#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3keb n ASP 3 N 0.00 0.37 -3.60 1.62 8.00 -1.26 -5.00 116.55 116.68 3keb n ASP 3 Ca 0.00 0.16 -0.16 0.00 0.71 0.00 0.00 54.79 55.50 3keb n ASP 3 Cb 0.00 1.02 -0.07 0.00 -0.02 0.00 0.00 41.12 42.05 3keb n ASP 3 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 3keb s PHE 4 N -3.10 -0.55 0.02 1.24 5.36 -1.26 -5.07 117.98 114.63 3keb s PHE 4 Ca -0.06 1.04 0.04 0.00 -0.96 0.00 0.00 56.93 56.99 3keb s PHE 4 Cb 0.10 0.30 -0.02 0.00 -0.34 0.00 0.00 43.02 43.07 3keb s PHE 4 CO 0.85 -0.50 -0.12 -1.58 -1.46 0.00 0.00 175.22 172.40 3keb s TRP 5 N -0.91 1.08 -0.05 10.12 0.52 -1.26 -1.26 118.94 127.18 3keb s TRP 5 Ca -0.09 -0.29 0.06 0.00 0.02 0.00 0.00 56.10 55.79 3keb s TRP 5 Cb -0.02 -0.66 -0.01 0.00 -1.15 0.00 0.00 33.47 31.63 3keb s TRP 5 CO 0.07 0.01 -0.23 0.54 0.02 0.00 0.00 176.95 177.35 3keb s VAL 6 N -0.64 1.91 -0.16 4.03 0.11 -0.16 -4.69 120.40 120.80 3keb s VAL 6 Ca 0.02 -0.99 -0.15 0.00 -2.93 0.00 0.00 61.98 57.93 3keb s VAL 6 Cb -0.06 -1.62 -0.04 0.00 -1.53 0.00 0.00 36.38 33.13 3keb s VAL 6 CO 0.00 0.53 0.34 -1.58 -3.33 0.00 0.00 175.10 171.07 3keb s GLN 7 N -0.14 4.27 -0.31 1.54 2.00 0.43 -0.88 119.66 126.56 3keb s GLN 7 Ca -0.03 0.17 -0.01 0.00 -2.00 0.00 0.00 55.36 53.50 3keb s GLN 7 Cb -0.13 -3.44 0.10 0.00 0.80 0.00 0.00 33.01 30.34 3keb s GLN 7 CO 0.03 0.19 0.10 -0.47 -0.50 0.00 0.00 175.29 174.64 3keb s TYR 8 N 0.61 1.63 0.00 1.67 5.04 0.02 -0.49 117.35 125.83 3keb s TYR 8 Ca 0.19 -1.70 0.00 0.00 -2.44 0.00 0.00 57.07 53.11 3keb s TYR 8 Cb -0.14 -1.67 0.00 0.00 0.35 0.00 0.00 41.96 40.50 3keb s TYR 8 CO 0.06 -0.87 0.00 0.41 -1.34 0.00 0.00 175.55 173.80 3keb n GLY 9 N 4.84 4.05 1.04 8.97 0.00 -1.26 -1.32 105.19 121.51 3keb n GLY 9 Ca -0.02 0.05 0.09 0.00 0.00 0.00 0.00 46.02 46.14 3keb n GLY 9 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3keb n ASP 10 N 7.63 3.02 0.00 1.61 2.03 -1.26 -5.10 116.55 124.48 3keb n ASP 10 Ca 0.00 -1.99 0.00 0.00 0.52 0.00 0.00 54.79 53.32 3keb n ASP 10 Cb 0.00 -0.37 0.00 0.00 -0.72 0.00 0.00 41.12 40.03 3keb n ASP 10 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 3keb n GLU 11 N 1.15 3.29 0.00 -0.67 -0.58 -0.43 -5.16 120.64 118.24 3keb n GLU 11 Ca 0.19 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.93 3keb n GLU 11 Cb 0.48 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.35 3keb n GLU 11 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 3keb n LEU 13 N 0.00 0.00 -4.77 -4.62 4.77 -0.06 -0.80 117.00 111.52 3keb n LEU 13 Ca 0.00 0.00 -0.37 0.00 -0.03 0.00 0.00 56.01 55.61 3keb n LEU 13 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 3keb n LEU 13 CO 0.00 0.00 0.87 -2.84 -1.33 0.00 0.00 177.39 174.09 3keb s PRO 14 N -0.77 3.62 -0.12 3.23 0.02 -1.26 -0.98 135.00 138.74 3keb s PRO 14 Ca 0.00 1.90 0.02 0.00 0.02 0.00 0.00 61.00 62.94 3keb s PRO 14 Cb 0.00 -2.39 -0.00 0.00 0.02 0.00 0.00 34.50 32.13 3keb s PRO 14 CO 0.00 -0.70 -0.19 0.08 -0.33 0.00 0.00 177.00 175.86 3keb s VAL 15 N -1.47 2.45 0.05 3.83 1.01 -0.39 -4.45 120.40 121.42 3keb s VAL 15 Ca 0.65 -0.87 0.07 0.00 0.00 0.00 0.00 61.98 61.83 3keb s VAL 15 Cb -0.32 -1.99 -0.03 0.00 0.00 0.00 0.00 36.38 34.04 3keb s VAL 15 CO 0.39 0.54 -0.18 -0.63 0.00 0.00 0.00 175.10 175.21 3keb s ILE 16 N 0.49 2.76 0.00 2.22 1.01 0.29 -3.99 121.20 123.99 3keb s ILE 16 Ca -0.13 -1.21 0.00 0.00 0.00 0.00 0.00 60.65 59.31 3keb s ILE 16 Cb -0.17 -2.17 0.00 0.00 0.01 0.00 0.00 42.46 40.14 3keb s ILE 16 CO 0.05 0.32 0.00 0.61 0.00 0.00 0.00 174.94 175.92 3keb n GLY 17 N 1.52 0.30 3.30 6.18 0.00 -1.26 -2.06 105.19 113.17 3keb n GLY 17 Ca -0.16 -2.30 -0.41 0.00 0.00 0.00 0.00 46.02 43.15 3keb n GLY 17 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3keb s ASP 18 N -0.84 5.71 0.04 1.61 1.01 -1.19 -4.57 116.67 118.43 3keb s ASP 18 Ca 0.00 -1.39 -0.30 0.00 0.71 0.00 0.00 52.55 51.57 3keb s ASP 18 Cb 0.00 -2.02 -0.04 0.00 1.01 0.00 0.00 42.92 41.87 3keb s ASP 18 CO 0.00 -0.52 1.06 0.12 0.21 0.00 0.00 175.17 176.04 3keb s PHE 19 N 1.47 3.59 0.53 4.23 5.36 -1.26 -3.44 117.98 128.47 3keb s PHE 19 Ca 0.03 1.56 -0.22 0.00 -0.96 0.00 0.00 56.93 57.34 3keb s PHE 19 Cb -0.22 -3.23 -0.05 0.00 -0.34 0.00 0.00 43.02 39.17 3keb s PHE 19 CO 0.03 -0.47 1.38 -2.14 -1.46 0.00 0.00 175.22 172.56 3keb s PRO 20 N 0.85 3.23 0.29 10.12 0.02 -1.26 -4.97 135.00 143.28 3keb s PRO 20 Ca 0.54 2.30 0.09 0.00 0.02 0.00 0.00 61.00 63.95 3keb s PRO 20 Cb -0.25 -2.34 -0.06 0.00 0.02 0.00 0.00 34.50 31.88 3keb s PRO 20 CO 0.29 -1.14 -0.13 1.03 -0.33 0.00 0.00 177.00 176.73 3keb s ARG 21 N -2.82 1.64 0.07 5.54 0.52 -1.26 -4.75 118.95 117.89 3keb s ARG 21 Ca 0.70 -1.80 -0.37 0.00 -0.52 0.00 0.00 55.73 53.74 3keb s ARG 21 Cb -0.42 -1.51 -0.17 0.00 0.52 0.00 0.00 34.95 33.37 3keb s ARG 21 CO 0.50 0.18 1.31 1.17 0.02 0.00 0.00 175.30 178.49 3keb n LYS 22 N -0.63 1.02 0.00 3.54 4.81 -1.26 -1.18 118.16 124.46 3keb n LYS 22 Ca -0.06 0.37 0.00 0.00 -0.87 0.00 0.00 58.31 57.75 3keb n LYS 22 Cb 0.62 -1.99 0.00 0.00 0.02 0.00 0.00 35.03 33.68 3keb n LYS 22 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3keb n GLY 23 N 2.42 2.22 3.78 3.14 0.00 0.10 -4.98 105.19 111.88 3keb n GLY 23 Ca 0.19 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.84 3keb n GLY 23 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3keb s ASP 24 N -1.75 6.53 0.17 1.61 1.01 -0.32 -4.73 116.67 119.18 3keb s ASP 24 Ca 0.00 2.09 -0.29 0.00 0.71 0.00 0.00 52.55 55.05 3keb s ASP 24 Cb 0.00 -2.59 -0.07 0.00 1.01 0.00 0.00 42.92 41.27 3keb s ASP 24 CO 0.00 -0.65 0.93 -0.31 0.21 0.00 0.00 175.17 175.34 3keb s TYR 25 N -1.69 3.90 0.25 4.23 2.02 -1.26 -0.11 117.35 124.70 3keb s TYR 25 Ca 0.61 1.83 -0.31 0.00 -0.37 0.00 0.00 57.07 58.83 3keb s TYR 25 Cb -0.23 -2.98 -0.13 0.00 -0.40 0.00 0.00 41.96 38.22 3keb s TYR 25 CO 0.28 0.36 1.34 1.28 -1.57 0.00 0.00 175.55 177.23 3keb n LEU 26 N 2.07 2.92 -4.76 -1.29 4.77 0.01 -4.94 117.00 115.78 3keb n LEU 26 Ca -0.01 1.15 -0.39 0.00 -0.03 0.00 0.00 56.01 56.74 3keb n LEU 26 Cb 0.48 -1.41 0.03 0.00 -2.33 0.00 0.00 43.42 40.19 3keb n LEU 26 CO 0.50 -0.63 1.03 -2.84 -1.33 0.00 0.00 177.39 174.11 3keb s PRO 27 N -0.70 3.44 0.64 3.23 0.02 -1.26 -4.97 135.00 135.39 3keb s PRO 27 Ca 0.66 2.33 -0.18 0.00 0.02 0.00 0.00 61.00 63.83 3keb s PRO 27 Cb -0.66 -2.47 -0.01 0.00 0.02 0.00 0.00 34.50 31.37 3keb s PRO 27 CO 0.52 -0.98 1.22 -1.54 -0.33 0.00 0.00 177.00 175.90 3keb s SER 28 N -0.72 4.84 0.00 2.53 1.04 -1.26 -4.99 113.70 115.14 3keb s SER 28 Ca 0.66 2.42 0.00 0.00 0.48 0.00 0.00 55.95 59.51 3keb s SER 28 Cb -0.42 -2.60 0.00 0.00 0.10 0.00 0.00 66.02 63.10 3keb s SER 28 CO 0.52 -1.83 0.00 2.22 0.98 0.00 0.00 173.24 175.13 3keb n PHE 29 N -1.93 0.00 -0.46 5.02 1.16 -1.26 -5.03 117.46 114.95 3keb n PHE 29 Ca 0.14 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.72 3keb n PHE 29 Cb 0.49 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.36 3keb n PHE 29 CO 0.00 0.00 0.00 1.28 -1.87 0.00 0.00 176.76 176.17 3keb n LEU 31 N 0.00 0.00 -3.99 5.98 4.77 0.18 -4.07 117.00 119.87 3keb n LEU 31 Ca 0.00 0.00 -0.21 0.00 -0.03 0.00 0.00 56.01 55.77 3keb n LEU 31 Cb 0.00 0.00 -0.16 0.00 -2.33 0.00 0.00 43.42 40.93 3keb n LEU 31 CO 0.00 0.00 -0.44 0.54 -1.33 0.00 0.00 177.39 176.16 3keb s VAL 32 N -2.12 0.80 0.80 4.08 0.11 -0.99 -0.72 120.40 122.37 3keb s VAL 32 Ca 0.00 -0.34 -0.08 0.00 -2.93 0.00 0.00 61.98 58.63 3keb s VAL 32 Cb 0.00 -0.73 0.17 0.00 -1.53 0.00 0.00 36.38 34.30 3keb s VAL 32 CO 0.00 0.26 1.10 -0.90 -3.33 0.00 0.00 175.10 172.23 3keb n ASP 33 N 3.48 0.71 0.19 3.54 5.68 -0.33 -0.35 116.55 129.47 3keb n ASP 33 Ca -0.20 -1.78 0.14 0.00 -0.50 0.00 0.00 54.79 52.45 3keb n ASP 33 Cb 0.53 -0.78 0.63 0.00 -1.14 0.00 0.00 41.12 40.36 3keb n ASP 33 CO 0.00 0.00 0.00 -2.24 -1.33 0.00 0.00 177.20 173.63 3keb h ASP 34 N -1.09 0.00 -0.63 -1.12 2.03 -1.61 0.37 116.42 114.37 3keb h ASP 34 Ca -0.36 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.94 3keb h ASP 34 Cb 1.14 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.64 3keb h ASP 34 CO 0.31 0.00 0.00 0.00 -1.03 0.00 0.00 179.24 178.52 3keb n GLN 35 N -2.54 4.19 -1.04 4.15 6.02 -1.26 -4.29 117.38 122.60 3keb n GLN 35 Ca 0.01 -3.01 -0.01 0.00 -0.01 0.00 0.00 57.00 53.97 3keb n GLN 35 Cb 0.20 -2.04 -0.01 0.00 1.02 0.00 0.00 30.24 29.41 3keb n GLN 35 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 3keb n LYS 36 N 0.95 -0.44 -2.94 -1.09 5.02 0.12 -5.02 118.16 114.77 3keb n LYS 36 Ca 0.27 0.28 -0.38 0.00 -2.02 0.00 0.00 58.31 56.46 3keb n LYS 36 Cb 1.01 -3.75 -0.06 0.00 -0.02 0.00 0.00 35.03 32.21 3keb n LYS 36 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 3keb s HIS 37 N -1.89 3.78 0.41 2.13 3.76 -1.26 -4.77 115.29 117.46 3keb s HIS 37 Ca 0.00 1.63 -0.26 0.00 -0.15 0.00 0.00 55.06 56.28 3keb s HIS 37 Cb 0.00 -2.79 -0.10 0.00 1.11 0.00 0.00 32.58 30.80 3keb s HIS 37 CO 0.00 0.37 1.35 -0.25 -0.85 0.00 0.00 174.74 175.36 3keb n ASP 38 N 1.03 2.97 -3.82 1.40 8.00 -1.26 -1.19 116.55 123.68 3keb n ASP 38 Ca -0.02 1.14 -0.23 0.00 0.71 0.00 0.00 54.79 56.39 3keb n ASP 38 Cb 0.50 -1.54 -0.17 0.00 -0.02 0.00 0.00 41.12 39.88 3keb n ASP 38 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3keb s ALA 39 N -1.17 0.84 0.44 2.24 0.00 0.11 -4.80 121.76 119.42 3keb s ALA 39 Ca 0.59 -0.21 0.03 0.00 0.00 0.00 0.00 51.96 52.37 3keb s ALA 39 Cb -0.49 -0.73 -0.04 0.00 0.00 0.00 0.00 23.12 21.86 3keb s ALA 39 CO 0.59 -0.37 0.04 0.00 0.00 0.00 0.00 175.76 176.02 3keb s ALA 40 N 1.73 3.39 0.28 0.00 0.00 -1.26 -0.65 121.76 125.26 3keb s ALA 40 Ca 0.02 -1.22 0.01 0.00 0.00 0.00 0.00 51.96 50.77 3keb s ALA 40 Cb -0.13 0.32 0.56 0.00 0.00 0.00 0.00 23.12 23.87 3keb s ALA 40 CO -0.05 -0.16 1.83 -0.07 0.00 0.00 0.00 175.76 177.32 3keb h LEU 41 N 1.65 0.92 -2.68 0.00 3.38 -1.95 -0.45 115.31 116.18 3keb h LEU 41 Ca -0.41 0.05 0.01 0.00 0.09 0.00 0.00 57.88 57.61 3keb h LEU 41 Cb 1.28 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.89 3keb h LEU 41 CO 0.71 0.49 0.06 -0.33 0.09 0.00 0.00 178.44 179.45 3keb h GLU 42 N 0.99 0.00 0.00 1.13 3.07 -1.96 0.11 114.58 117.92 3keb h GLU 42 Ca 0.50 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.36 3keb h GLU 42 Cb 0.50 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.41 3keb h GLU 42 CO -0.27 0.00 0.00 -1.13 -1.40 0.00 0.00 179.01 176.21 3keb n SER 43 N -3.31 0.00 -2.45 1.42 3.41 -0.18 -3.01 113.62 109.51 3keb n SER 43 Ca -0.02 0.39 -0.24 0.00 -0.26 0.00 0.00 58.87 58.74 3keb n SER 43 Cb 0.14 -0.45 0.01 0.00 -0.26 0.00 0.00 64.21 63.64 3keb n SER 43 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 3keb n PHE 44 N -1.45 3.03 -2.32 7.33 3.72 0.37 -5.01 117.46 123.14 3keb n PHE 44 Ca 0.05 -2.95 -0.34 0.00 -0.05 0.00 0.00 57.45 54.16 3keb n PHE 44 Cb 0.20 -0.15 -0.01 0.00 -0.94 0.00 0.00 39.48 38.58 3keb n PHE 44 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 3keb s SER 45 N -3.50 5.93 -1.52 4.37 0.01 -1.16 -3.90 113.70 113.93 3keb s SER 45 Ca 0.46 2.04 -0.13 0.00 1.31 0.00 0.00 55.95 59.63 3keb s SER 45 Cb 0.41 -2.57 0.08 0.00 0.21 0.00 0.00 66.02 64.15 3keb s SER 45 CO -0.13 -1.07 0.95 1.41 0.41 0.00 0.00 173.24 174.81 3keb n HIS 46 N -1.29 -2.25 -3.79 2.43 8.25 -1.26 -4.99 115.22 112.32 3keb n HIS 46 Ca 0.10 0.90 -0.13 0.00 -0.26 0.00 0.00 57.72 58.33 3keb n HIS 46 Cb 0.52 -3.98 -0.11 0.00 1.12 0.00 0.00 29.99 27.53 3keb n HIS 46 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 3keb s THR 47 N -3.34 0.01 0.69 1.59 -1.32 -1.25 -5.00 115.64 107.02 3keb s THR 47 Ca 0.60 -0.07 -0.14 0.00 -1.21 0.00 0.00 61.69 60.87 3keb s THR 47 Cb -0.30 -0.38 0.02 0.00 -1.51 0.00 0.00 72.50 70.32 3keb s THR 47 CO 0.83 -0.04 1.13 -2.16 -2.21 0.00 0.00 174.62 172.17 3keb s PRO 48 N -0.05 2.55 0.02 7.08 0.04 -1.26 -3.97 135.00 139.40 3keb s PRO 48 Ca -0.02 1.45 -0.00 0.00 0.04 0.00 0.00 61.00 62.47 3keb s PRO 48 Cb -0.02 -1.91 -0.02 0.00 0.04 0.00 0.00 34.50 32.58 3keb s PRO 48 CO 0.01 -1.46 -0.02 -1.59 0.04 0.00 0.00 177.00 173.97 3keb s LYS 49 N -4.15 0.31 -0.30 4.56 -2.85 0.76 -1.00 119.74 117.06 3keb s LYS 49 Ca 0.68 -0.60 0.03 0.00 -1.00 0.00 0.00 55.97 55.08 3keb s LYS 49 Cb -0.22 0.11 0.08 0.00 -2.06 0.00 0.00 37.83 35.74 3keb s LYS 49 CO 0.44 -0.05 -0.03 -1.17 0.10 0.00 0.00 175.35 174.65 3keb s LEU 50 N -1.44 4.10 -0.16 2.77 2.96 0.20 -0.82 118.68 126.30 3keb s LEU 50 Ca -0.16 -1.75 -0.17 0.00 -0.22 0.00 0.00 54.13 51.83 3keb s LEU 50 Cb -0.10 -1.60 -0.04 0.00 0.50 0.00 0.00 46.19 44.95 3keb s LEU 50 CO -0.01 -0.29 0.44 -0.63 -1.32 0.00 0.00 176.35 174.54 3keb s ILE 51 N 1.02 5.19 -0.10 6.68 1.01 0.70 -0.93 121.20 134.77 3keb s ILE 51 Ca 0.00 0.84 0.02 0.00 0.00 0.00 0.00 60.65 61.51 3keb s ILE 51 Cb -0.20 -3.78 0.01 0.00 0.01 0.00 0.00 42.46 38.51 3keb s ILE 51 CO -0.06 0.29 -0.14 -0.69 0.00 0.00 0.00 174.94 174.34 3keb s VAL 52 N 0.95 1.38 -0.14 2.92 1.01 0.22 -0.38 120.40 126.37 3keb s VAL 52 Ca 0.23 -0.58 -0.13 0.00 0.00 0.00 0.00 61.98 61.49 3keb s VAL 52 Cb -0.15 -1.27 -0.05 0.00 0.00 0.00 0.00 36.38 34.91 3keb s VAL 52 CO 0.09 0.42 0.30 0.42 0.00 0.00 0.00 175.10 176.32 3keb s THR 53 N 0.94 5.29 0.33 3.92 -4.23 -0.58 -0.47 115.64 120.82 3keb s THR 53 Ca -0.08 0.56 0.09 0.00 -1.18 0.00 0.00 61.69 61.08 3keb s THR 53 Cb -0.15 -3.63 -0.05 0.00 1.34 0.00 0.00 72.50 70.01 3keb s THR 53 CO -0.00 0.43 -0.01 -0.76 -0.54 0.00 0.00 174.62 173.73 3keb s LEU 54 N 0.19 2.97 0.01 4.79 1.43 -1.07 -2.13 118.68 124.87 3keb s LEU 54 Ca 0.17 -0.95 -0.25 0.00 -1.03 0.00 0.00 54.13 52.07 3keb s LEU 54 Cb -0.13 -1.37 -0.17 0.00 0.03 0.00 0.00 46.19 44.54 3keb s LEU 54 CO 0.05 -0.19 1.28 -0.07 0.23 0.00 0.00 176.35 177.65 3keb h LEU 55 N 1.86 -0.26 -7.00 1.79 3.38 -0.29 -3.42 115.31 111.37 3keb h LEU 55 Ca -0.43 -0.22 0.08 0.00 0.09 0.00 0.00 57.88 57.41 3keb h LEU 55 Cb 1.25 0.07 -0.19 0.00 0.09 0.00 0.00 40.66 41.88 3keb h LEU 55 CO 0.65 0.10 0.50 -0.55 0.09 0.00 0.00 178.44 179.24 3keb s SER 56 N -5.20 -0.39 0.16 -0.43 0.15 -1.13 -4.57 113.70 102.29 3keb s SER 56 Ca -0.14 0.24 0.17 0.00 0.70 0.00 0.00 55.95 56.91 3keb s SER 56 Cb 0.02 0.36 0.77 0.00 -1.71 0.00 0.00 66.02 65.46 3keb s SER 56 CO 0.58 -0.49 1.52 1.33 1.20 0.00 0.00 173.24 177.37 3keb n VAL 57 N 0.29 1.11 -0.32 4.45 0.24 -1.26 -1.70 118.33 121.14 3keb n VAL 57 Ca -0.10 0.39 0.08 0.00 -2.04 0.00 0.00 64.34 62.67 3keb n VAL 57 Cb 0.60 -1.30 0.22 0.00 -1.47 0.00 0.00 33.84 31.89 3keb n VAL 57 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 3keb n ASP 58 N -1.93 3.41 -4.96 -1.34 8.00 -1.26 -4.54 116.55 113.93 3keb n ASP 58 Ca 0.01 -2.11 -0.23 0.00 0.71 0.00 0.00 54.79 53.18 3keb n ASP 58 Cb 0.13 -0.35 0.01 0.00 -0.02 0.00 0.00 41.12 40.89 3keb n ASP 58 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 3keb s GLU 59 N -1.20 3.08 0.00 -1.24 0.41 -0.69 -5.03 118.70 114.04 3keb s GLU 59 Ca 0.33 -0.53 0.00 0.00 -0.41 0.00 0.00 54.97 54.37 3keb s GLU 59 Cb 0.19 -2.58 0.00 0.00 -1.78 0.00 0.00 34.13 29.96 3keb s GLU 59 CO 0.21 -0.23 0.00 -3.47 -0.49 0.00 0.00 175.26 171.27 3keb n ASP 60 N -2.04 0.00 -0.11 -0.19 2.03 -1.26 -1.50 116.55 113.48 3keb n ASP 60 Ca 0.01 0.00 -0.04 0.00 0.52 0.00 0.00 54.79 55.28 3keb n ASP 60 Cb 0.58 0.00 0.17 0.00 -0.72 0.00 0.00 41.12 41.15 3keb n ASP 60 CO 0.00 0.00 0.00 -0.08 -1.92 0.00 0.00 177.20 175.20 3keb h GLU 61 N 0.00 0.79 -4.80 -0.67 4.81 -1.96 -2.96 114.58 109.80 3keb h GLU 61 Ca 0.00 -0.20 -0.72 0.00 -0.13 0.00 0.00 59.36 58.32 3keb h GLU 61 Cb 0.00 -0.10 -0.19 0.00 0.63 0.00 0.00 28.75 29.09 3keb h GLU 61 CO 0.00 0.78 0.92 -1.01 -0.73 0.00 0.00 179.01 178.96 3keb s HIS 62 N -5.05 3.33 -1.23 0.92 3.76 -1.26 -4.39 115.29 111.38 3keb s HIS 62 Ca -0.09 -1.71 -0.25 0.00 -0.15 0.00 0.00 55.06 52.86 3keb s HIS 62 Cb 0.15 -4.24 0.02 0.00 1.11 0.00 0.00 32.58 29.62 3keb s HIS 62 CO 0.81 -1.40 0.66 0.00 -0.85 0.00 0.00 174.74 173.95 3keb n ALA 63 N 5.93 -2.50 -2.99 -1.40 0.00 -0.56 -4.54 120.51 114.45 3keb n ALA 63 Ca 0.27 -0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.29 3keb n ALA 63 Cb 0.47 -2.98 0.00 0.00 0.00 0.00 0.00 19.45 16.94 3keb n ALA 63 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3keb n GLY 64 N -1.97 5.14 0.21 0.00 0.00 -1.24 0.30 105.19 107.63 3keb n GLY 64 Ca -0.13 -0.74 0.03 0.00 0.00 0.00 0.00 46.02 45.17 3keb n GLY 64 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3keb h LEU 65 N 0.00 0.07 -0.11 0.99 3.38 -1.30 -1.25 115.31 117.10 3keb h LEU 65 Ca 0.00 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 3keb h LEU 65 Cb 0.00 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 40.73 3keb h LEU 65 CO 0.00 0.35 -0.07 0.25 0.09 0.00 0.00 178.44 179.07 3keb h LEU 66 N 0.07 0.25 -0.96 1.67 5.85 -1.78 0.07 115.31 120.48 3keb h LEU 66 Ca 0.01 -0.43 0.09 0.00 0.84 0.00 0.00 57.88 58.39 3keb h LEU 66 Cb 0.53 -0.07 -0.07 0.00 0.37 0.00 0.00 40.66 41.41 3keb h LEU 66 CO 0.04 0.63 0.60 0.25 -0.34 0.00 0.00 178.44 179.62 3keb h LEU 67 N -0.13 0.92 -0.50 2.25 5.85 -1.68 -1.74 115.31 120.29 3keb h LEU 67 Ca 0.02 0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.74 3keb h LEU 67 Cb 0.54 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.39 3keb h LEU 67 CO 0.02 0.55 0.17 0.25 -0.34 0.00 0.00 178.44 179.09 3keb h LEU 68 N 1.03 0.71 -0.87 2.25 5.85 -1.15 -1.54 115.31 121.59 3keb h LEU 68 Ca 0.44 -0.19 -0.01 0.00 0.84 0.00 0.00 57.88 58.96 3keb h LEU 68 Cb 0.31 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.11 3keb h LEU 68 CO -0.22 0.71 0.51 -0.09 -0.34 0.00 0.00 178.44 179.02 3keb h ARG 69 N 0.67 1.19 -0.62 1.25 2.43 -0.16 -0.41 114.38 118.72 3keb h ARG 69 Ca 0.16 -0.12 -0.08 0.00 -0.81 0.00 0.00 59.98 59.14 3keb h ARG 69 Cb 0.24 -0.24 -0.03 0.00 -0.42 0.00 0.00 29.97 29.52 3keb h ARG 69 CO -0.01 0.85 0.08 0.93 -1.51 0.00 0.00 179.97 180.31 3keb h GLU 70 N 1.20 1.03 -0.47 0.20 4.39 -0.99 0.16 114.58 120.11 3keb h GLU 70 Ca 0.31 -0.28 -0.06 0.00 0.34 0.00 0.00 59.36 59.67 3keb h GLU 70 Cb -0.02 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 28.49 3keb h GLU 70 CO -0.06 0.96 0.06 1.15 -1.16 0.00 0.00 179.01 179.96 3keb h THR 71 N 0.97 1.25 -0.43 1.13 2.02 -0.89 -1.13 112.91 115.82 3keb h THR 71 Ca 0.19 -0.95 -0.00 0.00 0.77 0.00 0.00 66.41 66.42 3keb h THR 71 Cb 0.44 0.95 -0.02 0.00 -1.74 0.00 0.00 68.15 67.79 3keb h THR 71 CO 0.01 0.33 0.26 0.03 0.37 0.00 0.00 175.52 176.53 3keb h ARG 72 N 0.65 0.59 -0.65 6.66 3.08 -0.71 -1.78 114.38 122.22 3keb h ARG 72 Ca 0.14 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.12 3keb h ARG 72 Cb 0.42 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.31 3keb h ARG 72 CO 0.01 0.44 0.37 0.00 -1.07 0.00 0.00 179.97 179.72 3keb h ARG 73 N 0.58 0.91 -0.61 0.04 3.08 -0.89 -2.36 114.38 115.12 3keb h ARG 73 Ca 0.16 -0.10 0.07 0.00 0.07 0.00 0.00 59.98 60.18 3keb h ARG 73 Cb 0.00 -0.18 -0.06 0.00 0.08 0.00 0.00 29.97 29.81 3keb h ARG 73 CO -0.03 0.68 0.29 0.35 -1.07 0.00 0.00 179.97 180.19 3keb h PHE 74 N 0.89 0.52 0.00 3.04 3.57 -0.92 -2.33 116.94 121.71 3keb h PHE 74 Ca 0.23 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.76 3keb h PHE 74 Cb 0.03 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 38.63 3keb h PHE 74 CO -0.01 0.21 0.00 1.28 -2.23 0.00 0.00 178.31 177.56 3keb n LEU 75 N -4.90 0.00 -0.17 0.59 4.77 -0.70 -2.69 117.00 113.90 3keb n LEU 75 Ca 0.08 0.42 0.21 0.00 -0.03 0.00 0.00 56.01 56.69 3keb n LEU 75 Cb 0.22 -0.42 0.59 0.00 -2.33 0.00 0.00 43.42 41.48 3keb n LEU 75 CO 0.26 -0.19 1.22 0.44 -1.33 0.00 0.00 177.39 177.79 3keb h ASP 76 N 0.00 0.24 1.23 -1.43 3.32 -0.97 -0.74 116.42 118.07 3keb h ASP 76 Ca 0.00 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.07 3keb h ASP 76 Cb 0.23 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.76 3keb h ASP 76 CO 0.00 0.10 -0.06 -1.20 -1.72 0.00 0.00 179.24 176.36 3keb n SER 77 N -4.42 0.50 -3.20 6.45 7.64 -1.10 -4.42 113.62 115.07 3keb n SER 77 Ca 0.17 0.49 -0.23 0.00 1.01 0.00 0.00 58.87 60.30 3keb n SER 77 Cb 0.72 -0.59 -0.06 0.00 -1.01 0.00 0.00 64.21 63.27 3keb n SER 77 CO 0.00 0.00 0.00 0.79 -3.01 0.00 0.00 175.04 172.82 3keb n TRP 78 N -1.95 0.61 0.19 1.43 7.02 -0.29 -4.97 117.44 119.48 3keb n TRP 78 Ca 0.06 -3.74 0.09 0.00 -1.02 0.00 0.00 57.50 52.89 3keb n TRP 78 Cb 0.40 -0.41 0.44 0.00 -2.42 0.00 0.00 31.31 29.32 3keb n TRP 78 CO 0.00 0.00 0.00 -0.35 -2.02 0.00 0.00 177.69 175.32 3keb n PRO 79 N 0.91 0.11 -0.04 -0.99 -0.04 -1.22 -2.58 135.00 131.16 3keb n PRO 79 Ca 0.24 0.55 0.12 0.00 -0.04 0.00 0.00 63.50 64.38 3keb n PRO 79 Cb 0.54 -1.83 0.33 0.00 -0.04 0.00 0.00 33.50 32.51 3keb n PRO 79 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 3keb n HIS 80 N -2.06 0.11 -3.37 0.54 8.25 -1.26 -4.85 115.22 112.58 3keb n HIS 80 Ca -0.00 -0.06 -0.38 0.00 -0.26 0.00 0.00 57.72 57.02 3keb n HIS 80 Cb 0.07 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.10 3keb n HIS 80 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3keb s LEU 81 N -1.84 4.13 -0.21 2.41 1.43 -1.07 -4.43 118.68 119.10 3keb s LEU 81 Ca 0.34 0.49 -0.27 0.00 -1.03 0.00 0.00 54.13 53.67 3keb s LEU 81 Cb 0.20 -2.52 -0.00 0.00 0.03 0.00 0.00 46.19 43.90 3keb s LEU 81 CO 0.31 -0.11 0.92 -0.75 0.23 0.00 0.00 176.35 176.95 3keb s LYS 82 N 1.49 4.25 -0.16 1.70 2.47 -0.17 -4.79 119.74 124.53 3keb s LYS 82 Ca 0.19 1.15 -0.24 0.00 -1.56 0.00 0.00 55.97 55.51 3keb s LYS 82 Cb -0.15 -3.62 -0.02 0.00 -1.46 0.00 0.00 37.83 32.58 3keb s LYS 82 CO 0.08 -0.51 0.76 -1.17 0.16 0.00 0.00 175.35 174.67 3keb s LEU 83 N 2.80 4.19 -0.23 5.43 2.96 -1.26 -0.62 118.68 131.95 3keb s LEU 83 Ca 0.40 1.10 0.01 0.00 -0.22 0.00 0.00 54.13 55.42 3keb s LEU 83 Cb -0.16 -3.13 0.05 0.00 0.50 0.00 0.00 46.19 43.46 3keb s LEU 83 CO 0.08 -0.32 -0.09 -0.63 -1.32 0.00 0.00 176.35 174.08 3keb s ILE 84 N 1.85 1.73 -0.19 6.68 1.01 -0.10 -1.63 121.20 130.54 3keb s ILE 84 Ca 0.36 -1.23 -0.09 0.00 0.00 0.00 0.00 60.65 59.69 3keb s ILE 84 Cb -0.17 -1.88 -0.05 0.00 0.01 0.00 0.00 42.46 40.38 3keb s ILE 84 CO 0.13 0.03 0.10 -0.69 0.00 0.00 0.00 174.94 174.51 3keb s VAL 85 N 1.32 5.15 -0.10 2.92 1.01 0.16 -0.61 120.40 130.25 3keb s VAL 85 Ca -0.05 0.09 0.02 0.00 0.00 0.00 0.00 61.98 62.05 3keb s VAL 85 Cb -0.18 -3.34 0.01 0.00 0.00 0.00 0.00 36.38 32.88 3keb s VAL 85 CO -0.07 0.45 -0.17 -0.63 0.00 0.00 0.00 175.10 174.68 3keb s ILE 86 N 0.34 1.62 0.25 2.22 1.01 0.37 -0.28 121.20 126.75 3keb s ILE 86 Ca 0.06 -0.74 0.02 0.00 0.00 0.00 0.00 60.65 59.99 3keb s ILE 86 Cb -0.12 -1.46 -0.03 0.00 0.01 0.00 0.00 42.46 40.86 3keb s ILE 86 CO -0.01 0.46 0.21 0.42 0.00 0.00 0.00 174.94 176.02 3keb s THR 87 N 0.77 0.00 -1.40 2.92 -4.23 -0.49 -2.59 115.64 110.62 3keb s THR 87 Ca -0.11 -1.97 0.30 0.00 -1.18 0.00 0.00 61.69 58.73 3keb s THR 87 Cb -0.16 -2.50 0.48 0.00 1.34 0.00 0.00 72.50 71.67 3keb s THR 87 CO 0.02 0.00 2.01 0.55 -0.54 0.00 0.00 174.62 176.66 3keb n VAL 88 N -0.42 0.00 -1.63 2.29 3.14 -1.26 -1.56 118.33 118.89 3keb n VAL 88 Ca 0.04 -0.01 -0.38 0.00 -2.96 0.00 0.00 64.34 61.03 3keb n VAL 88 Cb 0.64 -0.45 0.04 0.00 -1.06 0.00 0.00 33.84 33.02 3keb n VAL 88 CO 0.00 0.00 0.00 0.47 -6.46 0.00 0.00 176.83 170.84 3keb n ASP 89 N -1.28 1.08 -4.74 6.55 8.00 -1.26 -4.73 116.55 120.16 3keb n ASP 89 Ca 0.13 0.87 -0.35 0.00 0.71 0.00 0.00 54.79 56.16 3keb n ASP 89 Cb 0.26 -1.40 0.07 0.00 -0.02 0.00 0.00 41.12 40.02 3keb n ASP 89 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 3keb s SER 90 N -1.10 4.65 0.30 -2.24 1.04 -1.26 -4.49 113.70 110.60 3keb s SER 90 Ca 0.73 2.32 0.06 0.00 0.48 0.00 0.00 55.95 59.54 3keb s SER 90 Cb -0.44 -2.59 0.74 0.00 0.10 0.00 0.00 66.02 63.83 3keb s SER 90 CO 0.49 -1.95 1.78 -0.65 0.98 0.00 0.00 173.24 173.88 3keb h PRO 91 N 0.15 0.74 -0.43 4.02 0.11 -1.89 -1.50 132.00 133.20 3keb h PRO 91 Ca -0.48 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.58 3keb h PRO 91 Cb 1.29 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 32.21 3keb h PRO 91 CO 0.52 0.49 0.28 0.77 -0.21 0.00 0.00 178.00 179.85 3keb h SER 92 N 0.76 0.50 -0.14 -2.05 0.02 -1.92 -0.38 113.55 110.34 3keb h SER 92 Ca 0.58 -0.02 -0.08 0.00 -0.84 0.00 0.00 61.79 61.43 3keb h SER 92 Cb 0.90 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 63.30 3keb h SER 92 CO -0.38 0.37 -0.16 0.28 -1.14 0.00 0.00 176.83 175.79 3keb h SER 93 N 0.58 0.53 -0.47 3.07 0.02 -1.77 -1.65 113.55 113.87 3keb h SER 93 Ca 0.16 -0.15 -0.07 0.00 -0.84 0.00 0.00 61.79 60.88 3keb h SER 93 Cb -0.06 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 62.32 3keb h SER 93 CO -0.03 0.71 0.00 -0.07 -1.14 0.00 0.00 176.83 176.30 3keb h LEU 94 N 0.49 0.81 -0.75 5.07 3.38 -0.91 -0.47 115.31 122.92 3keb h LEU 94 Ca 0.08 -0.31 0.01 0.00 0.09 0.00 0.00 57.88 57.75 3keb h LEU 94 Cb 0.57 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 41.07 3keb h LEU 94 CO 0.04 0.91 0.49 0.00 0.09 0.00 0.00 178.44 179.97 3keb h ALA 95 N 0.92 0.95 -0.49 1.53 0.00 -0.97 -1.36 119.26 119.84 3keb h ALA 95 Ca 0.13 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 3keb h ALA 95 Cb 0.50 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 3keb h ALA 95 CO 0.02 0.38 0.27 -0.09 0.00 0.00 0.00 179.25 179.83 3keb h ARG 96 N 1.02 0.68 -0.61 0.00 2.43 -0.99 -0.56 114.38 116.35 3keb h ARG 96 Ca 0.27 -0.08 0.05 0.00 -0.81 0.00 0.00 59.98 59.42 3keb h ARG 96 Cb -0.10 -0.13 -0.05 0.00 -0.42 0.00 0.00 29.97 29.26 3keb h ARG 96 CO -0.06 0.52 0.33 0.00 -1.51 0.00 0.00 179.97 179.25 3keb h ALA 97 N 1.12 0.80 -0.25 2.80 0.00 -0.63 -0.18 119.26 122.91 3keb h ALA 97 Ca 0.17 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 3keb h ALA 97 Cb 0.04 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 3keb h ALA 97 CO -0.03 -0.00 0.13 -0.09 0.00 0.00 0.00 179.25 179.26 3keb h ARG 98 N 0.61 0.36 -0.66 0.00 2.43 -0.96 0.17 114.38 116.34 3keb h ARG 98 Ca 0.27 -0.05 0.08 0.00 -0.81 0.00 0.00 59.98 59.47 3keb h ARG 98 Cb 0.16 -0.07 -0.06 0.00 -0.42 0.00 0.00 29.97 29.58 3keb h ARG 98 CO -0.17 0.34 0.33 1.25 -1.51 0.00 0.00 179.97 180.21 3keb h HIS 99 N 0.29 0.60 0.00 2.20 2.76 -0.56 0.14 115.15 120.57 3keb h HIS 99 Ca 0.09 0.03 -0.26 0.00 -2.20 0.00 0.00 60.37 58.02 3keb h HIS 99 Cb 0.09 -0.17 -0.04 0.00 1.55 0.00 0.00 27.41 28.84 3keb h HIS 99 CO -0.03 0.24 -1.44 0.93 -1.30 0.00 0.00 177.93 176.33 3keb h GLU 100 N 0.59 0.00 -0.00 5.26 4.39 -0.76 -3.39 114.58 120.66 3keb h GLU 100 Ca 0.32 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.01 3keb h GLU 100 Cb 0.29 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.94 3keb h GLU 100 CO -0.24 0.69 -0.13 0.72 -1.16 0.00 0.00 179.01 178.89 3keb n HIS 101 N -3.16 0.00 0.00 4.33 8.25 0.58 -5.06 115.22 120.16 3keb n HIS 101 Ca -0.11 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.35 3keb n HIS 101 Cb 1.01 0.00 0.00 0.00 1.12 0.00 0.00 29.99 32.12 3keb n HIS 101 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3keb n GLY 102 N 0.77 2.17 3.59 -1.41 0.00 0.48 -4.85 105.19 105.94 3keb n GLY 102 Ca 0.02 -0.20 -0.20 0.00 0.00 0.00 0.00 46.02 45.64 3keb n GLY 102 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3keb n LEU 103 N 0.00 -3.56 -4.72 0.99 4.77 -1.26 -4.79 117.00 108.42 3keb n LEU 103 Ca 0.00 -0.76 -0.42 0.00 -0.03 0.00 0.00 56.01 54.80 3keb n LEU 103 Cb 0.00 -2.83 -0.03 0.00 -2.33 0.00 0.00 43.42 38.23 3keb n LEU 103 CO 0.00 0.38 1.31 -2.16 -1.33 0.00 0.00 177.39 175.59 3keb s PRO 104 N -5.68 4.16 -1.02 3.23 0.04 -1.26 -2.23 135.00 132.25 3keb s PRO 104 Ca 0.06 2.52 0.00 0.00 0.04 0.00 0.00 61.00 63.61 3keb s PRO 104 Cb -0.01 -3.10 0.00 0.00 0.04 0.00 0.00 34.50 31.43 3keb s PRO 104 CO 0.78 -0.69 0.00 0.09 0.04 0.00 0.00 177.00 177.22 3keb n ASN 105 N 3.90 -5.21 -4.72 6.66 3.02 -1.26 -4.99 115.26 112.67 3keb n ASN 105 Ca 0.15 0.24 -0.36 0.00 -0.03 0.00 0.00 54.58 54.57 3keb n ASN 105 Cb 0.36 -3.55 -0.07 0.00 -0.61 0.00 0.00 39.78 35.91 3keb n ASN 105 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3keb s ILE 106 N -2.00 5.32 0.07 2.41 1.01 -0.95 -4.51 121.20 122.55 3keb s ILE 106 Ca 0.00 0.47 -0.30 0.00 0.00 0.00 0.00 60.65 60.82 3keb s ILE 106 Cb 0.00 -3.60 -0.05 0.00 0.01 0.00 0.00 42.46 38.82 3keb s ILE 106 CO 0.00 0.38 1.03 0.00 0.00 0.00 0.00 174.94 176.35 3keb s ALA 107 N 0.57 3.26 -0.27 9.38 0.00 -0.65 -4.97 121.76 129.07 3keb s ALA 107 Ca 0.14 0.65 -0.00 0.00 0.00 0.00 0.00 51.96 52.74 3keb s ALA 107 Cb -0.13 -3.34 0.05 0.00 0.00 0.00 0.00 23.12 19.70 3keb s ALA 107 CO 0.03 -0.20 -0.05 -0.51 0.00 0.00 0.00 175.76 175.03 3keb s LEU 108 N 0.51 3.56 -0.03 0.00 1.43 -1.26 -0.66 118.68 122.22 3keb s LEU 108 Ca 0.51 -1.19 0.07 0.00 -1.03 0.00 0.00 54.13 52.50 3keb s LEU 108 Cb -0.24 -1.65 -0.02 0.00 0.03 0.00 0.00 46.19 44.31 3keb s LEU 108 CO 0.30 -0.20 -0.25 -0.76 0.23 0.00 0.00 176.35 175.67 3keb s LEU 109 N 1.23 2.05 -0.02 1.79 1.43 0.62 -1.78 118.68 124.00 3keb s LEU 109 Ca -0.05 -0.47 -0.00 0.00 -1.03 0.00 0.00 54.13 52.58 3keb s LEU 109 Cb -0.19 -1.31 -0.04 0.00 0.03 0.00 0.00 46.19 44.68 3keb s LEU 109 CO -0.03 0.28 0.04 -0.55 0.23 0.00 0.00 176.35 176.33 3keb s SER 110 N -0.44 5.46 0.00 2.29 0.15 0.52 -1.40 113.70 120.28 3keb s SER 110 Ca 0.05 0.11 0.09 0.00 0.70 0.00 0.00 55.95 56.91 3keb s SER 110 Cb -0.11 -1.53 0.29 0.00 -1.71 0.00 0.00 66.02 62.96 3keb s SER 110 CO 0.01 0.30 1.23 0.35 1.20 0.00 0.00 173.24 176.33 3keb n THR 111 N 1.45 0.35 -0.22 6.45 -2.24 -0.60 -2.35 114.28 117.11 3keb n THR 111 Ca -0.15 -0.36 -0.01 0.00 -2.27 0.00 0.00 64.05 61.26 3keb n THR 111 Cb 0.53 0.19 0.06 0.00 -2.10 0.00 0.00 70.33 69.00 3keb n THR 111 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 3keb h LEU 112 N 1.61 -0.74 -1.44 3.22 5.85 -1.84 -2.66 115.31 119.30 3keb h LEU 112 Ca 0.00 0.21 -0.06 0.00 0.84 0.00 0.00 57.88 58.87 3keb h LEU 112 Cb 0.37 0.45 -0.01 0.00 0.37 0.00 0.00 40.66 41.84 3keb h LEU 112 CO 0.00 -0.24 -0.28 -0.09 -0.34 0.00 0.00 178.44 177.49 3keb h ARG 113 N -0.04 0.00 -0.86 1.25 1.12 -1.93 -3.39 114.38 110.53 3keb h ARG 113 Ca 0.30 0.00 0.11 0.00 -1.11 0.00 0.00 59.98 59.28 3keb h ARG 113 Cb 0.51 0.00 -0.21 0.00 -0.01 0.00 0.00 29.97 30.26 3keb h ARG 113 CO -0.69 0.28 -0.22 0.20 -3.11 0.00 0.00 179.97 176.43 3keb s GLY 114 N -4.26 -0.96 0.00 2.80 0.00 -1.02 -5.02 107.32 98.87 3keb s GLY 114 Ca -0.03 1.82 0.15 0.00 0.00 0.00 0.00 44.72 46.66 3keb s GLY 114 CO 0.70 3.55 1.47 0.54 0.00 0.00 0.00 173.10 179.36 3keb n ARG 115 N 5.42 0.01 0.07 2.90 5.12 -1.09 -2.83 116.66 126.25 3keb n ARG 115 Ca -0.00 0.24 0.08 0.00 -1.93 0.00 0.00 57.85 56.24 3keb n ARG 115 Cb 0.52 -1.50 0.36 0.00 -1.16 0.00 0.00 32.46 30.68 3keb n ARG 115 CO 0.00 0.00 0.00 -0.40 -1.93 0.00 0.00 177.63 175.30 3keb n ASP 116 N -1.49 0.30 -0.32 0.55 5.75 -1.26 -1.37 116.55 118.70 3keb n ASP 116 Ca 0.04 0.59 0.20 0.00 -0.01 0.00 0.00 54.79 55.61 3keb n ASP 116 Cb 0.17 -0.65 0.41 0.00 -1.03 0.00 0.00 41.12 40.02 3keb n ASP 116 CO 0.00 0.00 0.00 0.15 -0.11 0.00 0.00 177.20 177.24 3keb h PHE 117 N 0.00 0.53 -0.30 2.11 3.57 -1.89 -2.42 116.94 118.53 3keb h PHE 117 Ca 0.00 0.05 -0.00 0.00 3.53 0.00 0.00 57.97 61.54 3keb h PHE 117 Cb 0.21 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 38.86 3keb h PHE 117 CO 0.00 -0.31 0.17 0.45 -2.23 0.00 0.00 178.31 176.39 3keb h HIS 118 N 0.15 0.41 -0.08 0.41 3.86 -1.51 -1.12 115.15 117.27 3keb h HIS 118 Ca 0.68 -0.01 -0.18 0.00 -1.16 0.00 0.00 60.37 59.70 3keb h HIS 118 Cb 1.54 -0.13 -0.01 0.00 1.06 0.00 0.00 27.41 29.87 3keb h HIS 118 CO -0.19 0.33 -0.72 -0.22 0.86 0.00 0.00 177.93 177.99 3keb h LYS 119 N 0.37 0.40 0.00 2.45 3.64 -1.73 0.01 116.57 121.71 3keb h LYS 119 Ca 0.11 -0.32 0.00 0.00 -1.27 0.00 0.00 60.65 59.16 3keb h LYS 119 Cb 0.05 0.07 0.00 0.00 -0.41 0.00 0.00 32.23 31.94 3keb h LYS 119 CO -0.02 0.96 0.00 0.00 -2.27 0.00 0.00 179.45 178.12 3keb h ARG 120 N 0.27 0.00 -0.20 1.90 3.08 -0.99 -2.37 114.38 116.07 3keb h ARG 120 Ca -0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.02 3keb h ARG 120 Cb 1.29 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.34 3keb h ARG 120 CO 0.12 0.00 0.00 0.66 -1.07 0.00 0.00 179.97 179.68 3keb n TYR 121 N -2.86 0.24 -2.96 3.04 4.02 -0.47 -4.67 117.16 113.51 3keb n TYR 121 Ca 0.01 -0.16 -0.15 0.00 -0.01 0.00 0.00 57.90 57.59 3keb n TYR 121 Cb 0.32 -0.00 0.04 0.00 -0.02 0.00 0.00 39.34 39.67 3keb n TYR 121 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3keb n GLY 122 N 1.03 -0.04 0.25 2.72 0.00 -0.80 -4.18 105.19 104.17 3keb n GLY 122 Ca 0.13 -0.15 0.06 0.00 0.00 0.00 0.00 46.02 46.06 3keb n GLY 122 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3keb n VAL 123 N -4.07 1.12 -2.50 1.61 0.24 -0.08 -4.56 118.33 110.09 3keb n VAL 123 Ca -0.03 -1.34 -0.42 0.00 -2.04 0.00 0.00 64.34 60.51 3keb n VAL 123 Cb 0.56 0.06 -0.03 0.00 -1.47 0.00 0.00 33.84 32.96 3keb n VAL 123 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 3keb s LEU 124 N -1.70 4.39 -0.08 1.34 2.96 -0.87 -0.81 118.68 123.90 3keb s LEU 124 Ca 0.19 1.95 0.05 0.00 -0.22 0.00 0.00 54.13 56.09 3keb s LEU 124 Cb 0.17 -3.58 -0.00 0.00 0.50 0.00 0.00 46.19 43.27 3keb s LEU 124 CO 0.02 -0.38 -0.24 -0.63 -1.32 0.00 0.00 176.35 173.79 3keb s ILE 125 N 0.84 2.04 -0.33 6.68 1.01 -1.19 -0.54 121.20 129.71 3keb s ILE 125 Ca 0.56 -1.03 0.04 0.00 0.00 0.00 0.00 60.65 60.22 3keb s ILE 125 Cb -0.28 -1.75 -0.00 0.00 0.01 0.00 0.00 42.46 40.44 3keb s ILE 125 CO 0.30 0.56 0.38 0.35 0.00 0.00 0.00 174.94 176.53 3keb n THR 126 N 3.32 0.00 -3.90 2.92 -2.24 -1.26 -0.56 114.28 112.56 3keb n THR 126 Ca -0.19 -0.46 -0.34 0.00 -2.27 0.00 0.00 64.05 60.80 3keb n THR 126 Cb 0.53 1.04 -0.05 0.00 -2.10 0.00 0.00 70.33 69.75 3keb n THR 126 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3keb s GLU 127 N -0.85 3.44 0.23 -0.78 2.02 -1.26 -4.53 118.70 116.97 3keb s GLU 127 Ca 0.03 -0.29 -0.30 0.00 0.02 0.00 0.00 54.97 54.43 3keb s GLU 127 Cb 0.03 -3.11 -0.15 0.00 0.10 0.00 0.00 34.13 31.00 3keb s GLU 127 CO 0.10 0.69 1.00 0.98 0.02 0.00 0.00 175.26 178.06 3keb n TYR 128 N 1.13 1.03 0.14 1.61 4.19 -1.26 -1.45 117.16 122.54 3keb n TYR 128 Ca -0.12 0.74 0.11 0.00 3.31 0.00 0.00 57.90 61.93 3keb n TYR 128 Cb 0.53 -2.22 0.27 0.00 0.49 0.00 0.00 39.34 38.41 3keb n TYR 128 CO 0.00 0.00 0.00 -0.35 0.91 0.00 0.00 176.86 177.42 3keb n PRO 129 N 1.18 2.43 -0.54 2.98 -0.04 -1.26 -4.85 135.00 134.89 3keb n PRO 129 Ca 0.13 -2.20 0.08 0.00 -0.04 0.00 0.00 63.50 61.47 3keb n PRO 129 Cb 0.28 -1.49 0.29 0.00 -0.04 0.00 0.00 33.50 32.53 3keb n PRO 129 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3keb n LEU 130 N 1.32 4.26 -4.65 1.53 4.77 -0.53 -5.01 117.00 118.68 3keb n LEU 130 Ca 0.20 -3.02 -0.55 0.00 -0.03 0.00 0.00 56.01 52.61 3keb n LEU 130 Cb 0.54 -0.58 -0.07 0.00 -2.33 0.00 0.00 43.42 40.98 3keb n LEU 130 CO 0.15 0.68 1.13 -1.20 -1.33 0.00 0.00 177.39 176.81 3keb n SER 131 N -0.31 2.03 0.00 -1.43 7.64 -0.71 -1.15 113.62 119.69 3keb n SER 131 Ca 0.23 1.10 0.00 0.00 1.01 0.00 0.00 58.87 61.21 3keb n SER 131 Cb 0.96 -1.16 0.00 0.00 -1.01 0.00 0.00 64.21 63.00 3keb n SER 131 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3keb n GLY 132 N 3.40 2.09 3.86 0.23 0.00 0.27 -4.96 105.19 110.09 3keb n GLY 132 Ca 0.23 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.94 3keb n GLY 132 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3keb s TYR 133 N -2.71 3.56 -0.28 1.61 1.51 -0.30 -4.87 117.35 115.87 3keb s TYR 133 Ca 0.00 1.30 -0.28 0.00 -1.01 0.00 0.00 57.07 57.08 3keb s TYR 133 Cb 0.00 -2.69 0.01 0.00 -0.11 0.00 0.00 41.96 39.17 3keb s TYR 133 CO 0.00 -0.52 1.01 0.95 -1.11 0.00 0.00 175.55 175.88 3keb s THR 134 N -2.92 4.63 0.37 -0.71 -4.23 -1.26 -3.15 115.64 108.36 3keb s THR 134 Ca 0.55 1.76 -0.28 0.00 -1.18 0.00 0.00 61.69 62.55 3keb s THR 134 Cb -0.11 -4.32 -0.10 0.00 1.34 0.00 0.00 72.50 69.31 3keb s THR 134 CO 0.45 -0.32 1.33 -0.55 -0.54 0.00 0.00 174.62 174.99 3keb s SER 135 N 1.47 6.54 0.13 3.99 0.15 0.01 -4.02 113.70 121.97 3keb s SER 135 Ca 0.43 2.72 -0.31 0.00 0.70 0.00 0.00 55.95 59.49 3keb s SER 135 Cb -0.14 -2.65 -0.08 0.00 -1.71 0.00 0.00 66.02 61.45 3keb s SER 135 CO 0.11 -0.70 1.37 -2.16 1.20 0.00 0.00 173.24 173.06 3keb s PRO 136 N -2.00 4.34 0.18 5.44 0.04 -1.26 -4.73 135.00 137.00 3keb s PRO 136 Ca 0.52 2.06 -0.23 0.00 0.04 0.00 0.00 61.00 63.40 3keb s PRO 136 Cb -0.40 -3.24 0.06 0.00 0.04 0.00 0.00 34.50 30.96 3keb s PRO 136 CO 0.53 -0.39 0.63 0.00 0.04 0.00 0.00 177.00 177.80 3keb s ALA 137 N 0.90 -1.54 -0.02 8.56 0.00 -0.91 -1.60 121.76 127.15 3keb s ALA 137 Ca 0.63 0.35 0.02 0.00 0.00 0.00 0.00 51.96 52.96 3keb s ALA 137 Cb -0.36 0.88 0.00 0.00 0.00 0.00 0.00 23.12 23.63 3keb s ALA 137 CO 0.32 -0.82 -0.08 -1.50 0.00 0.00 0.00 175.76 173.68 3keb s ILE 138 N -3.77 0.71 -0.08 0.00 2.07 -0.04 -1.53 121.20 118.55 3keb s ILE 138 Ca 0.03 -0.33 -0.00 0.00 -1.41 0.00 0.00 60.65 58.94 3keb s ILE 138 Cb -0.02 -0.63 0.02 0.00 0.13 0.00 0.00 42.46 41.97 3keb s ILE 138 CO -0.09 0.22 -0.05 -0.63 -1.91 0.00 0.00 174.94 172.47 3keb s ILE 139 N 0.13 0.75 -0.24 2.00 1.01 0.49 -1.22 121.20 124.13 3keb s ILE 139 Ca -0.02 -0.16 -0.13 0.00 0.00 0.00 0.00 60.65 60.34 3keb s ILE 139 Cb -0.07 -0.80 -0.04 0.00 0.01 0.00 0.00 42.46 41.56 3keb s ILE 139 CO 0.00 0.31 0.28 -0.22 0.00 0.00 0.00 174.94 175.30 3keb s LEU 140 N 1.47 4.10 0.03 2.97 2.96 0.02 -0.22 118.68 130.02 3keb s LEU 140 Ca -0.01 0.26 0.04 0.00 -0.22 0.00 0.00 54.13 54.20 3keb s LEU 140 Cb -0.13 -2.29 -0.02 0.00 0.50 0.00 0.00 46.19 44.25 3keb s LEU 140 CO -0.04 -0.04 -0.12 0.00 -1.32 0.00 0.00 176.35 174.84 3keb s ALA 141 N 1.38 0.99 0.98 5.97 0.00 -0.00 -0.09 121.76 130.99 3keb s ALA 141 Ca 0.12 -0.70 -0.07 0.00 0.00 0.00 0.00 51.96 51.31 3keb s ALA 141 Cb -0.15 -0.16 0.10 0.00 0.00 0.00 0.00 23.12 22.92 3keb s ALA 141 CO 0.07 0.18 0.60 -0.40 0.00 0.00 0.00 175.76 176.21 3keb n ASP 142 N 2.10 0.07 0.23 0.00 5.68 -0.55 -0.17 116.55 123.90 3keb n ASP 142 Ca -0.17 -1.23 0.15 0.00 -0.50 0.00 0.00 54.79 53.04 3keb n ASP 142 Cb 0.55 -0.46 0.59 0.00 -1.14 0.00 0.00 41.12 40.66 3keb n ASP 142 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3keb h ALA 143 N -1.85 1.00 -0.06 2.12 0.00 -1.91 -0.30 119.26 118.25 3keb h ALA 143 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.72 3keb h ALA 143 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.33 3keb h ALA 143 CO 0.14 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.39 3keb n ALA 144 N -2.00 2.57 -2.01 0.00 0.00 -1.26 -4.43 120.51 113.39 3keb n ALA 144 Ca 0.01 -0.27 -0.15 0.00 0.00 0.00 0.00 53.44 53.04 3keb n ALA 144 Cb 0.31 -1.21 -0.03 0.00 0.00 0.00 0.00 19.45 18.52 3keb n ALA 144 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3keb n ASN 145 N -0.37 -4.69 -4.77 0.00 3.02 -0.12 -4.89 115.26 103.44 3keb n ASN 145 Ca 0.14 0.11 -0.38 0.00 -0.03 0.00 0.00 54.58 54.43 3keb n ASN 145 Cb 0.16 -3.73 -0.06 0.00 -0.61 0.00 0.00 39.78 35.55 3keb n ASN 145 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3keb s VAL 146 N -2.70 4.99 -0.01 2.41 1.01 -1.26 -0.81 120.40 124.04 3keb s VAL 146 Ca 0.00 1.08 -0.30 0.00 0.00 0.00 0.00 61.98 62.76 3keb s VAL 146 Cb 0.00 -3.85 -0.04 0.00 0.00 0.00 0.00 36.38 32.49 3keb s VAL 146 CO 0.00 0.44 1.11 -0.69 0.00 0.00 0.00 175.10 175.97 3keb s VAL 147 N -0.26 4.42 -0.08 2.92 1.01 0.85 -1.48 120.40 127.78 3keb s VAL 147 Ca 0.28 1.73 0.18 0.00 0.00 0.00 0.00 61.98 64.17 3keb s VAL 147 Cb -0.17 -4.11 -0.27 0.00 0.00 0.00 0.00 36.38 31.82 3keb s VAL 147 CO 0.15 0.08 0.31 1.41 0.00 0.00 0.00 175.10 177.05 3keb n HIS 148 N 4.40 0.00 -3.63 5.22 8.25 0.87 -0.72 115.22 129.60 3keb n HIS 148 Ca 0.09 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.41 3keb n HIS 148 Cb 0.48 -0.58 -0.07 0.00 1.12 0.00 0.00 29.99 30.93 3keb n HIS 148 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 3keb s TYR 149 N -3.05 -0.80 0.01 4.41 5.04 -1.17 -4.83 117.35 116.97 3keb s TYR 149 Ca -0.08 1.91 -0.10 0.00 -2.44 0.00 0.00 57.07 56.37 3keb s TYR 149 Cb 0.10 0.29 0.01 0.00 0.35 0.00 0.00 41.96 42.71 3keb s TYR 149 CO 0.78 -0.39 0.21 -1.54 -1.34 0.00 0.00 175.55 173.27 3keb s SER 150 N 0.47 -0.04 -0.28 4.32 1.04 -1.26 -0.80 113.70 117.16 3keb s SER 150 Ca -0.01 -0.16 -0.18 0.00 0.48 0.00 0.00 55.95 56.08 3keb s SER 150 Cb -0.05 0.26 0.08 0.00 0.10 0.00 0.00 66.02 66.41 3keb s SER 150 CO -0.01 -0.45 0.72 -0.70 0.98 0.00 0.00 173.24 173.78 3keb s GLU 151 N -1.69 0.71 -0.17 4.02 2.12 -0.36 -5.00 118.70 118.33 3keb s GLU 151 Ca -0.12 1.15 -0.11 0.00 0.36 0.00 0.00 54.97 56.25 3keb s GLU 151 Cb -0.05 0.19 -0.05 0.00 0.26 0.00 0.00 34.13 34.48 3keb s GLU 151 CO 0.01 -0.14 0.18 1.03 -0.54 0.00 0.00 175.26 175.81 3keb s ARG 152 N 1.38 4.12 0.28 4.30 0.52 -1.26 -0.86 118.95 127.42 3keb s ARG 152 Ca -0.08 -0.11 -0.29 0.00 -0.52 0.00 0.00 55.73 54.73 3keb s ARG 152 Cb -0.05 -3.39 -0.10 0.00 0.52 0.00 0.00 34.95 31.93 3keb s ARG 152 CO -0.16 0.35 1.36 -0.51 0.02 0.00 0.00 175.30 176.36 3keb s LEU 153 N 0.20 4.41 0.19 2.53 1.43 -0.63 -4.93 118.68 121.87 3keb s LEU 153 Ca 0.12 2.64 0.25 0.00 -1.03 0.00 0.00 54.13 56.10 3keb s LEU 153 Cb -0.12 -3.63 0.49 0.00 0.03 0.00 0.00 46.19 42.96 3keb s LEU 153 CO 0.01 -0.60 1.50 0.00 0.23 0.00 0.00 176.35 177.48 3keb h ALA 154 N 4.28 0.77 -3.12 4.21 0.00 -1.90 -3.44 119.26 120.04 3keb h ALA 154 Ca -0.47 0.00 -0.22 0.00 0.00 0.00 0.00 54.91 54.22 3keb h ALA 154 Cb 1.22 0.00 -0.31 0.00 0.00 0.00 0.00 17.79 18.70 3keb h ALA 154 CO 0.72 0.00 -0.54 1.21 0.00 0.00 0.00 179.25 180.64 3keb s ASN 155 N -4.60 -0.17 0.54 0.00 3.84 -1.26 -0.43 114.94 112.86 3keb s ASN 155 Ca 0.07 0.42 0.36 0.00 0.21 0.00 0.00 52.86 53.93 3keb s ASN 155 Cb 0.12 0.31 1.90 0.00 -0.55 0.00 0.00 41.25 43.03 3keb s ASN 155 CO 0.68 -0.16 2.10 0.71 -2.79 0.00 0.00 177.10 177.64 3keb h THR 156 N 5.97 0.00 0.00 -5.21 1.35 -1.10 -1.07 112.91 112.86 3keb h THR 156 Ca -0.41 -0.07 0.00 0.00 -0.55 0.00 0.00 66.41 65.38 3keb h THR 156 Cb 1.15 0.91 0.00 0.00 -1.73 0.00 0.00 68.15 68.48 3keb h THR 156 CO 0.39 0.00 -0.35 0.54 -0.25 0.00 0.00 175.52 175.85 3keb n ARG 157 N -2.81 0.10 -1.53 4.72 1.74 -1.26 -1.50 116.66 116.12 3keb n ARG 157 Ca -0.02 0.04 -0.30 0.00 -0.77 0.00 0.00 57.85 56.81 3keb n ARG 157 Cb 0.09 -1.58 0.09 0.00 -1.02 0.00 0.00 32.46 30.05 3keb n ARG 157 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3keb s ASP 158 N -3.47 4.50 0.18 0.55 1.01 -0.41 -4.94 116.67 114.09 3keb s ASP 158 Ca 0.10 1.35 0.04 0.00 0.71 0.00 0.00 52.55 54.75 3keb s ASP 158 Cb 0.16 -2.09 -0.03 0.00 1.01 0.00 0.00 42.92 41.97 3keb s ASP 158 CO 0.65 -1.97 0.27 -0.36 0.21 0.00 0.00 175.17 173.98 3keb s PHE 159 N -3.13 3.40 0.95 4.23 0.08 -1.26 -4.87 117.98 117.37 3keb s PHE 159 Ca 0.61 0.05 -0.11 0.00 0.12 0.00 0.00 56.93 57.60 3keb s PHE 159 Cb -0.15 -1.60 0.16 0.00 -0.57 0.00 0.00 43.02 40.87 3keb s PHE 159 CO 0.54 0.50 1.12 -0.06 -0.10 0.00 0.00 175.22 177.22 3keb s PHE 160 N -1.82 1.65 -1.28 0.36 0.08 -1.26 -4.89 117.98 110.83 3keb s PHE 160 Ca 0.34 1.66 -0.13 0.00 0.12 0.00 0.00 56.93 58.91 3keb s PHE 160 Cb -0.10 -3.27 0.14 0.00 -0.57 0.00 0.00 43.02 39.21 3keb s PHE 160 CO 0.28 -2.93 1.71 -3.47 -0.10 0.00 0.00 175.22 170.71 3keb n ASP 161 N -4.31 4.98 -0.21 1.36 -0.08 -1.26 -4.76 116.55 112.28 3keb n ASP 161 Ca 0.10 -2.99 -0.00 0.00 -1.51 0.00 0.00 54.79 50.39 3keb n ASP 161 Cb 0.53 -1.59 0.23 0.00 2.34 0.00 0.00 41.12 42.63 3keb n ASP 161 CO 0.00 0.00 0.00 -0.26 0.12 0.00 0.00 177.20 177.06 3keb h PHE 162 N 6.68 0.96 -0.91 -0.67 0.04 -1.99 -1.79 116.94 119.26 3keb h PHE 162 Ca 0.39 0.00 0.11 0.00 2.80 0.00 0.00 57.97 61.28 3keb h PHE 162 Cb 0.78 -0.32 -0.08 0.00 2.20 0.00 0.00 35.95 38.53 3keb h PHE 162 CO 1.24 0.63 0.54 -0.44 -0.60 0.00 0.00 178.31 179.68 3keb h ASP 163 N 1.01 0.77 -0.55 2.17 3.32 -1.99 0.27 116.42 121.41 3keb h ASP 163 Ca 0.27 0.05 -0.05 0.00 0.02 0.00 0.00 57.03 57.32 3keb h ASP 163 Cb -0.05 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.38 3keb h ASP 163 CO -0.05 0.41 0.14 0.00 -1.72 0.00 0.00 179.24 178.02 3keb h ALA 164 N 1.50 0.72 -0.16 3.45 0.00 -1.74 -1.89 119.26 121.14 3keb h ALA 164 Ca 0.45 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 3keb h ALA 164 Cb 0.45 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 3keb h ALA 164 CO -0.27 0.42 0.05 0.82 0.00 0.00 0.00 179.25 180.27 3keb h ILE 165 N 0.77 1.17 -0.60 0.00 2.04 -0.94 -2.63 117.51 117.33 3keb h ILE 165 Ca 0.17 -0.53 0.11 0.00 1.00 0.00 0.00 64.86 65.61 3keb h ILE 165 Cb 0.33 1.24 -0.09 0.00 -0.74 0.00 0.00 36.82 37.56 3keb h ILE 165 CO 0.00 0.16 0.12 -0.08 0.00 0.00 0.00 178.15 178.35 3keb h GLU 166 N 0.08 0.24 -0.69 2.37 4.57 -0.40 -1.25 114.58 119.50 3keb h GLU 166 Ca 0.05 -0.01 0.01 0.00 -1.18 0.00 0.00 59.36 58.22 3keb h GLU 166 Cb 0.21 -0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 28.71 3keb h GLU 166 CO -0.00 0.16 0.46 -0.22 -1.18 0.00 0.00 179.01 178.22 3keb h LYS 167 N 0.24 0.91 -0.63 1.92 3.64 -1.21 0.90 116.57 122.35 3keb h LYS 167 Ca 0.31 -0.06 -0.07 0.00 -1.27 0.00 0.00 60.65 59.57 3keb h LYS 167 Cb 0.47 -0.21 -0.03 0.00 -0.41 0.00 0.00 32.23 32.06 3keb h LYS 167 CO -0.41 0.61 0.13 -0.07 -2.27 0.00 0.00 179.45 177.43 3keb h LEU 168 N 0.94 0.98 -0.39 5.20 3.38 -1.02 -0.61 115.31 123.79 3keb h LEU 168 Ca 0.25 -0.25 -0.11 0.00 0.09 0.00 0.00 57.88 57.87 3keb h LEU 168 Cb -0.11 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.37 3keb h LEU 168 CO -0.05 0.98 -0.19 -0.07 0.09 0.00 0.00 178.44 179.19 3keb h LEU 169 N 0.94 0.85 -0.85 1.67 3.38 -0.84 -1.41 115.31 119.06 3keb h LEU 169 Ca 0.19 -0.41 -0.06 0.00 0.09 0.00 0.00 57.88 57.70 3keb h LEU 169 Cb 0.40 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.88 3keb h LEU 169 CO 0.01 1.07 0.16 1.56 0.09 0.00 0.00 178.44 181.32 3keb h GLN 170 N 0.63 1.02 -0.17 1.13 1.08 -0.71 -0.69 115.11 117.40 3keb h GLN 170 Ca 0.09 -0.23 0.01 0.00 -1.45 0.00 0.00 58.65 57.07 3keb h GLN 170 Cb 0.75 -0.14 -0.01 0.00 -0.05 0.00 0.00 27.48 28.02 3keb h GLN 170 CO 0.06 0.90 0.09 1.49 -0.95 0.00 0.00 178.83 180.42 3keb h GLU 171 N 0.97 0.18 0.06 1.46 4.81 -0.95 0.29 114.58 121.40 3keb h GLU 171 Ca 0.21 -0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.43 3keb h GLU 171 Cb 0.34 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.67 3keb h GLU 171 CO 0.00 0.12 -0.09 0.78 -0.73 0.00 0.00 179.01 179.10 3keb h GLY 172 N 0.19 -0.15 0.56 1.92 0.00 -1.09 -1.89 103.07 102.61 3keb h GLY 172 Ca 0.07 0.10 0.05 0.00 0.00 0.00 0.00 47.33 47.55 3keb h GLY 172 CO -0.04 -0.09 0.02 -2.09 0.00 0.00 0.00 176.54 174.34 3keb h GLU 173 N -0.18 0.12 0.00 4.80 4.81 -0.93 -1.73 114.58 121.47 3keb h GLU 173 Ca 0.01 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3keb h GLU 173 Cb 0.19 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.54 3keb h GLU 173 CO -0.04 0.08 -0.01 -0.56 -0.73 0.00 0.00 179.01 177.75 3keb h GLN 174 N 0.12 0.00 0.38 1.92 3.07 -0.84 -2.92 115.11 116.84 3keb h GLN 174 Ca 0.15 0.00 -0.02 0.00 0.09 0.00 0.00 58.65 58.87 3keb h GLN 174 Cb 0.19 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.75 3keb h GLN 174 CO -0.23 0.01 -0.18 1.96 0.09 0.00 0.00 178.83 180.47 3keb h GLN 175 N 0.00 -0.50 0.00 0.06 4.20 -0.73 -3.51 115.11 114.63 3keb h GLN 175 Ca -0.00 0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.74 3keb h GLN 175 Cb 0.52 0.11 0.00 0.00 0.30 0.00 0.00 27.48 28.41 3keb h GLN 175 CO 0.00 -0.33 0.00 0.00 -0.67 0.00 0.00 178.83 177.83