 1k2e h VAL 129 Ca 0.23 -0.85 -0.05 0.00 0.82 0.00 0.00 66.70 66.85 1k2e h VAL 129 Cb 0.27 0.56 -0.03 0.00 -1.52 0.00 0.00 31.29 30.57 1k2e h VAL 129 CO -0.01 0.33 0.18 -1.28 0.02 0.00 0.00 177.57 176.81 1k2e h SER 130 N 0.94 0.84 -0.60 0.57 0.87 -0.65 -0.54 113.55 114.98 1k2e h SER 130 Ca 0.21 -0.14 -0.07 0.00 -1.23 0.00 0.00 61.79 60.56 1k2e h SER 130 Cb 0.29 -0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 62.01 1k2e h SER 130 CO -0.01 0.79 0.11 -0.07 -0.53 0.00 0.00 176.83 177.13 1k2e h LEU 131 N 0.88 0.94 -0.73 2.23 3.38 -0.35 -2.55 115.31 119.10 1k2e h LEU 131 Ca 0.20 -0.25 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 1k2e h LEU 131 Cb 0.26 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 1k2e h LEU 131 CO -0.01 0.95 0.34 0.00 0.09 0.00 0.00 178.44 179.81 1k2e h ALA 132 N 1.02 0.94 -0.64 1.53 0.00 -0.46 -1.48 119.26 120.17 1k2e h ALA 132 Ca 0.18 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1k2e h ALA 132 Cb 0.40 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 1k2e h ALA 132 CO 0.01 0.51 0.41 -0.07 0.00 0.00 0.00 179.25 180.11 1k2e h LEU 133 N 1.02 0.75 -0.36 0.00 3.38 -0.86 0.15 115.31 119.40 1k2e h LEU 133 Ca 0.25 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.16 1k2e h LEU 133 Cb 0.13 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 1k2e h LEU 133 CO -0.03 0.57 0.14 0.28 0.09 0.00 0.00 178.44 179.49 1k2e h SER 134 N 0.87 0.50 -0.50 -0.43 0.02 -1.29 -0.51 113.55 112.20 1k2e h SER 134 Ca 0.23 -0.17 -0.02 0.00 -0.84 0.00 0.00 61.79 60.99 1k2e h SER 134 Cb -0.06 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 62.33 1k2e h SER 134 CO -0.05 0.53 0.22 0.74 -1.14 0.00 0.00 176.83 177.13 1k2e h THR 135 N 0.43 1.20 -0.51 -2.27 2.02 -0.94 -2.25 112.91 110.60 1k2e h THR 135 Ca 0.12 -0.61 -0.05 0.00 0.77 0.00 0.00 66.41 66.65 1k2e h THR 135 Cb 0.18 0.68 -0.02 0.00 -1.74 0.00 0.00 68.15 67.25 1k2e h THR 135 CO -0.01 0.23 0.11 -0.07 0.37 0.00 0.00 175.52 176.15 1k2e h LEU 136 N 0.66 0.72 -0.21 2.58 3.38 -0.50 -0.03 115.31 121.92 1k2e h LEU 136 Ca 0.17 -0.13 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 1k2e h LEU 136 Cb 0.16 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1k2e h LEU 136 CO -0.02 0.72 0.11 0.22 0.09 0.00 0.00 178.44 179.57 1k2e h TYR 137 N 0.75 0.29 -0.32 1.13 3.20 -0.83 -0.47 116.97 120.71 1k2e h TYR 137 Ca 0.16 -0.01 -0.09 0.00 3.14 0.00 0.00 58.73 61.94 1k2e h TYR 137 Cb 0.29 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.46 1k2e h TYR 137 CO 0.02 0.27 -0.17 0.00 -1.64 0.00 0.00 178.16 176.63 1k2e h ARG 138 N 0.23 0.58 -0.50 1.82 3.08 -0.94 -1.78 114.38 116.87 1k2e h ARG 138 Ca 0.07 -0.19 -0.05 0.00 0.07 0.00 0.00 59.98 59.88 1k2e h ARG 138 Cb 0.07 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.05 1k2e h ARG 138 CO -0.01 0.72 0.09 -0.07 -1.07 0.00 0.00 179.97 179.63 1k2e h LEU 139 N 0.52 0.72 -0.59 3.04 3.38 -0.64 -1.69 115.31 120.06 1k2e h LEU 139 Ca 0.09 -0.14 -0.11 0.00 0.09 0.00 0.00 57.88 57.81 1k2e h LEU 139 Cb 0.59 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 1k2e h LEU 139 CO 0.04 0.74 -0.08 1.23 0.09 0.00 0.00 178.44 180.45 1k2e h GLY 140 N 0.95 1.12 1.07 0.83 0.00 -0.65 -0.26 103.07 106.12 1k2e h GLY 140 Ca 0.16 -0.89 -0.03 0.00 0.00 0.00 0.00 47.33 46.57 1k2e h GLY 140 CO 0.00 0.81 0.39 0.50 0.00 0.00 0.00 176.54 178.24 1k2e h LYS 141 N 0.93 1.20 -0.54 4.80 1.79 -0.86 0.59 116.57 124.48 1k2e h LYS 141 Ca 0.15 -0.18 -0.12 0.00 -2.18 0.00 0.00 60.65 58.32 1k2e h LYS 141 Cb 0.65 -0.21 -0.02 0.00 -1.58 0.00 0.00 32.23 31.07 1k2e h LYS 141 CO 0.04 0.93 -0.12 0.82 -1.08 0.00 0.00 179.45 180.04 1k2e h ILE 142 N 1.19 1.27 -0.45 1.86 2.04 -0.98 -1.82 117.51 120.62 1k2e h ILE 142 Ca 0.28 -1.29 -0.08 0.00 1.00 0.00 0.00 64.86 64.78 1k2e h ILE 142 Cb 0.13 0.98 -0.02 0.00 -0.74 0.00 0.00 36.82 37.18 1k2e h ILE 142 CO -0.03 0.45 -0.03 -1.28 0.00 0.00 0.00 178.15 177.26 1k2e h SER 143 N 0.92 0.80 -0.20 1.72 0.87 -0.66 -1.28 113.55 115.72 1k2e h SER 143 Ca 0.14 -0.32 -0.07 0.00 -1.23 0.00 0.00 61.79 60.30 1k2e h SER 143 Cb 0.70 -0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 62.42 1k2e h SER 143 CO 0.05 0.93 -0.09 0.11 -0.53 0.00 0.00 176.83 177.30 1k2e h LYS 144 N 0.65 0.56 -0.34 2.24 1.57 -0.82 -1.55 116.57 118.88 1k2e h LYS 144 Ca 0.12 -0.16 -0.16 0.00 -1.87 0.00 0.00 60.65 58.58 1k2e h LYS 144 Cb 0.54 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.78 1k2e h LYS 144 CO 0.03 0.65 -0.43 1.25 -0.57 0.00 0.00 179.45 180.38 1k2e h LEU 145 N 0.52 0.94 -0.59 2.94 5.85 -1.12 -0.76 115.31 123.08 1k2e h LEU 145 Ca 0.10 -0.45 -0.01 0.00 0.84 0.00 0.00 57.88 58.36 1k2e h LEU 145 Cb 0.47 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.21 1k2e h LEU 145 CO 0.03 1.23 0.33 0.00 -0.34 0.00 0.00 178.44 179.69 1k2e h ALA 146 N 0.80 0.76 -0.55 1.25 0.00 -0.81 -1.66 119.26 119.04 1k2e h ALA 146 Ca 0.05 -0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.77 1k2e h ALA 146 Cb 1.02 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 1k2e h ALA 146 CO 0.10 0.27 -0.03 0.00 0.00 0.00 0.00 179.25 179.59 1k2e h ALA 147 N 1.16 0.91 -0.10 0.00 0.00 -1.13 -2.41 119.26 117.69 1k2e h ALA 147 Ca 0.21 -0.31 -0.07 0.00 0.00 0.00 0.00 54.91 54.74 1k2e h ALA 147 Cb 0.03 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1k2e h ALA 147 CO -0.03 0.64 -0.27 0.00 0.00 0.00 0.00 179.25 179.59 1k2e h ALA 148 N 1.08 1.36 0.00 0.00 0.00 -0.86 -2.14 119.26 118.69 1k2e h ALA 148 Ca 0.16 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 54.70 1k2e h ALA 148 Cb 0.55 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1k2e h ALA 148 CO 0.03 0.45 -0.31 -0.07 0.00 0.00 0.00 179.25 179.35 1k2e h LEU 149 N 0.17 0.00 -0.87 0.00 3.38 -1.03 -2.92 115.31 114.03 1k2e h LEU 149 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1k2e h LEU 149 Cb 0.57 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.32 1k2e h LEU 149 CO 0.04 0.31 0.00 1.21 0.09 0.00 0.00 178.44 180.09 1k2e n GLU 150 N -3.30 0.14 -0.05 1.13 4.07 -0.80 -1.70 120.64 120.12 1k2e n GLU 150 Ca 0.01 0.50 0.01 0.00 -0.06 0.00 0.00 57.16 57.62 1k2e n GLU 150 Cb 0.56 -1.85 0.03 0.00 -0.06 0.00 0.00 31.44 30.12 1k2e n GLU 150 CO 0.00 0.00 0.00 0.72 -0.06 0.00 0.00 177.13 177.79 1k2e n HIS 151 N -2.13 0.13 -0.89 4.31 8.25 -1.10 -5.12 115.22 118.67 1k2e n HIS 151 Ca 0.01 -0.05 0.00 0.00 -0.26 0.00 0.00 57.72 57.42 1k2e n HIS 151 Cb 0.13 -0.10 0.00 0.00 1.12 0.00 0.00 29.99 31.14 1k2e n HIS 151 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70