#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 0.46 -3.58 1.62 8.00 -1.26 -4.99 116.55 116.80 3keb n ASP 3 Ca 0.00 -0.22 -0.13 0.00 0.71 0.00 0.00 54.79 55.15 3keb n ASP 3 Cb 0.00 1.28 -0.06 0.00 -0.02 0.00 0.00 41.12 42.32 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 -3.31 -0.56 0.06 1.24 5.36 -1.26 -5.06 117.98 114.44 3keb s PHE 4 Ca -0.01 1.14 0.05 0.00 -0.96 0.00 0.00 56.93 57.15 3keb s PHE 4 Cb 0.14 0.39 -0.03 0.00 -0.34 0.00 0.00 43.02 43.18 3keb s PHE 4 CO 0.86 -0.42 -0.13 -1.58 -1.46 0.00 0.00 175.22 172.49 3keb s TRP 5 N -0.60 1.13 -0.07 10.12 0.52 -1.26 -1.16 118.94 127.62 3keb s TRP 5 Ca -0.04 -0.43 0.04 0.00 0.02 0.00 0.00 56.10 55.70 3keb s TRP 5 Cb -0.02 -0.65 -0.00 0.00 -1.15 0.00 0.00 33.47 31.65 3keb s TRP 5 CO 0.03 0.03 -0.21 0.54 0.02 0.00 0.00 176.95 177.36 3keb s VAL 6 N -1.16 1.77 -0.24 4.03 0.11 0.16 -4.62 120.40 120.45 3keb s VAL 6 Ca -0.02 -0.88 -0.18 0.00 -2.93 0.00 0.00 61.98 57.97 3keb s VAL 6 Cb -0.09 -1.53 -0.03 0.00 -1.53 0.00 0.00 36.38 33.20 3keb s VAL 6 CO 0.02 0.50 0.52 -1.58 -3.33 0.00 0.00 175.10 171.22 3keb s GLN 7 N 0.20 4.11 -0.37 1.54 2.00 0.52 -0.81 119.66 126.85 3keb s GLN 7 Ca -0.11 0.35 0.03 0.00 -2.00 0.00 0.00 55.36 53.63 3keb s GLN 7 Cb -0.15 -3.62 0.10 0.00 0.80 0.00 0.00 33.01 30.14 3keb s GLN 7 CO 0.05 -0.29 0.09 -0.47 -0.50 0.00 0.00 175.29 174.17 3keb s TYR 8 N 2.10 3.70 0.00 1.67 5.04 0.63 -0.53 117.35 129.96 3keb s TYR 8 Ca 0.22 -2.96 0.00 0.00 -2.44 0.00 0.00 57.07 51.89 3keb s TYR 8 Cb -0.16 -2.96 0.00 0.00 0.35 0.00 0.00 41.96 39.20 3keb s TYR 8 CO 0.09 -0.93 0.00 0.41 -1.34 0.00 0.00 175.55 173.78 3keb n GLY 9 N 4.18 3.68 0.36 8.97 0.00 -1.26 -1.09 105.19 120.04 3keb n GLY 9 Ca 0.03 0.11 0.14 0.00 0.00 0.00 0.00 46.02 46.30 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 6.14 1.13 -1.26 1.61 2.03 -1.26 -5.08 116.55 119.86 3keb n ASP 10 Ca 0.00 -1.41 0.00 0.00 0.52 0.00 0.00 54.79 53.90 3keb n ASP 10 Cb 0.00 -0.01 0.00 0.00 -0.72 0.00 0.00 41.12 40.39 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 -0.11 1.73 0.00 -0.67 -0.58 -0.25 -5.15 120.64 115.61 3keb n GLU 11 Ca 0.20 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.94 3keb n GLU 11 Cb 0.29 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.16 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 0.01 -0.27 117.00 112.13 3keb n LEU 13 Ca 0.00 0.00 -0.40 0.00 -0.03 0.00 0.00 56.01 55.58 3keb n LEU 13 Cb 0.00 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.10 3keb n LEU 13 CO 0.00 0.00 1.05 -2.84 -1.33 0.00 0.00 177.39 174.27 3keb s PRO 14 N -0.63 3.82 -0.12 3.23 0.02 -1.26 -0.66 135.00 139.38 3keb s PRO 14 Ca 0.00 2.38 0.02 0.00 0.02 0.00 0.00 61.00 63.42 3keb s PRO 14 Cb 0.00 -2.73 -0.01 0.00 0.02 0.00 0.00 34.50 31.79 3keb s PRO 14 CO 0.00 -0.70 -0.18 0.08 -0.33 0.00 0.00 177.00 175.87 3keb s VAL 15 N -1.20 2.56 -0.04 3.83 1.01 -0.31 -4.44 120.40 121.82 3keb s VAL 15 Ca 0.59 -0.83 0.05 0.00 0.00 0.00 0.00 61.98 61.79 3keb s VAL 15 Cb -0.43 -2.04 -0.02 0.00 0.00 0.00 0.00 36.38 33.88 3keb s VAL 15 CO 0.56 0.54 -0.19 -0.63 0.00 0.00 0.00 175.10 175.38 3keb s ILE 16 N 0.47 2.68 0.00 2.22 1.01 0.13 -4.22 121.20 123.49 3keb s ILE 16 Ca -0.12 -0.87 0.00 0.00 0.00 0.00 0.00 60.65 59.66 3keb s ILE 16 Cb -0.17 -2.01 0.00 0.00 0.01 0.00 0.00 42.46 40.29 3keb s ILE 16 CO 0.05 0.59 0.00 0.61 0.00 0.00 0.00 174.94 176.19 3keb n GLY 17 N 2.38 -0.38 3.36 6.18 0.00 -1.26 -2.59 105.19 112.88 3keb n GLY 17 Ca -0.17 -2.28 -0.42 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 -0.41 5.94 0.01 1.61 1.01 -1.22 -4.54 116.67 119.07 3keb s ASP 18 Ca 0.00 -1.27 -0.30 0.00 0.71 0.00 0.00 52.55 51.69 3keb s ASP 18 Cb 0.00 -2.10 -0.04 0.00 1.01 0.00 0.00 42.92 41.79 3keb s ASP 18 CO 0.00 -0.55 1.12 0.12 0.21 0.00 0.00 175.17 176.06 3keb s PHE 19 N 1.57 3.47 0.36 4.23 5.36 -1.26 -3.52 117.98 128.19 3keb s PHE 19 Ca 0.04 1.43 -0.28 0.00 -0.96 0.00 0.00 56.93 57.15 3keb s PHE 19 Cb -0.22 -3.31 -0.11 0.00 -0.34 0.00 0.00 43.02 39.04 3keb s PHE 19 CO 0.06 -0.80 1.51 -2.30 -1.46 0.00 0.00 175.22 172.23 3keb n PRO 20 N 4.22 2.69 -4.28 10.12 -0.02 -1.26 -4.99 135.00 141.48 3keb n PRO 20 Ca 0.08 0.95 -0.24 0.00 -2.02 0.00 0.00 63.50 62.27 3keb n PRO 20 Cb 0.48 -2.69 -0.08 0.00 -0.02 0.00 0.00 33.50 31.19 3keb n PRO 20 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 3keb s ARG 21 N -1.77 2.20 0.07 -0.52 1.81 -1.26 -4.75 118.95 114.72 3keb s ARG 21 Ca 0.55 -1.58 -0.36 0.00 -1.72 0.00 0.00 55.73 52.62 3keb s ARG 21 Cb -0.48 -2.06 -0.18 0.00 -0.45 0.00 0.00 34.95 31.78 3keb s ARG 21 CO 0.61 0.23 1.04 1.17 -0.68 0.00 0.00 175.30 177.67 3keb n LYS 22 N -0.95 0.37 0.00 3.54 4.81 -1.26 -1.01 118.16 123.66 3keb n LYS 22 Ca -0.05 0.13 0.00 0.00 -0.87 0.00 0.00 58.31 57.53 3keb n LYS 22 Cb 0.61 -1.58 0.00 0.00 0.02 0.00 0.00 35.03 34.08 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 1.82 2.86 3.77 3.14 0.00 0.27 -4.99 105.19 112.08 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 -1.51 5.96 0.21 1.61 1.01 -0.18 -4.75 116.67 119.02 3keb s ASP 24 Ca 0.00 2.26 -0.30 0.00 0.71 0.00 0.00 52.55 55.22 3keb s ASP 24 Cb 0.00 -2.59 -0.08 0.00 1.01 0.00 0.00 42.92 41.25 3keb s ASP 24 CO 0.00 -1.06 0.94 -0.31 0.21 0.00 0.00 175.17 174.96 3keb s TYR 25 N -1.63 3.94 0.18 4.23 2.02 -1.26 -0.25 117.35 124.58 3keb s TYR 25 Ca 0.68 1.89 -0.33 0.00 -0.37 0.00 0.00 57.07 58.94 3keb s TYR 25 Cb -0.27 -3.00 -0.15 0.00 -0.40 0.00 0.00 41.96 38.14 3keb s TYR 25 CO 0.32 0.40 1.22 1.28 -1.57 0.00 0.00 175.55 177.20 3keb n LEU 26 N 1.82 1.86 -4.76 -1.29 4.77 0.28 -4.92 117.00 114.75 3keb n LEU 26 Ca -0.01 1.14 -0.36 0.00 -0.03 0.00 0.00 56.01 56.75 3keb n LEU 26 Cb 0.48 -1.26 0.02 0.00 -2.33 0.00 0.00 43.42 40.32 3keb n LEU 26 CO 0.50 -1.12 0.83 -2.84 -1.33 0.00 0.00 177.39 173.43 3keb s PRO 27 N -0.33 3.22 0.67 3.23 0.02 -1.26 -4.97 135.00 135.57 3keb s PRO 27 Ca 0.73 1.77 -0.17 0.00 0.02 0.00 0.00 61.00 63.35 3keb s PRO 27 Cb -0.81 -2.04 0.00 0.00 0.02 0.00 0.00 34.50 31.67 3keb s PRO 27 CO 0.51 -1.00 1.24 -1.54 -0.33 0.00 0.00 177.00 175.89 3keb s SER 28 N -1.58 4.58 0.00 2.53 1.04 -1.26 -4.97 113.70 114.04 3keb s SER 28 Ca 0.74 2.47 0.00 0.00 0.48 0.00 0.00 55.95 59.64 3keb s SER 28 Cb -0.29 -2.60 0.00 0.00 0.10 0.00 0.00 66.02 63.23 3keb s SER 28 CO 0.32 -2.01 0.00 2.22 0.98 0.00 0.00 173.24 174.75 3keb n PHE 29 N -2.14 0.00 -1.29 5.02 1.16 -1.26 -5.01 117.46 113.94 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 -3.95 5.98 4.77 0.11 -3.96 117.00 119.95 3keb n LEU 31 Ca 0.00 0.00 -0.22 0.00 -0.03 0.00 0.00 56.01 55.76 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 -0.43 -0.69 -1.33 0.00 0.00 177.39 174.94 3keb s VAL 32 N -2.32 0.78 0.81 4.08 1.01 -1.03 -0.77 120.40 122.94 3keb s VAL 32 Ca 0.00 -0.28 -0.07 0.00 0.00 0.00 0.00 61.98 61.63 3keb s VAL 32 Cb 0.00 -0.74 0.14 0.00 0.00 0.00 0.00 36.38 35.78 3keb s VAL 32 CO 0.00 0.27 1.12 1.51 0.00 0.00 0.00 175.10 178.00 3keb s ASP 33 N 0.73 3.98 0.13 3.32 1.47 -0.15 -0.27 116.67 125.87 3keb s ASP 33 Ca -0.12 0.02 0.15 0.00 1.18 0.00 0.00 52.55 53.78 3keb s ASP 33 Cb -0.14 -0.33 0.69 0.00 -0.34 0.00 0.00 42.92 42.81 3keb s ASP 33 CO 0.02 -2.13 1.48 -0.90 0.68 0.00 0.00 175.17 174.31 3keb n ASP 34 N -3.19 0.29 -1.62 2.11 5.75 -0.85 -0.62 116.55 118.42 3keb n ASP 34 Ca 0.14 0.59 0.09 0.00 -0.01 0.00 0.00 54.79 55.59 3keb n ASP 34 Cb 0.60 -0.65 0.36 0.00 -1.03 0.00 0.00 41.12 40.41 3keb n ASP 34 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3keb n GLN 35 N -1.84 4.05 -1.08 0.11 1.13 -1.26 -4.29 117.38 114.20 3keb n GLN 35 Ca 0.02 -2.96 -0.03 0.00 -1.94 0.00 0.00 57.00 52.09 3keb n GLN 35 Cb 0.13 -2.00 -0.01 0.00 0.11 0.00 0.00 30.24 28.47 3keb n GLN 35 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 3keb n LYS 36 N 0.83 -0.35 -3.46 -1.09 5.02 0.21 -5.03 118.16 114.29 3keb n LYS 36 Ca 0.26 0.44 -0.36 0.00 -2.02 0.00 0.00 58.31 56.62 3keb n LYS 36 Cb 0.98 -3.98 -0.06 0.00 -0.02 0.00 0.00 35.03 31.96 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 -2.02 3.66 0.38 2.13 3.76 -1.26 -4.80 115.29 117.14 3keb s HIS 37 Ca 0.00 0.98 -0.27 0.00 -0.15 0.00 0.00 55.06 55.62 3keb s HIS 37 Cb 0.00 -2.30 -0.11 0.00 1.11 0.00 0.00 32.58 31.29 3keb s HIS 37 CO 0.00 0.53 1.39 -0.25 -0.85 0.00 0.00 174.74 175.56 3keb n ASP 38 N 1.22 3.23 -3.80 1.40 8.00 -1.26 -0.98 116.55 124.36 3keb n ASP 38 Ca -0.09 1.19 -0.24 0.00 0.71 0.00 0.00 54.79 56.36 3keb n ASP 38 Cb 0.52 -1.56 -0.17 0.00 -0.02 0.00 0.00 41.12 39.89 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 -1.13 0.86 0.40 2.24 0.00 0.05 -4.79 121.76 119.39 3keb s ALA 39 Ca 0.56 -0.26 0.07 0.00 0.00 0.00 0.00 51.96 52.33 3keb s ALA 39 Cb -0.51 -0.82 -0.08 0.00 0.00 0.00 0.00 23.12 21.72 3keb s ALA 39 CO 0.62 -0.50 0.00 0.00 0.00 0.00 0.00 175.76 175.88 3keb s ALA 40 N 1.91 3.16 0.28 0.00 0.00 -1.26 -0.71 121.76 125.14 3keb s ALA 40 Ca 0.05 -2.29 0.02 0.00 0.00 0.00 0.00 51.96 49.74 3keb s ALA 40 Cb -0.13 0.15 0.63 0.00 0.00 0.00 0.00 23.12 23.77 3keb s ALA 40 CO -0.06 -0.10 1.78 -0.07 0.00 0.00 0.00 175.76 177.31 3keb h LEU 41 N 1.79 0.73 -0.07 0.00 3.38 -1.94 0.09 115.31 119.29 3keb h LEU 41 Ca -0.44 0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.62 3keb h LEU 41 Cb 1.24 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.95 3keb h LEU 41 CO 0.80 0.30 0.00 -0.62 0.09 0.00 0.00 178.44 179.01 3keb n GLU 42 N -4.77 0.02 0.22 1.13 4.71 -1.26 -0.98 120.64 119.70 3keb n GLU 42 Ca 0.20 0.28 0.15 0.00 -0.01 0.00 0.00 57.16 57.79 3keb n GLU 42 Cb 0.48 -1.53 0.72 0.00 -1.01 0.00 0.00 31.44 30.10 3keb n GLU 42 CO 0.00 0.00 0.00 0.77 0.09 0.00 0.00 177.13 177.99 3keb h SER 43 N 0.00 0.00 -2.26 1.62 0.02 -1.36 -3.29 113.55 108.29 3keb h SER 43 Ca 0.00 0.00 -0.60 0.00 -0.84 0.00 0.00 61.79 60.35 3keb h SER 43 Cb 0.24 0.00 -0.41 0.00 0.14 0.00 0.00 62.40 62.37 3keb h SER 43 CO 0.00 0.00 -0.54 0.49 -1.14 0.00 0.00 176.83 175.64 3keb n PHE 44 N -2.63 3.82 -2.94 3.45 3.72 -0.15 -5.01 117.46 117.72 3keb n PHE 44 Ca -0.00 -4.00 -0.32 0.00 -0.05 0.00 0.00 57.45 53.07 3keb n PHE 44 Cb 0.17 -0.55 -0.06 0.00 -0.94 0.00 0.00 39.48 38.10 3keb n PHE 44 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 3keb s SER 45 N -2.96 6.76 -1.43 4.37 1.04 -1.24 -4.12 113.70 116.11 3keb s SER 45 Ca 0.44 1.38 -0.08 0.00 0.48 0.00 0.00 55.95 58.18 3keb s SER 45 Cb 0.22 -2.42 0.01 0.00 0.10 0.00 0.00 66.02 63.93 3keb s SER 45 CO -0.08 -0.31 1.00 1.41 0.98 0.00 0.00 173.24 176.24 3keb n HIS 46 N -0.71 -2.60 -3.73 5.02 8.25 -1.26 -4.97 115.22 115.21 3keb n HIS 46 Ca 0.04 0.86 -0.12 0.00 -0.26 0.00 0.00 57.72 58.24 3keb n HIS 46 Cb 0.54 -4.87 -0.11 0.00 1.12 0.00 0.00 29.99 26.67 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 -3.28 -0.01 0.75 1.59 -1.32 -1.26 -5.01 115.64 107.11 3keb s THR 47 Ca 0.50 0.03 -0.12 0.00 -1.21 0.00 0.00 61.69 60.89 3keb s THR 47 Cb -0.22 -0.54 0.05 0.00 -1.51 0.00 0.00 72.50 70.27 3keb s THR 47 CO 0.62 0.01 1.10 -2.16 -2.21 0.00 0.00 174.62 171.98 3keb s PRO 48 N 0.54 2.31 0.00 7.08 0.04 -1.26 -3.86 135.00 139.86 3keb s PRO 48 Ca -0.03 1.26 -0.14 0.00 0.04 0.00 0.00 61.00 62.14 3keb s PRO 48 Cb -0.04 -1.90 0.02 0.00 0.04 0.00 0.00 34.50 32.62 3keb s PRO 48 CO -0.03 -1.61 0.29 -1.59 0.04 0.00 0.00 177.00 174.09 3keb s LYS 49 N -4.67 0.69 -0.28 4.56 0.00 0.17 -1.79 119.74 118.42 3keb s LYS 49 Ca 0.63 -0.31 0.00 0.00 0.00 0.00 0.00 55.97 56.30 3keb s LYS 49 Cb -0.19 0.30 0.05 0.00 0.00 0.00 0.00 37.83 38.00 3keb s LYS 49 CO 0.52 -0.20 -0.05 -1.17 0.00 0.00 0.00 175.35 174.46 3keb s LEU 50 N -1.55 3.69 -0.17 2.77 2.96 0.38 -0.98 118.68 125.77 3keb s LEU 50 Ca -0.11 -1.32 -0.15 0.00 -0.22 0.00 0.00 54.13 52.33 3keb s LEU 50 Cb -0.04 -1.64 -0.04 0.00 0.50 0.00 0.00 46.19 44.97 3keb s LEU 50 CO 0.02 -0.23 0.35 -0.63 -1.32 0.00 0.00 176.35 174.54 3keb s ILE 51 N 1.19 5.26 -0.04 6.68 1.01 0.80 -1.13 121.20 134.96 3keb s ILE 51 Ca -0.07 0.65 0.03 0.00 0.00 0.00 0.00 60.65 61.26 3keb s ILE 51 Cb -0.20 -3.69 0.01 0.00 0.01 0.00 0.00 42.46 38.59 3keb s ILE 51 CO -0.03 0.33 -0.11 0.68 0.00 0.00 0.00 174.94 175.81 3keb s VAL 52 N 0.80 1.01 -0.15 2.92 -7.23 0.10 -0.45 120.40 117.40 3keb s VAL 52 Ca 0.18 -0.46 -0.13 0.00 -1.81 0.00 0.00 61.98 59.77 3keb s VAL 52 Cb -0.14 -0.90 -0.05 0.00 0.56 0.00 0.00 36.38 35.85 3keb s VAL 52 CO 0.06 0.31 0.27 0.42 -0.31 0.00 0.00 175.10 175.86 3keb s THR 53 N 0.35 5.31 0.31 5.32 -4.23 -0.44 -0.64 115.64 121.63 3keb s THR 53 Ca -0.07 0.51 0.11 0.00 -1.18 0.00 0.00 61.69 61.05 3keb s THR 53 Cb -0.12 -3.61 -0.06 0.00 1.34 0.00 0.00 72.50 70.06 3keb s THR 53 CO 0.02 0.42 -0.13 -0.76 -0.54 0.00 0.00 174.62 173.63 3keb s LEU 54 N 0.29 2.71 0.05 4.79 1.43 -1.04 -2.01 118.68 124.89 3keb s LEU 54 Ca 0.16 -1.09 -0.25 0.00 -1.03 0.00 0.00 54.13 51.91 3keb s LEU 54 Cb -0.13 -1.09 -0.17 0.00 0.03 0.00 0.00 46.19 44.83 3keb s LEU 54 CO 0.04 -0.10 1.53 -0.07 0.23 0.00 0.00 176.35 177.98 3keb h LEU 55 N 2.10 -0.12 -7.00 1.79 3.38 -0.95 -3.42 115.31 111.10 3keb h LEU 55 Ca -0.41 -0.15 0.06 0.00 0.09 0.00 0.00 57.88 57.47 3keb h LEU 55 Cb 1.25 0.03 -0.24 0.00 0.09 0.00 0.00 40.66 41.80 3keb h LEU 55 CO 0.65 0.08 0.48 -0.55 0.09 0.00 0.00 178.44 179.19 3keb s SER 56 N -5.23 -0.43 0.32 -0.43 0.15 -1.22 -4.37 113.70 102.50 3keb s SER 56 Ca -0.14 0.61 0.24 0.00 0.70 0.00 0.00 55.95 57.36 3keb s SER 56 Cb 0.04 0.54 1.16 0.00 -1.71 0.00 0.00 66.02 66.06 3keb s SER 56 CO 0.64 -0.29 1.74 -0.37 1.20 0.00 0.00 173.24 176.16 3keb h VAL 57 N 2.98 0.00 -0.60 4.45 -1.51 -1.90 -2.41 116.25 117.26 3keb h VAL 57 Ca -0.23 -0.13 0.00 0.00 -1.23 0.00 0.00 66.70 65.11 3keb h VAL 57 Cb 1.17 0.78 0.00 0.00 -2.13 0.00 0.00 31.29 31.11 3keb h VAL 57 CO 0.24 0.00 0.00 0.47 -1.23 0.00 0.00 177.57 177.05 3keb n ASP 58 N -2.34 3.68 -4.91 4.19 8.00 -1.26 -4.26 116.55 119.65 3keb n ASP 58 Ca 0.00 -1.99 -0.27 0.00 0.71 0.00 0.00 54.79 53.23 3keb n ASP 58 Cb 0.14 -0.40 -0.00 0.00 -0.02 0.00 0.00 41.12 40.84 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 -1.21 3.53 0.00 -1.24 0.41 -0.91 -5.00 118.70 114.29 3keb s GLU 59 Ca 0.45 0.21 0.00 0.00 -0.41 0.00 0.00 54.97 55.22 3keb s GLU 59 Cb 0.24 -2.37 0.00 0.00 -1.78 0.00 0.00 34.13 30.22 3keb s GLU 59 CO 0.32 -0.22 0.00 -0.40 -0.49 0.00 0.00 175.26 174.47 3keb n ASP 60 N -2.28 0.00 0.11 -0.19 5.75 -1.26 -1.19 116.55 117.49 3keb n ASP 60 Ca 0.01 0.00 0.02 0.00 -0.01 0.00 0.00 54.79 54.81 3keb n ASP 60 Cb 0.55 0.00 -0.00 0.00 -1.03 0.00 0.00 41.12 40.64 3keb n ASP 60 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 3keb h GLU 61 N 0.00 0.00 -4.94 0.11 5.08 -1.95 -2.80 114.58 110.08 3keb h GLU 61 Ca 0.00 0.00 -0.69 0.00 -1.00 0.00 0.00 59.36 57.67 3keb h GLU 61 Cb 0.00 0.00 -0.18 0.00 0.50 0.00 0.00 28.75 29.07 3keb h GLU 61 CO 0.00 0.43 0.59 -1.01 -1.00 0.00 0.00 179.01 178.02 3keb s HIS 62 N -2.96 3.07 -0.54 4.33 3.76 -1.26 -4.33 115.29 117.37 3keb s HIS 62 Ca 0.02 -1.22 -0.05 0.00 -0.15 0.00 0.00 55.06 53.67 3keb s HIS 62 Cb 0.08 -4.20 0.01 0.00 1.11 0.00 0.00 32.58 29.58 3keb s HIS 62 CO 0.76 -1.44 0.36 0.00 -0.85 0.00 0.00 174.74 173.57 3keb n ALA 63 N 6.49 -2.04 -2.77 -1.40 0.00 -0.16 -4.62 120.51 116.01 3keb n ALA 63 Ca 0.12 -0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.35 3keb n ALA 63 Cb 0.47 -0.65 0.00 0.00 0.00 0.00 0.00 19.45 19.27 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 -1.28 4.83 0.25 0.00 0.00 -1.25 -0.53 105.19 107.21 3keb n GLY 64 Ca -0.16 -0.61 -0.03 0.00 0.00 0.00 0.00 46.02 45.22 3keb n GLY 64 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3keb h LEU 65 N 0.00 0.50 -0.26 0.99 5.85 -1.14 -0.94 115.31 120.31 3keb h LEU 65 Ca 0.00 -0.15 -0.01 0.00 0.84 0.00 0.00 57.88 58.56 3keb h LEU 65 Cb 0.00 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 40.88 3keb h LEU 65 CO 0.00 0.69 0.11 0.25 -0.34 0.00 0.00 178.44 179.16 3keb h LEU 66 N 0.46 0.36 -0.61 2.25 5.85 -1.75 0.23 115.31 122.11 3keb h LEU 66 Ca 0.08 -0.15 -0.11 0.00 0.84 0.00 0.00 57.88 58.53 3keb h LEU 66 Cb 0.58 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.50 3keb h LEU 66 CO 0.04 0.41 -0.13 0.25 -0.34 0.00 0.00 178.44 178.67 3keb h LEU 67 N 0.28 0.97 -0.37 2.25 5.85 -1.72 -1.66 115.31 120.92 3keb h LEU 67 Ca 0.09 -0.32 0.05 0.00 0.84 0.00 0.00 57.88 58.53 3keb h LEU 67 Cb 0.16 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 40.88 3keb h LEU 67 CO -0.01 1.10 0.12 0.25 -0.34 0.00 0.00 178.44 179.56 3keb h LEU 68 N 0.85 0.11 -0.76 2.25 6.46 -0.83 -1.10 115.31 122.29 3keb h LEU 68 Ca 0.13 0.05 -0.11 0.00 -0.12 0.00 0.00 57.88 57.82 3keb h LEU 68 Cb 0.68 0.04 -0.01 0.00 -0.73 0.00 0.00 40.66 40.64 3keb h LEU 68 CO 0.05 0.10 -0.29 0.03 -0.62 0.00 0.00 178.44 177.71 3keb h ARG 69 N 0.26 0.62 -0.65 1.25 3.08 -0.70 -0.65 114.38 117.59 3keb h ARG 69 Ca 0.17 -0.26 -0.08 0.00 0.07 0.00 0.00 59.98 59.88 3keb h ARG 69 Cb 0.16 -0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.16 3keb h ARG 69 CO -0.19 0.84 0.09 1.49 -1.07 0.00 0.00 179.97 181.13 3keb h GLU 70 N 0.53 1.09 -0.28 0.04 4.57 -1.14 -1.02 114.58 118.38 3keb h GLU 70 Ca 0.07 -0.30 -0.01 0.00 -1.18 0.00 0.00 59.36 57.94 3keb h GLU 70 Cb 0.77 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 29.22 3keb h GLU 70 CO 0.06 1.01 0.13 1.15 -1.18 0.00 0.00 179.01 180.18 3keb h THR 71 N 1.02 1.16 -0.69 0.32 2.02 -0.82 -1.00 112.91 114.92 3keb h THR 71 Ca 0.20 -0.46 -0.05 0.00 0.77 0.00 0.00 66.41 66.87 3keb h THR 71 Cb 0.46 0.94 -0.03 0.00 -1.74 0.00 0.00 68.15 67.78 3keb h THR 71 CO 0.02 0.16 0.25 -0.09 0.37 0.00 0.00 175.52 176.23 3keb h ARG 72 N 0.32 1.04 -0.34 6.66 2.43 -1.00 -1.65 114.38 121.85 3keb h ARG 72 Ca 0.10 -0.19 0.02 0.00 -0.81 0.00 0.00 59.98 59.09 3keb h ARG 72 Cb 0.14 -0.17 -0.03 0.00 -0.42 0.00 0.00 29.97 29.49 3keb h ARG 72 CO -0.01 0.87 0.18 -0.09 -1.51 0.00 0.00 179.97 179.41 3keb h ARG 73 N 1.01 0.36 -0.91 0.20 2.43 -0.97 -2.23 114.38 114.28 3keb h ARG 73 Ca 0.23 -0.02 0.05 0.00 -0.81 0.00 0.00 59.98 59.43 3keb h ARG 73 Cb 0.24 -0.08 -0.06 0.00 -0.42 0.00 0.00 29.97 29.64 3keb h ARG 73 CO -0.01 0.24 0.58 0.35 -1.51 0.00 0.00 179.97 179.61 3keb h PHE 74 N 0.37 1.07 0.00 2.20 3.57 -0.83 -2.44 116.94 120.88 3keb h PHE 74 Ca 0.14 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.67 3keb h PHE 74 Cb 0.03 -0.35 0.00 0.00 2.79 0.00 0.00 35.95 38.42 3keb h PHE 74 CO -0.09 0.57 0.00 -0.07 -2.23 0.00 0.00 178.31 176.49 3keb h LEU 75 N 1.07 0.00 -1.98 0.59 3.38 -0.74 -3.12 115.31 114.52 3keb h LEU 75 Ca 0.38 0.00 0.07 0.00 0.09 0.00 0.00 57.88 58.42 3keb h LEU 75 Cb 0.12 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 3keb h LEU 75 CO -0.16 0.00 0.19 -0.78 0.09 0.00 0.00 178.44 177.78 3keb h ASP 76 N 0.00 0.02 0.27 -0.43 3.58 -0.92 0.56 116.42 119.51 3keb h ASP 76 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 3keb h ASP 76 Cb 0.42 -0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.46 3keb h ASP 76 CO 0.00 0.01 0.00 -1.20 -2.88 0.00 0.00 179.24 175.17 3keb n SER 77 N -4.46 0.00 -3.38 2.28 7.64 -1.18 -4.54 113.62 109.98 3keb n SER 77 Ca 0.03 -0.48 -0.26 0.00 1.01 0.00 0.00 58.87 59.17 3keb n SER 77 Cb 0.33 -0.15 -0.09 0.00 -1.01 0.00 0.00 64.21 63.29 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 -1.15 0.88 0.28 1.43 7.02 0.19 -4.99 117.44 121.10 3keb n TRP 78 Ca 0.17 -3.73 0.16 0.00 -1.02 0.00 0.00 57.50 53.08 3keb n TRP 78 Cb 0.16 -0.29 0.82 0.00 -2.42 0.00 0.00 31.31 29.58 3keb n TRP 78 CO 0.00 0.00 0.00 -1.00 -2.02 0.00 0.00 177.69 174.67 3keb h PRO 79 N 4.59 0.00 -0.00 -0.99 0.13 -1.80 -2.01 132.00 131.92 3keb h PRO 79 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 3keb h PRO 79 Cb 0.82 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.95 3keb h PRO 79 CO 0.56 0.00 -0.24 0.72 -0.23 0.00 0.00 178.00 178.80 3keb n HIS 80 N -2.69 0.00 -3.17 1.56 8.25 -1.26 -4.86 115.22 113.05 3keb n HIS 80 Ca -0.01 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.03 3keb n HIS 80 Cb 0.12 -0.21 -0.07 0.00 1.12 0.00 0.00 29.99 30.95 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 -2.67 4.44 -0.07 2.41 1.43 -0.76 -4.11 118.68 119.35 3keb s LEU 81 Ca 0.21 -0.18 -0.28 0.00 -1.03 0.00 0.00 54.13 52.85 3keb s LEU 81 Cb 0.19 -2.67 -0.02 0.00 0.03 0.00 0.00 46.19 43.72 3keb s LEU 81 CO 0.55 -0.64 0.94 -0.75 0.23 0.00 0.00 176.35 176.68 3keb s LYS 82 N 2.61 4.45 -0.26 1.70 2.20 -0.74 -4.81 119.74 124.90 3keb s LYS 82 Ca 0.21 1.29 -0.22 0.00 -0.36 0.00 0.00 55.97 56.89 3keb s LYS 82 Cb -0.15 -3.51 -0.01 0.00 -1.51 0.00 0.00 37.83 32.65 3keb s LYS 82 CO 0.16 -0.19 0.73 -1.17 -0.36 0.00 0.00 175.35 174.52 3keb s LEU 83 N 1.56 4.07 -0.24 5.43 2.96 -1.26 -0.47 118.68 130.74 3keb s LEU 83 Ca 0.47 0.83 0.02 0.00 -0.22 0.00 0.00 54.13 55.23 3keb s LEU 83 Cb -0.19 -3.02 0.05 0.00 0.50 0.00 0.00 46.19 43.53 3keb s LEU 83 CO 0.21 -0.46 -0.13 -0.63 -1.32 0.00 0.00 176.35 174.02 3keb s ILE 84 N 2.70 2.21 -0.20 6.68 1.01 -0.28 -1.51 121.20 131.81 3keb s ILE 84 Ca 0.30 -1.42 -0.08 0.00 0.00 0.00 0.00 60.65 59.46 3keb s ILE 84 Cb -0.15 -2.20 -0.04 0.00 0.01 0.00 0.00 42.46 40.07 3keb s ILE 84 CO 0.08 0.13 0.09 -0.69 0.00 0.00 0.00 174.94 174.55 3keb s VAL 85 N 1.17 4.97 -0.11 2.92 1.01 0.19 -0.72 120.40 129.83 3keb s VAL 85 Ca -0.05 0.03 0.03 0.00 0.00 0.00 0.00 61.98 62.00 3keb s VAL 85 Cb -0.18 -3.26 0.01 0.00 0.00 0.00 0.00 36.38 32.95 3keb s VAL 85 CO -0.07 0.44 -0.21 -0.63 0.00 0.00 0.00 175.10 174.63 3keb s ILE 86 N 0.50 1.86 0.25 2.22 1.01 0.19 -0.33 121.20 126.90 3keb s ILE 86 Ca 0.05 -0.89 -0.04 0.00 0.00 0.00 0.00 60.65 59.77 3keb s ILE 86 Cb -0.12 -1.63 -0.02 0.00 0.01 0.00 0.00 42.46 40.69 3keb s ILE 86 CO 0.00 0.51 0.30 0.42 0.00 0.00 0.00 174.94 176.18 3keb s THR 87 N 0.59 0.00 -1.88 2.92 -4.23 -0.65 -2.50 115.64 109.88 3keb s THR 87 Ca -0.14 -1.76 0.31 0.00 -1.18 0.00 0.00 61.69 58.92 3keb s THR 87 Cb -0.17 -2.43 0.71 0.00 1.34 0.00 0.00 72.50 71.95 3keb s THR 87 CO 0.04 0.00 2.07 1.33 -0.54 0.00 0.00 174.62 177.52 3keb n VAL 88 N -0.38 0.00 -1.40 2.29 0.24 -1.26 -0.98 118.33 116.83 3keb n VAL 88 Ca 0.01 -0.04 -0.36 0.00 -2.04 0.00 0.00 64.34 61.92 3keb n VAL 88 Cb 0.64 -0.31 0.09 0.00 -1.47 0.00 0.00 33.84 32.79 3keb n VAL 88 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 3keb n ASP 89 N -0.91 0.99 -4.77 -1.34 8.00 -1.26 -4.73 116.55 112.53 3keb n ASP 89 Ca 0.20 0.69 -0.33 0.00 0.71 0.00 0.00 54.79 56.06 3keb n ASP 89 Cb 0.19 -1.46 0.04 0.00 -0.02 0.00 0.00 41.12 39.87 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 -1.66 5.15 0.33 -2.24 1.04 -1.26 -4.48 113.70 110.58 3keb s SER 90 Ca 0.76 2.05 0.07 0.00 0.48 0.00 0.00 55.95 59.30 3keb s SER 90 Cb -0.35 -2.56 0.74 0.00 0.10 0.00 0.00 66.02 63.96 3keb s SER 90 CO 0.48 -1.60 1.83 -0.65 0.98 0.00 0.00 173.24 174.28 3keb h PRO 91 N 0.19 0.76 -0.29 4.02 0.11 -1.89 -0.83 132.00 134.07 3keb h PRO 91 Ca -0.47 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 65.59 3keb h PRO 91 Cb 1.25 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 3keb h PRO 91 CO 0.54 0.50 0.17 0.77 -0.21 0.00 0.00 178.00 179.77 3keb h SER 92 N 0.78 0.35 -0.38 -2.05 0.02 -1.92 0.61 113.55 110.96 3keb h SER 92 Ca 0.50 -0.06 -0.11 0.00 -0.84 0.00 0.00 61.79 61.28 3keb h SER 92 Cb 0.74 -0.09 -0.02 0.00 0.14 0.00 0.00 62.40 63.17 3keb h SER 92 CO -0.26 0.31 -0.16 0.28 -1.14 0.00 0.00 176.83 175.85 3keb h SER 93 N 0.36 0.85 -0.56 3.07 0.02 -1.78 -1.93 113.55 113.58 3keb h SER 93 Ca 0.10 -0.29 -0.02 0.00 -0.84 0.00 0.00 61.79 60.75 3keb h SER 93 Cb 0.03 -0.23 -0.03 0.00 0.14 0.00 0.00 62.40 62.31 3keb h SER 93 CO -0.02 1.01 0.28 -0.07 -1.14 0.00 0.00 176.83 176.89 3keb h LEU 94 N 0.75 0.72 -0.77 5.07 3.38 -0.82 -0.64 115.31 123.00 3keb h LEU 94 Ca 0.11 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 3keb h LEU 94 Cb 0.68 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 41.21 3keb h LEU 94 CO 0.05 0.63 0.38 0.00 0.09 0.00 0.00 178.44 179.60 3keb h ALA 95 N 1.11 0.99 -0.43 1.53 0.00 -0.66 -1.16 119.26 120.65 3keb h ALA 95 Ca 0.19 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 3keb h ALA 95 Cb 0.10 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 3keb h ALA 95 CO -0.03 0.54 0.02 -0.09 0.00 0.00 0.00 179.25 179.70 3keb h ARG 96 N 1.08 0.74 -0.74 0.00 1.12 -1.09 -2.94 114.38 112.56 3keb h ARG 96 Ca 0.27 -0.23 0.01 0.00 -1.11 0.00 0.00 59.98 58.92 3keb h ARG 96 Cb 0.10 -0.07 -0.04 0.00 -0.01 0.00 0.00 29.97 29.95 3keb h ARG 96 CO -0.04 0.81 0.48 0.00 -3.11 0.00 0.00 179.97 178.11 3keb h ALA 97 N 0.91 0.94 -0.30 2.80 0.00 -0.88 0.28 119.26 123.01 3keb h ALA 97 Ca 0.12 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 55.04 3keb h ALA 97 Cb 0.46 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.91 3keb h ALA 97 CO 0.02 0.33 0.02 -0.09 0.00 0.00 0.00 179.25 179.54 3keb h ARG 98 N 0.98 0.12 -0.08 0.00 2.43 -1.07 0.37 114.38 117.12 3keb h ARG 98 Ca 0.28 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.41 3keb h ARG 98 Cb -0.09 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 29.43 3keb h ARG 98 CO -0.07 0.08 -0.04 1.25 -1.51 0.00 0.00 179.97 179.67 3keb h HIS 99 N 0.12 0.20 -0.83 2.20 2.76 -1.30 -2.00 115.15 116.31 3keb h HIS 99 Ca 0.14 -0.05 -0.03 0.00 -2.20 0.00 0.00 60.37 58.23 3keb h HIS 99 Cb 0.18 -0.05 -0.04 0.00 1.55 0.00 0.00 27.41 29.05 3keb h HIS 99 CO -0.20 0.55 0.40 1.49 -1.30 0.00 0.00 177.93 178.86 3keb h GLU 100 N -0.20 1.19 -0.29 5.26 4.81 -0.04 -3.25 114.58 122.07 3keb h GLU 100 Ca 0.02 -0.18 0.00 0.00 -0.13 0.00 0.00 59.36 59.07 3keb h GLU 100 Cb 0.50 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 29.66 3keb h GLU 100 CO 0.01 0.92 0.00 0.72 -0.73 0.00 0.00 179.01 179.93 3keb n HIS 101 N -4.33 0.37 -3.05 0.92 8.25 0.13 -5.02 115.22 112.49 3keb n HIS 101 Ca 0.08 -0.30 -0.03 0.00 -0.26 0.00 0.00 57.72 57.21 3keb n HIS 101 Cb 0.14 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.24 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 0.86 -1.24 2.72 -1.41 0.00 -0.94 -5.01 105.19 100.17 3keb n GLY 102 Ca 0.13 0.65 -0.25 0.00 0.00 0.00 0.00 46.02 46.55 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 -1.48 3.52 0.12 0.99 4.77 -0.79 -4.99 117.00 119.13 3keb n LEU 103 Ca 0.01 -5.50 0.03 0.00 -0.03 0.00 0.00 56.01 50.52 3keb n LEU 103 Cb 0.50 -0.25 0.41 0.00 -2.33 0.00 0.00 43.42 41.75 3keb n LEU 103 CO 0.52 2.32 0.93 1.55 -1.33 0.00 0.00 177.39 181.38 3keb h PRO 104 N 3.08 0.25 0.00 3.23 0.13 -1.95 -3.26 132.00 133.47 3keb h PRO 104 Ca 0.13 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 3keb h PRO 104 Cb 0.63 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 31.72 3keb h PRO 104 CO 0.74 0.35 -1.20 0.09 -0.23 0.00 0.00 178.00 177.75 3keb n ASN 105 N -4.31 1.04 -4.81 1.44 3.02 -1.26 -5.01 115.26 105.36 3keb n ASN 105 Ca -0.01 -0.45 -0.33 0.00 -0.03 0.00 0.00 54.58 53.76 3keb n ASN 105 Cb 0.24 1.35 -0.03 0.00 -0.61 0.00 0.00 39.78 40.72 3keb n ASN 105 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 3keb s ILE 106 N -2.76 4.01 -0.01 2.41 -4.36 -1.23 -4.90 121.20 114.35 3keb s ILE 106 Ca 0.00 1.13 -0.28 0.00 -0.26 0.00 0.00 60.65 61.23 3keb s ILE 106 Cb 0.11 -3.50 -0.03 0.00 1.25 0.00 0.00 42.46 40.29 3keb s ILE 106 CO 0.64 -0.39 0.91 0.00 0.24 0.00 0.00 174.94 176.34 3keb s ALA 107 N -2.24 3.20 -0.22 2.27 0.00 -0.57 -4.99 121.76 119.22 3keb s ALA 107 Ca 0.64 0.44 0.02 0.00 0.00 0.00 0.00 51.96 53.06 3keb s ALA 107 Cb -0.14 -3.24 0.04 0.00 0.00 0.00 0.00 23.12 19.78 3keb s ALA 107 CO 0.25 -0.19 -0.15 -0.51 0.00 0.00 0.00 175.76 175.16 3keb s LEU 108 N 0.94 2.86 -0.07 0.00 1.43 -1.26 -0.64 118.68 121.94 3keb s LEU 108 Ca 0.48 -1.05 0.05 0.00 -1.03 0.00 0.00 54.13 52.59 3keb s LEU 108 Cb -0.20 -1.52 -0.01 0.00 0.03 0.00 0.00 46.19 44.49 3keb s LEU 108 CO 0.26 -0.10 -0.24 -0.76 0.23 0.00 0.00 176.35 175.73 3keb s LEU 109 N 1.19 2.05 -0.00 1.79 1.43 0.55 -2.02 118.68 123.67 3keb s LEU 109 Ca -0.02 -0.50 -0.08 0.00 -1.03 0.00 0.00 54.13 52.49 3keb s LEU 109 Cb -0.17 -1.33 -0.05 0.00 0.03 0.00 0.00 46.19 44.68 3keb s LEU 109 CO -0.08 0.21 0.28 -0.55 0.23 0.00 0.00 176.35 176.44 3keb s SER 110 N -0.02 6.54 -0.07 2.29 0.15 0.63 -1.64 113.70 121.58 3keb s SER 110 Ca -0.07 0.63 0.11 0.00 0.70 0.00 0.00 55.95 57.31 3keb s SER 110 Cb -0.14 -2.12 0.42 0.00 -1.71 0.00 0.00 66.02 62.47 3keb s SER 110 CO 0.05 0.28 1.27 0.35 1.20 0.00 0.00 173.24 176.38 3keb n THR 111 N 1.32 1.08 0.13 6.45 -2.24 -0.15 -2.47 114.28 118.40 3keb n THR 111 Ca -0.13 -0.69 0.16 0.00 -2.27 0.00 0.00 64.05 61.13 3keb n THR 111 Cb 0.53 -0.05 0.72 0.00 -2.10 0.00 0.00 70.33 69.43 3keb n THR 111 CO 0.00 0.00 0.00 0.17 -0.57 0.00 0.00 175.07 174.67 3keb h LEU 112 N 2.39 0.00 0.00 3.22 -0.00 -1.84 -3.43 115.31 115.65 3keb h LEU 112 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 3keb h LEU 112 Cb 0.96 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.62 3keb h LEU 112 CO 0.14 0.00 0.00 0.54 -0.00 0.00 0.00 178.44 179.12 3keb n ARG 113 N -4.25 0.07 0.00 0.17 1.74 -1.26 -5.15 116.66 107.99 3keb n ARG 113 Ca 0.04 0.27 0.00 0.00 -0.77 0.00 0.00 57.85 57.39 3keb n ARG 113 Cb 0.39 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.33 3keb n ARG 113 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3keb n ARG 115 N -1.37 0.97 -0.16 5.56 1.74 -1.26 -5.01 116.66 117.13 3keb n ARG 115 Ca 0.03 0.00 -0.10 0.00 -0.77 0.00 0.00 57.85 57.02 3keb n ARG 115 Cb 0.08 -1.48 -0.00 0.00 -1.02 0.00 0.00 32.46 30.03 3keb n ARG 115 CO 0.00 0.00 0.00 0.22 -1.52 0.00 0.00 177.63 176.33 3keb h ASP 116 N 0.03 0.72 -0.32 0.55 3.58 -2.01 -2.38 116.42 116.60 3keb h ASP 116 Ca 0.00 -0.26 0.07 0.00 0.42 0.00 0.00 57.03 57.25 3keb h ASP 116 Cb 0.49 -0.19 -0.06 0.00 1.72 0.00 0.00 39.33 41.28 3keb h ASP 116 CO 0.00 0.80 -0.10 0.15 -2.88 0.00 0.00 179.24 177.21 3keb h PHE 117 N 0.61 -0.23 -0.39 0.28 3.57 -1.95 -2.52 116.94 116.32 3keb h PHE 117 Ca 0.14 0.03 0.07 0.00 3.53 0.00 0.00 57.97 61.74 3keb h PHE 117 Cb 0.39 0.15 -0.06 0.00 2.79 0.00 0.00 35.95 39.22 3keb h PHE 117 CO 0.03 -0.17 -0.01 0.45 -2.23 0.00 0.00 178.31 176.38 3keb h HIS 118 N -0.03 -0.03 -0.41 0.41 3.86 -1.81 -0.69 115.15 116.44 3keb h HIS 118 Ca 0.16 0.03 -0.15 0.00 -1.16 0.00 0.00 60.37 59.24 3keb h HIS 118 Cb 0.27 0.07 -0.01 0.00 1.06 0.00 0.00 27.41 28.81 3keb h HIS 118 CO -0.32 -0.08 -0.35 0.87 0.86 0.00 0.00 177.93 178.91 3keb h LYS 119 N 0.10 0.95 0.00 2.45 1.57 -1.49 0.70 116.57 120.85 3keb h LYS 119 Ca 0.19 -0.48 -0.04 0.00 -1.87 0.00 0.00 60.65 58.45 3keb h LYS 119 Cb 0.27 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.58 3keb h LYS 119 CO -0.32 1.14 -0.19 0.00 -0.57 0.00 0.00 179.45 179.51 3keb h ARG 120 N 0.78 0.00 -0.23 3.15 3.08 -0.94 -2.58 114.38 117.65 3keb h ARG 120 Ca 0.07 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.12 3keb h ARG 120 Cb 0.94 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.99 3keb h ARG 120 CO 0.09 0.19 0.00 0.66 -1.07 0.00 0.00 179.97 179.84 3keb n TYR 121 N -3.51 0.29 -3.49 3.04 4.02 -0.33 -4.72 117.16 112.46 3keb n TYR 121 Ca -0.01 -0.17 -0.21 0.00 -0.01 0.00 0.00 57.90 57.50 3keb n TYR 121 Cb 0.35 -0.00 0.07 0.00 -0.02 0.00 0.00 39.34 39.74 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 1.22 -0.41 0.20 2.72 0.00 -0.75 -4.28 105.19 103.88 3keb n GLY 122 Ca 0.15 0.17 0.06 0.00 0.00 0.00 0.00 46.02 46.40 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 -4.73 1.18 -2.88 1.61 0.24 0.17 -4.59 118.33 109.33 3keb n VAL 123 Ca -0.02 -1.41 -0.41 0.00 -2.04 0.00 0.00 64.34 60.46 3keb n VAL 123 Cb 0.56 0.08 -0.04 0.00 -1.47 0.00 0.00 33.84 32.97 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 -1.77 4.34 -0.12 1.34 2.96 -1.07 0.43 118.68 124.79 3keb s LEU 124 Ca 0.19 1.43 -0.00 0.00 -0.22 0.00 0.00 54.13 55.53 3keb s LEU 124 Cb 0.17 -3.33 -0.02 0.00 0.50 0.00 0.00 46.19 43.51 3keb s LEU 124 CO 0.02 -0.19 -0.12 -0.63 -1.32 0.00 0.00 176.35 174.11 3keb s ILE 125 N 0.91 3.16 -0.71 6.68 1.01 -1.21 0.21 121.20 131.25 3keb s ILE 125 Ca 0.45 -0.63 0.08 0.00 0.00 0.00 0.00 60.65 60.54 3keb s ILE 125 Cb -0.19 -2.32 -0.00 0.00 0.01 0.00 0.00 42.46 39.95 3keb s ILE 125 CO 0.23 0.53 0.55 0.35 0.00 0.00 0.00 174.94 176.60 3keb n THR 126 N 3.34 0.00 -4.04 2.92 -2.24 -1.26 -0.27 114.28 112.73 3keb n THR 126 Ca -0.18 -0.42 -0.34 0.00 -2.27 0.00 0.00 64.05 60.84 3keb n THR 126 Cb 0.53 1.09 -0.07 0.00 -2.10 0.00 0.00 70.33 69.78 3keb n THR 126 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 3keb s GLU 127 N -1.18 3.22 0.26 -0.78 2.12 -1.26 -4.54 118.70 116.54 3keb s GLU 127 Ca 0.06 -0.36 -0.30 0.00 0.36 0.00 0.00 54.97 54.74 3keb s GLU 127 Cb 0.06 -2.98 -0.14 0.00 0.26 0.00 0.00 34.13 31.33 3keb s GLU 127 CO 0.20 0.69 1.13 0.98 -0.54 0.00 0.00 175.26 177.72 3keb n TYR 128 N 1.43 1.48 -0.54 5.30 4.19 -1.26 -1.56 117.16 126.20 3keb n TYR 128 Ca -0.15 0.65 0.10 0.00 3.31 0.00 0.00 57.90 61.81 3keb n TYR 128 Cb 0.53 -2.30 0.35 0.00 0.49 0.00 0.00 39.34 38.42 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 1.17 3.50 -0.40 2.98 -0.04 -1.26 -4.86 135.00 136.09 3keb n PRO 129 Ca 0.11 -2.83 0.07 0.00 -0.04 0.00 0.00 63.50 60.81 3keb n PRO 129 Cb 0.30 -1.82 0.21 0.00 -0.04 0.00 0.00 33.50 32.15 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 1.29 3.44 -4.68 1.53 4.77 -0.60 -5.02 117.00 117.72 3keb n LEU 130 Ca 0.26 -3.19 -0.50 0.00 -0.03 0.00 0.00 56.01 52.55 3keb n LEU 130 Cb 0.83 -0.53 -0.05 0.00 -2.33 0.00 0.00 43.42 41.34 3keb n LEU 130 CO 0.22 0.80 1.38 -0.24 -1.33 0.00 0.00 177.39 178.23 3keb n SER 131 N -0.90 3.13 0.00 -1.43 2.88 -0.76 -1.25 113.62 115.29 3keb n SER 131 Ca 0.22 1.02 0.00 0.00 -1.33 0.00 0.00 58.87 58.77 3keb n SER 131 Cb 0.84 -1.33 0.00 0.00 -0.75 0.00 0.00 64.21 62.96 3keb n SER 131 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3keb n GLY 132 N 4.10 1.81 3.82 0.46 0.00 0.62 -4.97 105.19 111.04 3keb n GLY 132 Ca 0.22 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.45 3.11 -0.14 1.61 2.02 -0.38 -4.89 117.35 116.23 3keb s TYR 133 Ca 0.00 1.45 -0.25 0.00 -0.37 0.00 0.00 57.07 57.91 3keb s TYR 133 Cb 0.00 -2.91 -0.02 0.00 -0.40 0.00 0.00 41.96 38.62 3keb s TYR 133 CO 0.00 -1.11 0.79 0.95 -1.57 0.00 0.00 175.55 174.60 3keb s THR 134 N -2.81 4.93 0.38 -0.71 -4.23 -1.26 -3.31 115.64 108.64 3keb s THR 134 Ca 0.60 1.56 -0.27 0.00 -1.18 0.00 0.00 61.69 62.40 3keb s THR 134 Cb -0.14 -4.10 -0.09 0.00 1.34 0.00 0.00 72.50 69.50 3keb s THR 134 CO 0.47 0.09 1.29 -0.55 -0.54 0.00 0.00 174.62 175.39 3keb s SER 135 N 1.07 6.48 0.28 3.99 0.15 0.17 -4.05 113.70 121.79 3keb s SER 135 Ca 0.38 2.64 -0.29 0.00 0.70 0.00 0.00 55.95 59.37 3keb s SER 135 Cb -0.17 -2.64 -0.10 0.00 -1.71 0.00 0.00 66.02 61.40 3keb s SER 135 CO 0.14 -0.73 1.31 -2.16 1.20 0.00 0.00 173.24 173.00 3keb s PRO 136 N -2.10 4.38 0.12 5.44 0.04 -1.26 -4.71 135.00 136.91 3keb s PRO 136 Ca 0.54 2.15 -0.25 0.00 0.04 0.00 0.00 61.00 63.49 3keb s PRO 136 Cb -0.38 -3.12 0.07 0.00 0.04 0.00 0.00 34.50 31.12 3keb s PRO 136 CO 0.49 -0.20 0.73 0.00 0.04 0.00 0.00 177.00 178.06 3keb s ALA 137 N -0.67 -1.63 -0.02 8.56 0.00 -0.85 -1.68 121.76 125.46 3keb s ALA 137 Ca 0.52 0.53 0.01 0.00 0.00 0.00 0.00 51.96 53.02 3keb s ALA 137 Cb -0.39 0.72 0.01 0.00 0.00 0.00 0.00 23.12 23.47 3keb s ALA 137 CO 0.47 -0.80 -0.05 -1.50 0.00 0.00 0.00 175.76 173.88 3keb s ILE 138 N -3.55 0.47 -0.08 0.00 2.07 -0.12 -1.32 121.20 118.67 3keb s ILE 138 Ca 0.04 -0.18 -0.00 0.00 -1.41 0.00 0.00 60.65 59.10 3keb s ILE 138 Cb -0.02 -0.45 0.03 0.00 0.13 0.00 0.00 42.46 42.15 3keb s ILE 138 CO -0.08 0.17 -0.04 -0.63 -1.91 0.00 0.00 174.94 172.45 3keb s ILE 139 N 0.35 0.65 -0.21 2.00 1.01 0.41 -0.99 121.20 124.41 3keb s ILE 139 Ca -0.04 -0.08 -0.16 0.00 0.00 0.00 0.00 60.65 60.37 3keb s ILE 139 Cb -0.08 -0.73 -0.04 0.00 0.01 0.00 0.00 42.46 41.63 3keb s ILE 139 CO -0.00 0.29 0.39 -0.22 0.00 0.00 0.00 174.94 175.40 3keb s LEU 140 N 1.64 4.13 0.05 2.97 2.96 0.08 -0.14 118.68 130.37 3keb s LEU 140 Ca 0.01 0.47 0.03 0.00 -0.22 0.00 0.00 54.13 54.43 3keb s LEU 140 Cb -0.13 -2.49 -0.02 0.00 0.50 0.00 0.00 46.19 44.04 3keb s LEU 140 CO -0.05 -0.10 -0.10 0.00 -1.32 0.00 0.00 176.35 174.79 3keb s ALA 141 N 1.45 0.76 0.84 5.97 0.00 -0.16 -0.46 121.76 130.15 3keb s ALA 141 Ca 0.18 -0.82 -0.07 0.00 0.00 0.00 0.00 51.96 51.26 3keb s ALA 141 Cb -0.15 -0.01 0.16 0.00 0.00 0.00 0.00 23.12 23.12 3keb s ALA 141 CO 0.08 0.05 0.99 -0.40 0.00 0.00 0.00 175.76 176.47 3keb n ASP 142 N 1.47 0.65 0.31 0.00 5.68 -0.40 -0.65 116.55 123.62 3keb n ASP 142 Ca -0.22 -1.71 0.20 0.00 -0.50 0.00 0.00 54.79 52.57 3keb n ASP 142 Cb 0.55 -0.70 0.98 0.00 -1.14 0.00 0.00 41.12 40.81 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 -1.17 1.00 0.00 2.12 0.00 -1.91 -1.06 119.26 118.24 3keb h ALA 143 Ca -0.32 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.59 3keb h ALA 143 Cb 1.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.82 3keb h ALA 143 CO 0.28 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.53 3keb n ALA 144 N -2.08 2.60 -2.81 0.00 0.00 -1.26 -4.61 120.51 112.34 3keb n ALA 144 Ca -0.01 -0.13 -0.22 0.00 0.00 0.00 0.00 53.44 53.08 3keb n ALA 144 Cb 0.18 -1.33 0.02 0.00 0.00 0.00 0.00 19.45 18.31 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 -0.83 -5.93 -4.76 0.00 3.02 -0.40 -4.91 115.26 101.45 3keb n ASN 145 Ca 0.15 -0.19 -0.37 0.00 -0.03 0.00 0.00 54.58 54.15 3keb n ASN 145 Cb 0.07 -4.85 -0.07 0.00 -0.61 0.00 0.00 39.78 34.33 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 -3.11 5.27 0.00 2.41 1.01 -1.26 -0.56 120.40 124.17 3keb s VAL 146 Ca 0.20 0.59 -0.30 0.00 0.00 0.00 0.00 61.98 62.46 3keb s VAL 146 Cb -0.09 -3.63 -0.05 0.00 0.00 0.00 0.00 36.38 32.61 3keb s VAL 146 CO 0.24 0.44 1.23 -0.69 0.00 0.00 0.00 175.10 176.33 3keb s VAL 147 N 0.06 4.07 -0.04 2.92 1.01 0.66 -1.27 120.40 127.81 3keb s VAL 147 Ca 0.18 1.45 0.18 0.00 0.00 0.00 0.00 61.98 63.79 3keb s VAL 147 Cb -0.14 -3.93 -0.27 0.00 0.00 0.00 0.00 36.38 32.04 3keb s VAL 147 CO 0.06 0.04 0.35 1.41 0.00 0.00 0.00 175.10 176.97 3keb n HIS 148 N 4.71 0.00 -3.63 5.22 8.25 0.39 -0.56 115.22 129.59 3keb n HIS 148 Ca 0.10 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.45 3keb n HIS 148 Cb 0.46 -0.47 -0.07 0.00 1.12 0.00 0.00 29.99 31.03 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 -3.14 -0.73 -0.07 4.41 5.04 -1.18 -4.83 117.35 116.84 3keb s TYR 149 Ca -0.07 1.73 -0.09 0.00 -2.44 0.00 0.00 57.07 56.21 3keb s TYR 149 Cb 0.11 0.32 0.02 0.00 0.35 0.00 0.00 41.96 42.76 3keb s TYR 149 CO 0.74 -0.35 0.23 -1.54 -1.34 0.00 0.00 175.55 173.29 3keb s SER 150 N 0.47 -0.21 -0.14 4.32 1.04 -1.26 -0.75 113.70 117.17 3keb s SER 150 Ca -0.00 0.37 -0.07 0.00 0.48 0.00 0.00 55.95 56.73 3keb s SER 150 Cb -0.05 0.44 0.06 0.00 0.10 0.00 0.00 66.02 66.57 3keb s SER 150 CO -0.03 -0.14 0.33 -0.70 0.98 0.00 0.00 173.24 173.68 3keb s GLU 151 N -0.14 0.28 -0.17 4.02 2.12 -0.16 -4.98 118.70 119.67 3keb s GLU 151 Ca -0.03 0.70 -0.13 0.00 0.36 0.00 0.00 54.97 55.87 3keb s GLU 151 Cb -0.03 -0.04 -0.05 0.00 0.26 0.00 0.00 34.13 34.28 3keb s GLU 151 CO 0.01 -0.18 0.27 1.03 -0.54 0.00 0.00 175.26 175.85 3keb s ARG 152 N 1.54 4.25 0.22 4.30 0.52 -1.26 -0.95 118.95 127.57 3keb s ARG 152 Ca -0.08 0.06 -0.30 0.00 -0.52 0.00 0.00 55.73 54.89 3keb s ARG 152 Cb -0.10 -3.42 -0.10 0.00 0.52 0.00 0.00 34.95 31.85 3keb s ARG 152 CO -0.11 0.25 1.48 -0.51 0.02 0.00 0.00 175.30 176.43 3keb s LEU 153 N 0.45 4.38 0.42 2.53 1.43 -0.68 -4.93 118.68 122.29 3keb s LEU 153 Ca 0.15 2.66 0.23 0.00 -1.03 0.00 0.00 54.13 56.14 3keb s LEU 153 Cb -0.13 -3.61 0.31 0.00 0.03 0.00 0.00 46.19 42.79 3keb s LEU 153 CO 0.03 -0.75 1.56 0.00 0.23 0.00 0.00 176.35 177.43 3keb h ALA 154 N 5.59 0.96 -3.62 4.21 0.00 -1.91 -3.44 119.26 121.05 3keb h ALA 154 Ca -0.45 0.00 -0.27 0.00 0.00 0.00 0.00 54.91 54.19 3keb h ALA 154 Cb 1.21 0.00 -0.31 0.00 0.00 0.00 0.00 17.79 18.69 3keb h ALA 154 CO 0.82 0.00 -0.73 1.21 0.00 0.00 0.00 179.25 180.55 3keb s ASN 155 N -6.13 0.07 0.50 0.00 3.84 -1.26 -0.36 114.94 111.61 3keb s ASN 155 Ca 0.06 0.01 0.34 0.00 0.21 0.00 0.00 52.86 53.49 3keb s ASN 155 Cb 0.05 -0.05 1.63 0.00 -0.55 0.00 0.00 41.25 42.34 3keb s ASN 155 CO 0.68 -0.07 2.02 0.71 -2.79 0.00 0.00 177.10 177.65 3keb h THR 156 N 5.76 0.00 -0.02 -5.21 1.35 -1.13 -2.38 112.91 111.28 3keb h THR 156 Ca -0.36 -0.21 0.00 0.00 -0.55 0.00 0.00 66.41 65.30 3keb h THR 156 Cb 1.16 1.07 0.00 0.00 -1.73 0.00 0.00 68.15 68.65 3keb h THR 156 CO 0.49 0.00 -0.01 0.54 -0.25 0.00 0.00 175.52 176.29 3keb n ARG 157 N -2.80 1.90 -1.80 4.72 1.74 -1.26 -0.99 116.66 118.17 3keb n ARG 157 Ca -0.01 -1.34 -0.31 0.00 -0.77 0.00 0.00 57.85 55.43 3keb n ARG 157 Cb 0.17 -1.47 0.03 0.00 -1.02 0.00 0.00 32.46 30.16 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 -2.02 5.87 0.11 0.55 1.01 -0.90 -4.98 116.67 116.31 3keb s ASP 158 Ca 0.33 1.41 0.00 0.00 0.71 0.00 0.00 52.55 55.00 3keb s ASP 158 Cb 0.21 -2.37 -0.04 0.00 1.01 0.00 0.00 42.92 41.72 3keb s ASP 158 CO 0.33 -1.10 0.27 -0.36 0.21 0.00 0.00 175.17 174.52 3keb s PHE 159 N -3.18 3.50 0.93 4.23 0.08 -1.26 -4.91 117.98 117.37 3keb s PHE 159 Ca 0.56 0.25 -0.11 0.00 0.12 0.00 0.00 56.93 57.76 3keb s PHE 159 Cb -0.12 -1.77 0.11 0.00 -0.57 0.00 0.00 43.02 40.68 3keb s PHE 159 CO 0.54 0.53 0.91 1.19 -0.10 0.00 0.00 175.22 178.29 3keb n PHE 160 N -0.09 0.13 -2.61 0.36 3.72 -1.26 -4.89 117.46 112.82 3keb n PHE 160 Ca -0.05 0.35 -0.43 0.00 -0.05 0.00 0.00 57.45 57.26 3keb n PHE 160 Cb 0.52 -1.93 0.00 0.00 -0.94 0.00 0.00 39.48 37.13 3keb n PHE 160 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 3keb n ASP 161 N -3.33 4.95 -0.05 4.37 -0.08 -1.26 -4.76 116.55 116.38 3keb n ASP 161 Ca 0.10 -2.94 -0.01 0.00 -1.51 0.00 0.00 54.79 50.43 3keb n ASP 161 Cb 0.52 -1.67 0.25 0.00 2.34 0.00 0.00 41.12 42.56 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 7.19 0.66 -0.77 -0.67 0.04 -2.00 -2.21 116.94 119.19 3keb h PHE 162 Ca 0.42 -0.07 0.06 0.00 2.80 0.00 0.00 57.97 61.18 3keb h PHE 162 Cb 0.84 -0.19 -0.06 0.00 2.20 0.00 0.00 35.95 38.74 3keb h PHE 162 CO 1.32 0.62 0.46 -0.44 -0.60 0.00 0.00 178.31 179.66 3keb h ASP 163 N 0.61 0.70 -0.38 2.17 3.32 -1.99 0.28 116.42 121.13 3keb h ASP 163 Ca 0.13 0.03 -0.08 0.00 0.02 0.00 0.00 57.03 57.13 3keb h ASP 163 Cb 0.35 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.76 3keb h ASP 163 CO 0.01 0.44 -0.03 0.00 -1.72 0.00 0.00 179.24 177.94 3keb h ALA 164 N 1.38 1.08 -0.23 3.45 0.00 -1.81 -1.99 119.26 121.14 3keb h ALA 164 Ca 0.34 -0.28 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 3keb h ALA 164 Cb 0.19 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 3keb h ALA 164 CO -0.18 0.58 -0.22 0.82 0.00 0.00 0.00 179.25 180.24 3keb h ILE 165 N 0.72 1.32 -0.99 0.00 2.04 -0.88 -2.86 117.51 116.85 3keb h ILE 165 Ca 0.14 -1.38 0.04 0.00 1.00 0.00 0.00 64.86 64.65 3keb h ILE 165 Cb 0.49 1.70 -0.06 0.00 -0.74 0.00 0.00 36.82 38.21 3keb h ILE 165 CO 0.02 0.43 0.65 -0.08 0.00 0.00 0.00 178.15 179.17 3keb h GLU 166 N 0.25 1.20 -0.40 2.37 4.81 -0.38 -0.86 114.58 121.58 3keb h GLU 166 Ca 0.04 -0.07 -0.03 0.00 -0.13 0.00 0.00 59.36 59.16 3keb h GLU 166 Cb 0.77 -0.27 -0.02 0.00 0.63 0.00 0.00 28.75 29.87 3keb h GLU 166 CO 0.06 0.79 0.13 -0.22 -0.73 0.00 0.00 179.01 179.03 3keb h LYS 167 N 1.24 0.62 -0.71 1.92 3.64 -1.33 0.96 116.57 122.91 3keb h LYS 167 Ca 0.40 -0.13 -0.06 0.00 -1.27 0.00 0.00 60.65 59.58 3keb h LYS 167 Cb 0.03 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 31.73 3keb h LYS 167 CO -0.13 0.62 0.19 -0.07 -2.27 0.00 0.00 179.45 177.79 3keb h LEU 168 N 0.50 1.05 -0.84 5.20 3.38 -1.21 0.43 115.31 123.82 3keb h LEU 168 Ca 0.13 -0.22 -0.10 0.00 0.09 0.00 0.00 57.88 57.77 3keb h LEU 168 Cb 0.26 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 3keb h LEU 168 CO -0.00 1.00 -0.23 -0.07 0.09 0.00 0.00 178.44 179.23 3keb h LEU 169 N 1.05 0.62 -0.22 1.67 3.38 -0.82 -1.00 115.31 120.00 3keb h LEU 169 Ca 0.22 -0.21 -0.14 0.00 0.09 0.00 0.00 57.88 57.84 3keb h LEU 169 Cb 0.35 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.93 3keb h LEU 169 CO -0.00 0.84 -0.42 1.56 0.09 0.00 0.00 178.44 180.51 3keb h GLN 170 N 0.54 0.67 -0.80 1.13 4.20 -0.53 -1.94 115.11 118.38 3keb h GLN 170 Ca 0.08 -0.43 0.00 0.00 0.06 0.00 0.00 58.65 58.36 3keb h GLN 170 Cb 0.68 0.05 -0.04 0.00 0.30 0.00 0.00 27.48 28.47 3keb h GLN 170 CO 0.05 1.05 0.51 0.93 -0.67 0.00 0.00 178.83 180.70 3keb h GLU 171 N 0.37 1.07 0.25 1.46 5.08 -0.81 -2.28 114.58 119.71 3keb h GLU 171 Ca 0.01 -0.07 0.01 0.00 -1.00 0.00 0.00 59.36 58.30 3keb h GLU 171 Cb 1.02 -0.23 -0.03 0.00 0.50 0.00 0.00 28.75 30.01 3keb h GLU 171 CO 0.09 0.72 -0.30 0.78 -1.00 0.00 0.00 179.01 179.30 3keb h GLY 172 N 1.10 -0.65 1.95 -3.84 0.00 -1.12 -2.94 103.07 97.57 3keb h GLY 172 Ca 0.29 0.35 0.00 0.00 0.00 0.00 0.00 47.33 47.97 3keb h GLY 172 CO -0.06 -0.26 0.02 1.18 0.00 0.00 0.00 176.54 177.42 3keb n GLU 173 N -5.41 0.10 0.00 4.80 1.02 -0.73 -5.11 120.64 115.30 3keb n GLU 173 Ca -0.08 0.59 0.00 0.00 -0.02 0.00 0.00 57.16 57.65 3keb n GLU 173 Cb 0.32 -1.84 0.00 0.00 -0.02 0.00 0.00 31.44 29.90 3keb n GLU 173 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35