#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tk6 h ARG 8 N 0.00 0.29 -3.48 0.00 3.08 -2.08 -3.45 114.38 108.74 1tk6 h ARG 8 Ca 0.00 -0.19 -0.10 0.00 0.07 0.00 0.00 59.98 59.76 1tk6 h ARG 8 Cb 0.00 0.02 -0.17 0.00 0.08 0.00 0.00 29.97 29.90 1tk6 h ARG 8 CO 0.00 0.78 -0.34 0.00 -1.07 0.00 0.00 179.97 179.33 1tk6 s ALA 9 N -3.86 -0.47 -0.09 0.04 0.00 -1.26 -5.14 121.76 110.98 1tk6 s ALA 9 Ca -0.05 -0.19 0.00 0.00 0.00 0.00 0.00 51.96 51.72 1tk6 s ALA 9 Cb 0.12 0.30 -0.03 0.00 0.00 0.00 0.00 23.12 23.51 1tk6 s ALA 9 CO 0.80 -0.38 -0.08 0.99 0.00 0.00 0.00 175.76 177.09 1tk6 s THR 10 N -2.58 3.55 0.32 0.00 2.01 -1.26 -5.05 115.64 112.62 1tk6 s THR 10 Ca -0.05 -0.52 -0.29 0.00 0.31 0.00 0.00 61.69 61.15 1tk6 s THR 10 Cb -0.01 -2.47 -0.12 0.00 0.01 0.00 0.00 72.50 69.90 1tk6 s THR 10 CO -0.04 0.56 1.33 0.00 -0.69 0.00 0.00 174.62 175.79 1tk6 n ALA 11 N 2.72 1.34 0.00 7.40 0.00 -1.26 -0.65 120.51 130.06 1tk6 n ALA 11 Ca -0.18 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.64 1tk6 n ALA 11 Cb 0.53 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.71 1tk6 n ALA 11 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1tk6 n GLY 12 N 1.15 3.23 3.84 0.00 0.00 -1.26 -5.04 105.19 107.11 1tk6 n GLY 12 Ca 0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.76 1tk6 n GLY 12 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1tk6 s GLU 13 N -0.53 4.06 -0.14 1.61 2.02 0.18 -4.98 118.70 120.91 1tk6 s GLU 13 Ca 0.00 0.91 -0.04 0.00 0.02 0.00 0.00 54.97 55.85 1tk6 s GLU 13 Cb 0.00 -2.25 0.06 0.00 0.10 0.00 0.00 34.13 32.04 1tk6 s GLU 13 CO 0.00 -0.05 0.12 0.08 0.02 0.00 0.00 175.26 175.43 1tk6 s VAL 14 N -2.27 -0.16 -2.24 2.63 1.01 -1.26 -3.85 120.40 114.27 1tk6 s VAL 14 Ca 0.58 0.01 0.24 0.00 0.00 0.00 0.00 61.98 62.81 1tk6 s VAL 14 Cb -0.10 -0.49 0.15 0.00 0.00 0.00 0.00 36.38 35.94 1tk6 s VAL 14 CO 0.20 -0.14 1.29 -1.84 0.00 0.00 0.00 175.10 174.62 1tk6 n GLU 15 N 5.30 1.43 0.00 2.72 0.28 -0.40 -4.78 120.64 125.18 1tk6 n GLU 15 Ca -0.06 -1.10 0.00 0.00 -0.16 0.00 0.00 57.16 55.85 1tk6 n GLU 15 Cb 0.49 -1.48 0.00 0.00 1.43 0.00 0.00 31.44 31.89 1tk6 n GLU 15 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1tk6 n GLY 16 N 1.36 -1.02 3.06 -1.84 0.00 -0.90 -4.35 105.19 101.51 1tk6 n GLY 16 Ca 0.12 -1.10 -0.12 0.00 0.00 0.00 0.00 46.02 44.92 1tk6 n GLY 16 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1tk6 s SER 17 N -4.00 -0.26 0.11 1.61 0.15 -0.09 -3.52 113.70 107.70 1tk6 s SER 17 Ca 0.00 0.51 -0.14 0.00 0.70 0.00 0.00 55.95 57.02 1tk6 s SER 17 Cb 0.00 0.41 -0.07 0.00 -1.71 0.00 0.00 66.02 64.65 1tk6 s SER 17 CO 0.00 -0.15 1.44 0.44 1.20 0.00 0.00 173.24 176.16 1tk6 h ASP 18 N 7.01 0.80 -0.65 5.45 3.32 -1.90 -0.09 116.42 130.36 1tk6 h ASP 18 Ca -0.39 -0.46 -0.02 0.00 0.02 0.00 0.00 57.03 56.17 1tk6 h ASP 18 Cb 1.16 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 40.45 1tk6 h ASP 18 CO 0.37 1.10 0.32 0.00 -1.72 0.00 0.00 179.24 179.32 1tk6 h ALA 19 N 0.73 1.30 -0.23 3.45 0.00 -1.96 -1.41 119.26 121.14 1tk6 h ALA 19 Ca 0.05 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1tk6 h ALA 19 Cb 0.87 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1tk6 h ALA 19 CO 0.07 0.54 0.00 1.28 0.00 0.00 0.00 179.25 181.15 1tk6 n LEU 20 N -4.34 2.32 -3.80 0.00 4.77 -1.22 -4.95 117.00 109.78 1tk6 n LEU 20 Ca 0.06 -0.97 -0.23 0.00 -0.03 0.00 0.00 56.01 54.85 1tk6 n LEU 20 Cb 0.13 -0.14 0.01 0.00 -2.33 0.00 0.00 43.42 41.09 1tk6 n LEU 20 CO 0.38 0.48 -0.11 0.54 -1.33 0.00 0.00 177.39 177.35 1tk6 n ARG 21 N 0.76 -4.39 -4.00 3.23 5.12 -0.53 -4.94 116.66 111.91 1tk6 n ARG 21 Ca 0.17 0.55 -0.31 0.00 -1.93 0.00 0.00 57.85 56.33 1tk6 n ARG 21 Cb 0.44 -4.98 -0.15 0.00 -1.16 0.00 0.00 32.46 26.60 1tk6 n ARG 21 CO 0.00 0.00 0.00 1.41 -1.93 0.00 0.00 177.63 177.11 1tk6 s MET 22 N -6.20 1.90 0.57 5.56 1.75 -0.12 -5.01 119.30 117.75 1tk6 s MET 22 Ca 0.04 -1.16 -0.20 0.00 -1.25 0.00 0.00 55.69 53.12 1tk6 s MET 22 Cb -0.02 -2.73 -0.04 0.00 2.84 0.00 0.00 34.83 34.88 1tk6 s MET 22 CO 0.84 -0.59 1.26 0.16 -0.65 0.00 0.00 175.02 176.04 1tk6 s ASP 23 N 1.26 5.25 0.33 1.11 -4.77 -1.26 -0.91 116.67 117.68 1tk6 s ASP 23 Ca -0.07 2.53 0.07 0.00 -3.30 0.00 0.00 52.55 51.78 1tk6 s ASP 23 Cb -0.19 -2.61 0.76 0.00 -1.09 0.00 0.00 42.92 39.79 1tk6 s ASP 23 CO -0.06 -1.56 1.83 0.00 0.70 0.00 0.00 175.17 176.08 1tk6 h ALA 24 N 1.16 1.76 0.25 2.11 0.00 -1.87 0.15 119.26 122.82 1tk6 h ALA 24 Ca -0.51 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.43 1tk6 h ALA 24 Cb 1.30 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1tk6 h ALA 24 CO 0.56 -0.05 -0.12 0.22 0.00 0.00 0.00 179.25 179.87 1tk6 h ASP 25 N 0.75 -0.28 -0.31 0.00 -0.00 -1.92 0.67 116.42 115.34 1tk6 h ASP 25 Ca 0.50 -0.02 -0.00 0.00 -0.00 0.00 0.00 57.03 57.51 1tk6 h ASP 25 Cb 0.78 0.07 -0.02 0.00 -0.00 0.00 0.00 39.33 40.17 1tk6 h ASP 25 CO -0.27 -0.16 0.19 -0.09 -0.00 0.00 0.00 179.24 178.91 1tk6 h ARG 26 N -0.38 0.43 -0.79 0.28 2.43 -1.82 -3.08 114.38 111.45 1tk6 h ARG 26 Ca -0.03 -0.04 0.02 0.00 -0.81 0.00 0.00 59.98 59.12 1tk6 h ARG 26 Cb 0.29 -0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 29.71 1tk6 h ARG 26 CO 0.06 0.33 0.52 0.00 -1.51 0.00 0.00 179.97 179.36 1tk6 h ALA 27 N 1.07 1.02 -0.82 2.80 0.00 -0.85 -2.67 119.26 119.81 1tk6 h ALA 27 Ca 0.11 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.99 1tk6 h ALA 27 Cb 0.01 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 17.46 1tk6 h ALA 27 CO -0.02 0.37 0.54 1.49 0.00 0.00 0.00 179.25 181.63 1tk6 h GLU 28 N 1.03 1.05 -0.66 0.00 4.81 -0.78 0.11 114.58 120.15 1tk6 h GLU 28 Ca 0.30 -0.06 0.01 0.00 -0.13 0.00 0.00 59.36 59.47 1tk6 h GLU 28 Cb -0.07 -0.24 -0.03 0.00 0.63 0.00 0.00 28.75 29.04 1tk6 h GLU 28 CO -0.08 0.70 0.43 1.96 -0.73 0.00 0.00 179.01 181.28 1tk6 h GLN 29 N 1.08 0.87 -0.28 1.92 4.20 -1.41 -0.47 115.11 121.02 1tk6 h GLN 29 Ca 0.31 -0.06 -0.04 0.00 0.06 0.00 0.00 58.65 58.93 1tk6 h GLN 29 Cb -0.08 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.49 1tk6 h GLN 29 CO -0.08 0.58 0.03 0.00 -0.67 0.00 0.00 178.83 178.70 1tk6 h VAL 31 N 0.29 0.76 -0.99 0.00 2.07 -0.59 0.22 116.25 118.00 1tk6 h VAL 31 Ca 0.08 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.69 1tk6 h VAL 31 Cb 0.36 0.76 -0.07 0.00 -1.52 0.00 0.00 31.29 30.81 1tk6 h VAL 31 CO 0.01 0.00 0.64 0.44 0.02 0.00 0.00 177.57 178.67 1tk6 h ASP 32 N -0.02 0.98 -0.35 0.57 3.32 -1.13 0.18 116.42 119.96 1tk6 h ASP 32 Ca 0.11 0.02 -0.10 0.00 0.02 0.00 0.00 57.03 57.08 1tk6 h ASP 32 Cb 0.18 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 1tk6 h ASP 32 CO -0.23 0.58 -0.17 0.00 -1.72 0.00 0.00 179.24 177.71 1tk6 h ALA 33 N 1.50 0.49 -0.43 3.45 0.00 -1.15 -2.94 119.26 120.17 1tk6 h ALA 33 Ca 0.45 -0.35 -0.14 0.00 0.00 0.00 0.00 54.91 54.88 1tk6 h ALA 33 Cb 0.30 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1tk6 h ALA 33 CO -0.20 0.41 -0.28 -0.07 0.00 0.00 0.00 179.25 179.11 1tk6 h LEU 34 N 0.51 0.96 -1.05 0.00 3.38 0.16 -1.77 115.31 117.50 1tk6 h LEU 34 Ca 0.08 -0.39 -0.08 0.00 0.09 0.00 0.00 57.88 57.57 1tk6 h LEU 34 Cb 0.71 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 1tk6 h LEU 34 CO 0.05 1.17 -0.23 0.78 0.09 0.00 0.00 178.44 180.30 1tk6 h ASN 35 N 0.79 0.39 -0.43 -0.43 2.35 -0.75 -0.38 115.58 117.13 1tk6 h ASN 35 Ca 0.09 -0.12 -0.14 0.00 -0.55 0.00 0.00 56.30 55.57 1tk6 h ASN 35 Cb 0.85 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 39.10 1tk6 h ASN 35 CO 0.07 0.63 -0.29 0.00 -1.65 0.00 0.00 177.43 176.19 1tk6 h ALA 36 N 1.40 0.65 -0.49 -0.83 0.00 -1.29 -2.37 119.26 116.33 1tk6 h ALA 36 Ca 0.06 -0.42 0.01 0.00 0.00 0.00 0.00 54.91 54.55 1tk6 h ALA 36 Cb 0.61 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 1tk6 h ALA 36 CO 0.04 0.68 0.33 -0.44 0.00 0.00 0.00 179.25 179.86 1tk6 h ASP 37 N 0.81 0.56 -0.56 0.00 3.32 -0.67 -2.42 116.42 117.46 1tk6 h ASP 37 Ca 0.09 -0.01 0.07 0.00 0.02 0.00 0.00 57.03 57.20 1tk6 h ASP 37 Cb 0.88 -0.14 -0.06 0.00 0.22 0.00 0.00 39.33 40.23 1tk6 h ASP 37 CO 0.08 0.41 0.24 0.25 -1.72 0.00 0.00 179.24 178.50 1tk6 h LEU 38 N 0.67 0.29 -0.33 1.55 5.85 -0.93 0.10 115.31 122.51 1tk6 h LEU 38 Ca 0.18 0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.94 1tk6 h LEU 38 Cb -0.07 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 40.96 1tk6 h LEU 38 CO -0.04 0.19 0.15 0.00 -0.34 0.00 0.00 178.44 178.40 1tk6 h ALA 39 N 1.36 0.42 -0.59 1.25 0.00 -1.27 -0.99 119.26 119.43 1tk6 h ALA 39 Ca 0.27 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.99 1tk6 h ALA 39 Cb 0.27 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1tk6 h ALA 39 CO -0.24 -0.01 0.05 -0.91 0.00 0.00 0.00 179.25 178.14 1tk6 h ASN 40 N 0.39 0.96 0.06 0.00 2.35 -0.91 -2.35 115.58 116.08 1tk6 h ASN 40 Ca 0.11 -0.24 -0.12 0.00 -0.55 0.00 0.00 56.30 55.50 1tk6 h ASN 40 Cb 0.13 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.24 1tk6 h ASN 40 CO -0.01 0.99 -0.38 0.58 -1.65 0.00 0.00 177.43 176.96 1tk6 h VAL 41 N 0.93 1.30 0.00 2.81 2.07 -0.64 -0.98 116.25 121.74 1tk6 h VAL 41 Ca 0.18 -1.50 -0.15 0.00 0.82 0.00 0.00 66.70 66.05 1tk6 h VAL 41 Cb 0.48 1.56 -0.02 0.00 -1.52 0.00 0.00 31.29 31.79 1tk6 h VAL 41 CO 0.02 0.46 -0.72 1.88 0.02 0.00 0.00 177.57 179.24 1tk6 h TYR 42 N 0.36 0.00 -0.33 1.57 0.99 -1.00 0.31 116.97 118.88 1tk6 h TYR 42 Ca 0.04 0.00 -0.18 0.00 2.00 0.00 0.00 58.73 60.59 1tk6 h TYR 42 Cb 0.83 0.00 -0.00 0.00 1.00 0.00 0.00 36.73 38.56 1tk6 h TYR 42 CO 0.03 0.72 -0.49 -0.39 -0.00 0.00 0.00 178.16 178.03 1tk6 h VAL 43 N 0.00 1.27 -0.22 -2.88 -1.51 -1.34 -2.20 116.25 109.37 1tk6 h VAL 43 Ca -0.01 -1.67 0.05 0.00 -1.23 0.00 0.00 66.70 63.85 1tk6 h VAL 43 Cb 1.46 1.53 -0.07 0.00 -2.13 0.00 0.00 31.29 32.08 1tk6 h VAL 43 CO 0.09 0.55 -0.44 0.25 -1.23 0.00 0.00 177.57 176.79 1tk6 h LEU 44 N 0.71 -1.41 -0.63 4.19 5.85 -0.82 -0.99 115.31 122.21 1tk6 h LEU 44 Ca 0.03 0.19 0.12 0.00 0.84 0.00 0.00 57.88 59.07 1tk6 h LEU 44 Cb 1.09 0.59 -0.12 0.00 0.37 0.00 0.00 40.66 42.59 1tk6 h LEU 44 CO 0.11 -0.42 -0.20 0.22 -0.34 0.00 0.00 178.44 177.82 1tk6 h TYR 45 N -0.45 -0.47 -0.24 1.25 3.20 -0.88 0.41 116.97 119.79 1tk6 h TYR 45 Ca 0.09 0.06 -0.11 0.00 3.14 0.00 0.00 58.73 61.91 1tk6 h TYR 45 Cb 0.62 0.30 -0.01 0.00 1.54 0.00 0.00 36.73 39.18 1tk6 h TYR 45 CO -0.55 -0.31 -0.34 0.45 -1.64 0.00 0.00 178.16 175.78 1tk6 h HIS 46 N -0.04 0.59 -0.02 -3.82 3.86 -1.11 -0.42 115.15 114.19 1tk6 h HIS 46 Ca 0.30 -0.15 -0.19 0.00 -1.16 0.00 0.00 60.37 59.16 1tk6 h HIS 46 Cb 0.50 -0.13 -0.01 0.00 1.06 0.00 0.00 27.41 28.82 1tk6 h HIS 46 CO -0.55 0.78 -0.82 0.37 0.86 0.00 0.00 177.93 178.57 1tk6 h GLN 47 N 0.43 0.28 -0.55 2.45 4.15 -0.44 -1.71 115.11 119.73 1tk6 h GLN 47 Ca 0.05 -0.28 -0.05 0.00 0.77 0.00 0.00 58.65 59.14 1tk6 h GLN 47 Cb 0.79 0.07 -0.03 0.00 0.21 0.00 0.00 27.48 28.53 1tk6 h GLN 47 CO 0.06 0.96 0.13 -0.07 -1.93 0.00 0.00 178.83 177.98 1tk6 h LEU 48 N 0.17 0.79 -0.20 -2.39 3.38 -0.45 -1.22 115.31 115.40 1tk6 h LEU 48 Ca -0.04 -0.15 0.04 0.00 0.09 0.00 0.00 57.88 57.82 1tk6 h LEU 48 Cb 1.42 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.93 1tk6 h LEU 48 CO 0.13 0.78 -0.03 0.11 0.09 0.00 0.00 178.44 179.52 1tk6 h LYS 49 N 0.82 0.02 -0.07 1.13 1.79 -0.90 0.32 116.57 119.67 1tk6 h LYS 49 Ca 0.18 -0.00 0.04 0.00 -2.18 0.00 0.00 60.65 58.68 1tk6 h LYS 49 Cb 0.31 -0.01 -0.05 0.00 -1.58 0.00 0.00 32.23 30.90 1tk6 h LYS 49 CO -0.00 0.01 -0.21 -0.22 -1.08 0.00 0.00 179.45 177.95 1tk6 h LYS 50 N 0.02 -0.29 -0.15 3.15 3.64 -1.01 0.47 116.57 122.41 1tk6 h LYS 50 Ca 0.09 0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 59.42 1tk6 h LYS 50 Cb 0.13 0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.01 1tk6 h LYS 50 CO -0.18 -0.19 -0.22 0.45 -2.27 0.00 0.00 179.45 177.03 1tk6 h HIS 51 N -0.30 0.27 -0.15 1.91 3.86 -1.03 -1.74 115.15 117.99 1tk6 h HIS 51 Ca 0.08 -0.04 0.01 0.00 -1.16 0.00 0.00 60.37 59.26 1tk6 h HIS 51 Cb 0.41 -0.07 -0.02 0.00 1.06 0.00 0.00 27.41 28.80 1tk6 h HIS 51 CO -0.29 0.46 0.05 1.25 0.86 0.00 0.00 177.93 180.26 1tk6 h HIS 52 N 0.23 0.08 -0.45 2.45 -0.00 0.45 -1.69 115.15 116.22 1tk6 h HIS 52 Ca 0.04 0.01 -0.01 0.00 -0.00 0.00 0.00 60.37 60.41 1tk6 h HIS 52 Cb 0.53 -0.02 -0.02 0.00 -0.00 0.00 0.00 27.41 27.90 1tk6 h HIS 52 CO 0.01 0.04 0.24 -1.49 -0.00 0.00 0.00 177.93 176.73 1tk6 h TRP 53 N 0.12 0.60 -0.00 5.26 6.55 0.40 -3.31 115.95 125.56 1tk6 h TRP 53 Ca 0.06 -0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.90 1tk6 h TRP 53 Cb 0.04 -0.20 0.00 0.00 -0.86 0.00 0.00 29.16 28.14 1tk6 h TRP 53 CO -0.11 0.42 -0.64 0.09 -1.05 0.00 0.00 178.44 177.15 1tk6 n ASN 54 N -4.42 0.77 -4.77 -3.49 3.02 -0.70 -4.98 115.26 100.69 1tk6 n ASN 54 Ca 0.04 -0.89 -0.40 0.00 -0.03 0.00 0.00 54.58 53.30 1tk6 n ASN 54 Cb 0.10 0.95 -0.01 0.00 -0.61 0.00 0.00 39.78 40.21 1tk6 n ASN 54 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1tk6 s VAL 55 N -2.30 2.47 0.11 2.41 0.11 -0.66 -4.97 120.40 117.57 1tk6 s VAL 55 Ca 0.06 0.46 0.00 0.00 -2.93 0.00 0.00 61.98 59.57 1tk6 s VAL 55 Cb 0.11 -3.29 -0.04 0.00 -1.53 0.00 0.00 36.38 31.63 1tk6 s VAL 55 CO 0.57 0.10 0.00 -1.61 -3.33 0.00 0.00 175.10 170.83 1tk6 s GLU 56 N -2.03 0.88 0.00 1.54 2.02 -1.26 -4.91 118.70 114.93 1tk6 s GLU 56 Ca 0.53 -1.39 0.00 0.00 0.02 0.00 0.00 54.97 54.13 1tk6 s GLU 56 Cb -0.41 0.03 0.00 0.00 0.10 0.00 0.00 34.13 33.85 1tk6 s GLU 56 CO 0.55 -0.15 0.00 0.41 0.02 0.00 0.00 175.26 176.09 1tk6 n GLY 57 N -0.07 -0.72 0.15 -1.39 0.00 -1.26 -4.58 105.19 97.32 1tk6 n GLY 57 Ca -0.09 -2.15 -0.00 0.00 0.00 0.00 0.00 46.02 43.78 1tk6 n GLY 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tk6 h ALA 58 N 0.00 1.02 -0.62 4.61 0.00 -2.06 -1.48 119.26 120.72 1tk6 h ALA 58 Ca 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1tk6 h ALA 58 Cb 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1tk6 h ALA 58 CO 0.00 0.71 0.00 0.39 0.00 0.00 0.00 179.25 180.35 1tk6 n GLU 59 N -3.80 3.10 0.05 0.00 4.71 -1.26 -4.80 120.64 118.63 1tk6 n GLU 59 Ca -0.01 -2.64 0.04 0.00 -0.01 0.00 0.00 57.16 54.54 1tk6 n GLU 59 Cb 0.59 -1.64 0.46 0.00 -1.01 0.00 0.00 31.44 29.84 1tk6 n GLU 59 CO 0.00 0.00 0.00 0.27 0.09 0.00 0.00 177.13 177.49 1tk6 h PHE 60 N 3.74 0.41 -0.10 -0.32 -5.15 -1.51 -2.29 116.94 111.72 1tk6 h PHE 60 Ca 0.00 0.01 -0.22 0.00 -0.20 0.00 0.00 57.97 57.56 1tk6 h PHE 60 Cb 1.12 -0.14 0.01 0.00 0.22 0.00 0.00 35.95 37.15 1tk6 h PHE 60 CO 0.54 0.28 -0.80 -0.09 -2.00 0.00 0.00 178.31 176.23 1tk6 h ARG 61 N 0.44 0.63 -0.50 6.09 2.43 -1.87 0.55 114.38 122.15 1tk6 h ARG 61 Ca 0.12 -0.54 -0.07 0.00 -0.81 0.00 0.00 59.98 58.67 1tk6 h ARG 61 Cb -0.02 0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.63 1tk6 h ARG 61 CO -0.02 1.16 0.03 0.22 -1.51 0.00 0.00 179.97 179.85 1tk6 h ASP 62 N 0.42 0.84 -0.53 -3.80 1.82 -1.88 -1.69 116.42 111.59 1tk6 h ASP 62 Ca -0.06 -0.29 -0.08 0.00 -0.39 0.00 0.00 57.03 56.22 1tk6 h ASP 62 Cb 1.42 -0.22 -0.02 0.00 0.68 0.00 0.00 39.33 41.19 1tk6 h ASP 62 CO 0.15 0.92 0.04 -0.07 -1.61 0.00 0.00 179.24 178.67 1tk6 h LEU 63 N 0.73 0.89 -0.64 2.28 3.38 -1.12 -1.30 115.31 119.53 1tk6 h LEU 63 Ca 0.15 -0.29 0.05 0.00 0.09 0.00 0.00 57.88 57.88 1tk6 h LEU 63 Cb 0.47 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 40.93 1tk6 h LEU 63 CO 0.02 0.95 0.36 -0.74 0.09 0.00 0.00 178.44 179.12 1tk6 h HIS 64 N 0.79 0.67 -0.15 1.13 2.76 0.36 0.14 115.15 120.84 1tk6 h HIS 64 Ca 0.16 0.02 -0.03 0.00 -2.20 0.00 0.00 60.37 58.32 1tk6 h HIS 64 Cb 0.48 -0.21 -0.01 0.00 1.55 0.00 0.00 27.41 29.23 1tk6 h HIS 64 CO 0.04 0.34 -0.01 -0.07 -1.30 0.00 0.00 177.93 176.93 1tk6 h LEU 65 N 0.68 0.26 -0.85 0.26 3.38 -1.26 -0.41 115.31 117.38 1tk6 h LEU 65 Ca 0.28 -0.32 -0.10 0.00 0.09 0.00 0.00 57.88 57.83 1tk6 h LEU 65 Cb 0.13 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 1tk6 h LEU 65 CO -0.16 0.52 -0.18 0.15 0.09 0.00 0.00 178.44 178.86 1tk6 h PHE 66 N -0.00 0.73 -0.01 1.13 3.57 -0.75 -1.87 116.94 119.75 1tk6 h PHE 66 Ca 0.04 -0.14 -0.19 0.00 3.53 0.00 0.00 57.97 61.21 1tk6 h PHE 66 Cb 0.39 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 38.93 1tk6 h PHE 66 CO 0.04 0.79 -0.83 -0.07 -2.23 0.00 0.00 178.31 176.01 1tk6 h LEU 67 N 0.59 0.22 -0.69 0.59 3.38 -0.60 -0.16 115.31 118.63 1tk6 h LEU 67 Ca 0.09 -0.17 0.02 0.00 0.09 0.00 0.00 57.88 57.92 1tk6 h LEU 67 Cb 0.63 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 41.28 1tk6 h LEU 67 CO 0.04 0.95 0.44 1.23 0.09 0.00 0.00 178.44 181.20 1tk6 h GLY 68 N 1.89 0.99 1.04 0.83 0.00 -0.87 0.21 103.07 107.15 1tk6 h GLY 68 Ca -0.03 -0.34 -0.13 0.00 0.00 0.00 0.00 47.33 46.83 1tk6 h GLY 68 CO 0.12 0.30 -0.26 0.83 0.00 0.00 0.00 176.54 177.54 1tk6 h GLU 69 N 0.88 0.83 -0.38 4.80 5.08 -1.04 -1.55 114.58 123.19 1tk6 h GLU 69 Ca 0.27 -0.40 -0.09 0.00 -1.00 0.00 0.00 59.36 58.14 1tk6 h GLU 69 Cb -0.02 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 1tk6 h GLU 69 CO -0.09 1.04 -0.12 0.00 -1.00 0.00 0.00 179.01 178.83 1tk6 h ALA 70 N 0.78 0.53 -0.40 3.43 0.00 -0.77 -0.80 119.26 122.03 1tk6 h ALA 70 Ca 0.07 -0.33 0.08 0.00 0.00 0.00 0.00 54.91 54.74 1tk6 h ALA 70 Cb 0.83 -0.13 -0.07 0.00 0.00 0.00 0.00 17.79 18.41 1tk6 h ALA 70 CO 0.07 0.42 -0.08 0.00 0.00 0.00 0.00 179.25 179.66 1tk6 h ALA 71 N 0.82 0.29 -0.58 0.00 0.00 -0.50 -0.09 119.26 119.20 1tk6 h ALA 71 Ca 0.09 0.15 -0.04 0.00 0.00 0.00 0.00 54.91 55.11 1tk6 h ALA 71 Cb 0.65 0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.69 1tk6 h ALA 71 CO 0.04 -0.44 0.18 1.49 0.00 0.00 0.00 179.25 180.53 1tk6 h GLU 72 N 0.02 0.86 -0.74 0.00 4.81 -0.94 0.13 114.58 118.72 1tk6 h GLU 72 Ca 0.19 -0.16 -0.03 0.00 -0.13 0.00 0.00 59.36 59.24 1tk6 h GLU 72 Cb 0.29 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.50 1tk6 h GLU 72 CO -0.39 0.74 0.35 1.15 -0.73 0.00 0.00 179.01 180.13 1tk6 h THR 73 N 0.84 1.24 -0.50 0.32 2.02 -0.59 -1.38 112.91 114.86 1tk6 h THR 73 Ca 0.19 -0.69 -0.06 0.00 0.77 0.00 0.00 66.41 66.62 1tk6 h THR 73 Cb 0.24 0.32 -0.02 0.00 -1.74 0.00 0.00 68.15 66.95 1tk6 h THR 73 CO -0.01 0.29 0.07 0.00 0.37 0.00 0.00 175.52 176.24 1tk6 h ALA 74 N 1.17 0.66 -0.91 6.16 0.00 0.02 0.88 119.26 127.24 1tk6 h ALA 74 Ca 0.25 -0.24 0.02 0.00 0.00 0.00 0.00 54.91 54.95 1tk6 h ALA 74 Cb 0.13 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.68 1tk6 h ALA 74 CO -0.03 0.40 0.60 1.49 0.00 0.00 0.00 179.25 181.72 1tk6 h GLU 75 N 0.70 1.16 -0.13 0.00 4.22 -0.76 -0.05 114.58 119.73 1tk6 h GLU 75 Ca 0.15 -0.07 -0.21 0.00 0.08 0.00 0.00 59.36 59.31 1tk6 h GLU 75 Cb 0.41 -0.26 0.01 0.00 0.50 0.00 0.00 28.75 29.41 1tk6 h GLU 75 CO 0.01 0.77 -0.76 0.93 -2.18 0.00 0.00 179.01 177.78 1tk6 h GLU 76 N 1.19 0.74 -0.70 1.92 5.08 -0.81 -0.45 114.58 121.55 1tk6 h GLU 76 Ca 0.35 -0.62 -0.01 0.00 -1.00 0.00 0.00 59.36 58.08 1tk6 h GLU 76 Cb -0.06 0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.29 1tk6 h GLU 76 CO -0.09 1.23 0.40 0.28 -1.00 0.00 0.00 179.01 179.83 1tk6 h VAL 77 N 0.45 1.21 -0.29 3.13 2.07 -0.54 -2.06 116.25 120.21 1tk6 h VAL 77 Ca -0.06 -0.49 0.05 0.00 0.82 0.00 0.00 66.70 67.02 1tk6 h VAL 77 Cb 1.39 0.27 -0.05 0.00 -1.52 0.00 0.00 31.29 31.38 1tk6 h VAL 77 CO 0.16 0.22 -0.02 0.00 0.02 0.00 0.00 177.57 177.95 1tk6 h ALA 78 N 1.20 0.24 -0.62 1.67 0.00 -0.79 -0.96 119.26 120.00 1tk6 h ALA 78 Ca 0.25 0.09 0.03 0.00 0.00 0.00 0.00 54.91 55.28 1tk6 h ALA 78 Cb 0.00 0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 1tk6 h ALA 78 CO -0.04 -0.43 0.38 0.22 0.00 0.00 0.00 179.25 179.38 1tk6 h ASP 79 N 0.06 0.61 -0.63 0.00 3.58 -0.81 -0.58 116.42 118.65 1tk6 h ASP 79 Ca 0.14 0.01 -0.00 0.00 0.42 0.00 0.00 57.03 57.60 1tk6 h ASP 79 Cb 0.20 -0.12 -0.03 0.00 1.72 0.00 0.00 39.33 41.09 1tk6 h ASP 79 CO -0.26 0.42 0.38 -0.33 -2.88 0.00 0.00 179.24 176.58 1tk6 h GLU 80 N 0.74 0.85 -0.39 0.28 4.39 -1.01 -0.74 114.58 118.69 1tk6 h GLU 80 Ca 0.26 -0.07 -0.00 0.00 0.34 0.00 0.00 59.36 59.88 1tk6 h GLU 80 Cb 0.05 -0.18 -0.02 0.00 -0.10 0.00 0.00 28.75 28.50 1tk6 h GLU 80 CO -0.11 0.60 0.25 -0.07 -1.16 0.00 0.00 179.01 178.51 1tk6 h LEU 81 N 0.85 0.47 -0.30 1.33 4.07 -0.73 0.08 115.31 121.07 1tk6 h LEU 81 Ca 0.23 -0.04 -0.06 0.00 0.08 0.00 0.00 57.88 58.08 1tk6 h LEU 81 Cb -0.03 -0.12 -0.01 0.00 1.08 0.00 0.00 40.66 41.58 1tk6 h LEU 81 CO -0.04 0.37 -0.05 0.00 -1.08 0.00 0.00 178.44 177.63 1tk6 h ALA 82 N 1.12 0.42 -0.63 1.53 0.00 -0.92 0.19 119.26 120.97 1tk6 h ALA 82 Ca 0.14 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.73 1tk6 h ALA 82 Cb -0.02 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 1tk6 h ALA 82 CO -0.03 0.22 0.17 0.93 0.00 0.00 0.00 179.25 180.55 1tk6 h GLU 83 N 0.35 0.97 -0.33 0.00 5.08 -1.00 -1.91 114.58 117.75 1tk6 h GLU 83 Ca 0.08 -0.20 -0.05 0.00 -1.00 0.00 0.00 59.36 58.18 1tk6 h GLU 83 Cb 0.53 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.62 1tk6 h GLU 83 CO 0.03 0.85 -0.01 -0.09 -1.00 0.00 0.00 179.01 178.79 1tk6 h ARG 84 N 0.93 0.58 -0.75 2.33 9.65 -0.44 0.30 114.38 126.99 1tk6 h ARG 84 Ca 0.20 -0.19 0.12 0.00 -1.10 0.00 0.00 59.98 59.02 1tk6 h ARG 84 Cb 0.30 -0.05 -0.09 0.00 -1.39 0.00 0.00 29.97 28.75 1tk6 h ARG 84 CO -0.00 0.72 0.34 0.28 2.80 0.00 0.00 179.97 184.10 1tk6 h VAL 85 N 0.38 0.74 -0.19 0.20 2.07 -0.42 -0.86 116.25 118.17 1tk6 h VAL 85 Ca 0.09 -0.18 -0.20 0.00 0.82 0.00 0.00 66.70 67.23 1tk6 h VAL 85 Cb 0.46 0.16 0.00 0.00 -1.52 0.00 0.00 31.29 30.40 1tk6 h VAL 85 CO 0.02 0.10 -0.67 -0.61 0.02 0.00 0.00 177.57 176.42 1tk6 h GLN 86 N 0.53 0.73 -0.25 1.57 -0.00 -1.02 0.84 115.11 117.52 1tk6 h GLN 86 Ca 0.40 -0.54 0.03 0.00 -0.00 0.00 0.00 58.65 58.53 1tk6 h GLN 86 Cb 0.53 0.09 -0.01 0.00 0.00 0.00 0.00 27.48 28.09 1tk6 h GLN 86 CO -0.34 1.16 0.17 0.00 0.00 0.00 0.00 178.83 179.81 1tk6 h ALA 87 N 0.71 1.95 -0.18 3.38 0.00 0.90 -1.03 119.26 124.99 1tk6 h ALA 87 Ca -0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1tk6 h ALA 87 Cb 1.27 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1tk6 h ALA 87 CO 0.14 0.01 0.00 1.28 0.00 0.00 0.00 179.25 180.68 1tk6 n LEU 88 N -4.50 1.30 0.00 0.00 4.77 -0.51 -4.56 117.00 113.51 1tk6 n LEU 88 Ca 0.02 -0.59 0.00 0.00 -0.03 0.00 0.00 56.01 55.40 1tk6 n LEU 88 Cb 0.16 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 1tk6 n LEU 88 CO 0.35 0.30 0.00 0.61 -1.33 0.00 0.00 177.39 177.31 1tk6 n GLY 89 N 0.99 0.76 2.17 -0.72 0.00 -0.39 -2.11 105.19 105.90 1tk6 n GLY 89 Ca 0.13 -0.25 -0.12 0.00 0.00 0.00 0.00 46.02 45.78 1tk6 n GLY 89 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tk6 n GLY 90 N -2.42 2.13 3.02 -0.02 0.00 0.23 -1.28 105.19 106.86 1tk6 n GLY 90 Ca 0.00 -2.20 -0.31 0.00 0.00 0.00 0.00 46.02 43.51 1tk6 n GLY 90 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1tk6 s VAL 91 N -1.11 1.97 0.48 1.61 1.01 -1.25 -4.21 120.40 118.90 1tk6 s VAL 91 Ca 0.31 -1.56 -0.23 0.00 0.00 0.00 0.00 61.98 60.50 1tk6 s VAL 91 Cb -0.02 -2.16 -0.07 0.00 0.00 0.00 0.00 36.38 34.13 1tk6 s VAL 91 CO 0.19 -0.10 1.21 -2.16 0.00 0.00 0.00 175.10 174.24 1tk6 s PRO 92 N 1.18 3.60 0.31 2.72 0.04 -1.26 -4.72 135.00 136.86 1tk6 s PRO 92 Ca -0.06 1.88 -0.29 0.00 0.04 0.00 0.00 61.00 62.57 1tk6 s PRO 92 Cb -0.20 -2.36 -0.10 0.00 0.04 0.00 0.00 34.50 31.88 1tk6 s PRO 92 CO -0.06 -0.72 1.30 -1.01 0.04 0.00 0.00 177.00 176.56 1tk6 s HIS 93 N -1.49 3.10 0.04 0.56 3.76 -1.26 -4.92 115.29 115.08 1tk6 s HIS 93 Ca 0.66 1.38 0.00 0.00 -0.15 0.00 0.00 55.06 56.95 1tk6 s HIS 93 Cb -0.31 -3.66 0.00 0.00 1.11 0.00 0.00 32.58 29.72 1tk6 s HIS 93 CO 0.38 -1.84 0.00 0.00 -0.85 0.00 0.00 174.74 172.43 1tk6 n ALA 94 N 1.13 3.00 -1.74 -1.40 0.00 -1.26 -4.91 120.51 115.33 1tk6 n ALA 94 Ca 0.01 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.12 1tk6 n ALA 94 Cb 0.42 0.36 -0.02 0.00 0.00 0.00 0.00 19.45 20.21 1tk6 n ALA 94 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1tk6 s SER 95 N -5.23 6.12 0.26 0.00 1.04 -1.26 -4.82 113.70 109.81 1tk6 s SER 95 Ca 0.00 1.86 -0.04 0.00 0.48 0.00 0.00 55.95 58.25 1tk6 s SER 95 Cb 0.00 -2.54 0.34 0.00 0.10 0.00 0.00 66.02 63.92 1tk6 s SER 95 CO 0.00 -0.93 1.90 -0.65 0.98 0.00 0.00 173.24 174.54 1tk6 h PRO 96 N 1.04 1.22 -0.54 4.02 0.11 -1.99 0.50 132.00 136.36 1tk6 h PRO 96 Ca -0.48 -0.07 -0.07 0.00 0.11 0.00 0.00 66.00 65.49 1tk6 h PRO 96 Cb 1.22 -0.28 -0.02 0.00 0.11 0.00 0.00 31.00 32.03 1tk6 h PRO 96 CO 0.58 0.81 0.06 1.49 -0.21 0.00 0.00 178.00 180.73 1tk6 h GLU 97 N 1.26 0.88 -0.45 1.05 4.81 -2.00 -0.99 114.58 119.15 1tk6 h GLU 97 Ca 0.40 -0.22 -0.05 0.00 -0.13 0.00 0.00 59.36 59.36 1tk6 h GLU 97 Cb 0.02 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.28 1tk6 h GLU 97 CO -0.13 0.84 0.07 1.15 -0.73 0.00 0.00 179.01 180.21 1tk6 h THR 98 N 0.83 1.25 -0.01 0.32 2.02 -1.66 -1.14 112.91 114.51 1tk6 h THR 98 Ca 0.17 -0.90 -0.00 0.00 0.77 0.00 0.00 66.41 66.45 1tk6 h THR 98 Cb 0.41 0.97 -0.00 0.00 -1.74 0.00 0.00 68.15 67.79 1tk6 h THR 98 CO 0.01 0.31 0.01 -0.07 0.37 0.00 0.00 175.52 176.15 1tk6 h LEU 99 N 0.60 0.01 -1.05 2.58 3.38 -0.60 0.33 115.31 120.56 1tk6 h LEU 99 Ca 0.14 -0.06 -0.09 0.00 0.09 0.00 0.00 57.88 57.96 1tk6 h LEU 99 Cb 0.38 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 1tk6 h LEU 99 CO 0.01 0.07 -0.28 -0.61 0.09 0.00 0.00 178.44 177.71 1tk6 h GLN 100 N -0.04 0.32 -0.19 1.13 4.15 -1.04 -1.92 115.11 117.52 1tk6 h GLN 100 Ca 0.00 -0.12 -0.11 0.00 0.77 0.00 0.00 58.65 59.19 1tk6 h GLN 100 Cb 0.06 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 27.72 1tk6 h GLN 100 CO -0.00 0.59 -0.36 0.00 -1.93 0.00 0.00 178.83 177.12 1tk6 h ALA 101 N 1.42 1.03 -0.00 3.38 0.00 -0.79 -2.77 119.26 121.53 1tk6 h ALA 101 Ca 0.04 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.55 1tk6 h ALA 101 Cb 0.65 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1tk6 h ALA 101 CO 0.05 0.59 -0.36 0.39 0.00 0.00 0.00 179.25 179.92 1tk6 n GLU 102 N -4.05 0.13 -2.66 0.00 -0.58 0.07 -4.84 120.64 108.70 1tk6 n GLU 102 Ca -0.01 -0.07 -0.34 0.00 -0.42 0.00 0.00 57.16 56.32 1tk6 n GLU 102 Cb 0.47 -1.50 -0.05 0.00 -0.57 0.00 0.00 31.44 29.79 1tk6 n GLU 102 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1tk6 s ALA 103 N -2.92 3.00 -0.19 0.62 0.00 -0.76 -4.77 121.76 116.75 1tk6 s ALA 103 Ca 0.14 0.55 0.22 0.00 0.00 0.00 0.00 51.96 52.86 1tk6 s ALA 103 Cb 0.18 -3.21 -0.32 0.00 0.00 0.00 0.00 23.12 19.77 1tk6 s ALA 103 CO 0.64 -0.09 0.56 -1.13 0.00 0.00 0.00 175.76 175.73 1tk6 n SER 104 N -0.54 0.17 -4.78 0.00 3.41 -1.26 -4.97 113.62 105.64 1tk6 n SER 104 Ca 0.07 -0.15 -0.30 0.00 -0.26 0.00 0.00 58.87 58.23 1tk6 n SER 104 Cb 0.52 1.82 0.09 0.00 -0.26 0.00 0.00 64.21 66.38 1tk6 n SER 104 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 1tk6 s VAL 105 N -3.44 3.26 0.22 -3.33 -7.23 -1.26 -5.01 120.40 103.62 1tk6 s VAL 105 Ca -0.05 0.41 -0.29 0.00 -1.81 0.00 0.00 61.98 60.24 1tk6 s VAL 105 Cb 0.14 -3.05 -0.09 0.00 0.56 0.00 0.00 36.38 33.95 1tk6 s VAL 105 CO 0.90 -0.54 0.91 -1.81 -0.31 0.00 0.00 175.10 174.25 1tk6 s ASP 106 N -3.67 7.59 -0.03 4.85 1.01 -1.26 -5.07 116.67 120.08 1tk6 s ASP 106 Ca 0.61 1.89 0.07 0.00 0.71 0.00 0.00 52.55 55.82 1tk6 s ASP 106 Cb -0.16 -2.59 -0.01 0.00 1.01 0.00 0.00 42.92 41.17 1tk6 s ASP 106 CO 0.55 0.16 -0.23 0.68 0.21 0.00 0.00 175.17 176.54 1tk6 s VAL 107 N -1.14 1.89 0.74 -1.27 -7.23 -1.26 -4.90 120.40 107.23 1tk6 s VAL 107 Ca 0.40 -1.00 -0.15 0.00 -1.81 0.00 0.00 61.98 59.42 1tk6 s VAL 107 Cb -0.25 -1.58 0.05 0.00 0.56 0.00 0.00 36.38 35.15 1tk6 s VAL 107 CO 0.31 0.53 1.22 -1.61 -0.31 0.00 0.00 175.10 175.24 1tk6 s GLU 108 N -0.35 2.03 0.39 4.82 2.02 -1.26 -5.02 118.70 121.33 1tk6 s GLU 108 Ca 0.03 1.82 -0.07 0.00 0.02 0.00 0.00 54.97 56.78 1tk6 s GLU 108 Cb -0.11 -1.81 0.09 0.00 0.10 0.00 0.00 34.13 32.40 1tk6 s GLU 108 CO 0.01 -1.93 0.43 -0.40 0.02 0.00 0.00 175.26 173.38 1tk6 n ASP 109 N -2.77 -0.71 -0.08 -0.19 3.85 -1.26 -4.92 116.55 110.48 1tk6 n ASP 109 Ca 0.14 -0.94 0.15 0.00 -0.71 0.00 0.00 54.79 53.43 1tk6 n ASP 109 Cb 0.50 -0.36 0.84 0.00 -1.35 0.00 0.00 41.12 40.75 1tk6 n ASP 109 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 1tk6 n GLU 110 N -2.35 0.99 -1.78 0.11 -0.58 -1.26 -4.80 120.64 110.97 1tk6 n GLU 110 Ca 0.06 -0.15 -0.31 0.00 -0.42 0.00 0.00 57.16 56.33 1tk6 n GLU 110 Cb 0.21 -1.50 0.03 0.00 -0.57 0.00 0.00 31.44 29.61 1tk6 n GLU 110 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1tk6 s ASP 111 N -2.12 5.81 -0.19 1.62 1.01 -1.26 -5.04 116.67 116.50 1tk6 s ASP 111 Ca 0.42 1.42 -0.06 0.00 0.71 0.00 0.00 52.55 55.05 1tk6 s ASP 111 Cb 0.21 -2.37 -0.03 0.00 1.01 0.00 0.00 42.92 41.74 1tk6 s ASP 111 CO 0.39 -1.14 0.02 -0.69 0.21 0.00 0.00 175.17 173.95 1tk6 s VAL 112 N -3.17 4.22 0.40 -1.27 1.01 -1.26 -5.08 120.40 115.24 1tk6 s VAL 112 Ca 0.57 -0.23 0.08 0.00 0.00 0.00 0.00 61.98 62.39 1tk6 s VAL 112 Cb -0.12 -2.90 0.00 0.00 0.00 0.00 0.00 36.38 33.36 1tk6 s VAL 112 CO 0.54 0.44 0.53 -0.31 0.00 0.00 0.00 175.10 176.30 1tk6 s TYR 113 N 0.75 2.86 0.86 5.22 1.51 -1.26 -5.08 117.35 122.21 1tk6 s TYR 113 Ca 0.01 -0.37 -0.10 0.00 -1.01 0.00 0.00 57.07 55.60 1tk6 s TYR 113 Cb -0.14 -2.27 0.11 0.00 -0.11 0.00 0.00 41.96 39.55 1tk6 s TYR 113 CO 0.02 -0.30 1.12 0.16 -1.11 0.00 0.00 175.55 175.44 1tk6 s ASP 114 N -4.29 3.58 0.22 2.29 -4.77 -1.26 -4.68 116.67 107.77 1tk6 s ASP 114 Ca 0.52 2.00 -0.09 0.00 -3.30 0.00 0.00 52.55 51.69 1tk6 s ASP 114 Cb -0.09 -2.53 0.21 0.00 -1.09 0.00 0.00 42.92 39.42 1tk6 s ASP 114 CO 0.32 -2.65 1.87 -0.29 0.70 0.00 0.00 175.17 175.11 1tk6 h ILE 115 N -1.56 1.13 -0.73 2.11 6.09 -1.98 -0.35 117.51 122.22 1tk6 h ILE 115 Ca -0.44 -0.33 0.06 0.00 -1.37 0.00 0.00 64.86 62.78 1tk6 h ILE 115 Cb 1.25 0.07 -0.06 0.00 0.47 0.00 0.00 36.82 38.56 1tk6 h ILE 115 CO 0.46 0.18 0.42 0.03 -3.07 0.00 0.00 178.15 176.17 1tk6 h ARG 116 N 0.97 0.76 -0.12 2.19 3.08 -1.99 -0.15 114.38 119.12 1tk6 h ARG 116 Ca 0.30 -0.05 -0.08 0.00 0.07 0.00 0.00 59.98 60.23 1tk6 h ARG 116 Cb -0.01 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 29.87 1tk6 h ARG 116 CO -0.10 0.50 -0.23 1.15 -1.07 0.00 0.00 179.97 180.22 1tk6 h THR 117 N 0.78 1.38 -0.49 2.04 2.02 -1.79 -0.25 112.91 116.60 1tk6 h THR 117 Ca 0.32 -1.51 0.06 0.00 0.77 0.00 0.00 66.41 66.06 1tk6 h THR 117 Cb 0.17 2.07 -0.05 0.00 -1.74 0.00 0.00 68.15 68.60 1tk6 h THR 117 CO -0.17 0.44 0.19 0.28 0.37 0.00 0.00 175.52 176.62 1tk6 h SER 118 N -0.06 0.21 -0.71 4.18 0.02 -0.90 -0.38 113.55 115.90 1tk6 h SER 118 Ca 0.00 0.05 -0.04 0.00 -0.84 0.00 0.00 61.79 60.96 1tk6 h SER 118 Cb 0.82 0.03 -0.03 0.00 0.14 0.00 0.00 62.40 63.36 1tk6 h SER 118 CO 0.05 0.15 0.28 -0.07 -1.14 0.00 0.00 176.83 176.10 1tk6 h LEU 119 N 0.37 1.00 -0.67 5.07 4.07 -0.79 -1.75 115.31 122.62 1tk6 h LEU 119 Ca 0.23 -0.15 -0.10 0.00 0.08 0.00 0.00 57.88 57.94 1tk6 h LEU 119 Cb 0.23 -0.26 -0.02 0.00 1.08 0.00 0.00 40.66 41.69 1tk6 h LEU 119 CO -0.23 0.90 -0.06 0.00 -1.08 0.00 0.00 178.44 177.97 1tk6 h ALA 120 N 1.24 0.87 -0.58 1.53 0.00 -0.42 -0.00 119.26 121.90 1tk6 h ALA 120 Ca 0.24 -0.32 0.05 0.00 0.00 0.00 0.00 54.91 54.88 1tk6 h ALA 120 Cb 0.22 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 17.76 1tk6 h ALA 120 CO -0.02 0.65 0.31 -0.91 0.00 0.00 0.00 179.25 179.28 1tk6 h ASN 121 N 0.87 0.45 -0.53 0.00 2.35 -0.70 -2.11 115.58 115.91 1tk6 h ASN 121 Ca 0.15 0.03 -0.09 0.00 -0.55 0.00 0.00 56.30 55.84 1tk6 h ASN 121 Cb 0.60 -0.06 -0.02 0.00 0.05 0.00 0.00 38.32 38.89 1tk6 h ASN 121 CO 0.04 0.30 -0.01 0.44 -1.65 0.00 0.00 177.43 176.55 1tk6 h ASP 122 N 0.59 0.93 -0.81 5.81 3.32 -0.49 -2.69 116.42 123.07 1tk6 h ASP 122 Ca 0.26 -0.31 0.08 0.00 0.02 0.00 0.00 57.03 57.07 1tk6 h ASP 122 Cb 0.15 -0.25 -0.07 0.00 0.22 0.00 0.00 39.33 39.38 1tk6 h ASP 122 CO -0.17 1.01 0.48 -0.03 -1.72 0.00 0.00 179.24 178.81 1tk6 h MET 123 N 0.82 0.81 -0.67 3.56 4.05 -0.58 -0.13 114.93 122.80 1tk6 h MET 123 Ca 0.15 -0.05 -0.00 0.00 -0.28 0.00 0.00 59.70 59.52 1tk6 h MET 123 Cb 0.54 -0.18 -0.03 0.00 -0.80 0.00 0.00 31.60 31.13 1tk6 h MET 123 CO 0.03 0.54 0.41 0.00 0.23 0.00 0.00 176.91 178.12 1tk6 h ALA 124 N 1.42 0.85 -0.14 0.39 0.00 -1.16 -0.67 119.26 119.95 1tk6 h ALA 124 Ca 0.37 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.21 1tk6 h ALA 124 Cb 0.27 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1tk6 h ALA 124 CO -0.21 0.32 0.06 0.82 0.00 0.00 0.00 179.25 180.24 1tk6 h ILE 125 N 0.91 1.13 -0.63 0.00 2.04 -0.98 -1.58 117.51 118.40 1tk6 h ILE 125 Ca 0.24 -0.38 0.07 0.00 1.00 0.00 0.00 64.86 65.79 1tk6 h ILE 125 Cb -0.05 1.14 -0.06 0.00 -0.74 0.00 0.00 36.82 37.11 1tk6 h ILE 125 CO -0.05 0.12 0.31 1.88 0.00 0.00 0.00 178.15 180.41 1tk6 h TYR 126 N 0.08 0.56 -0.35 1.37 -1.99 -0.66 -1.09 116.97 114.90 1tk6 h TYR 126 Ca 0.05 0.03 -0.00 0.00 2.00 0.00 0.00 58.73 60.80 1tk6 h TYR 126 Cb 0.13 -0.16 -0.02 0.00 2.00 0.00 0.00 36.73 38.69 1tk6 h TYR 126 CO -0.02 0.23 0.20 0.78 -0.00 0.00 0.00 178.16 179.34 1tk6 h GLY 127 N 0.56 0.51 0.78 3.88 0.00 -0.91 0.73 103.07 108.63 1tk6 h GLY 127 Ca 0.30 -0.22 0.05 0.00 0.00 0.00 0.00 47.33 47.45 1tk6 h GLY 127 CO -0.23 0.21 0.46 -0.55 0.00 0.00 0.00 176.54 176.44 1tk6 h ASP 128 N 0.44 0.73 -0.26 0.19 3.32 -0.73 -1.38 116.42 118.74 1tk6 h ASP 128 Ca 0.12 0.01 -0.16 0.00 0.02 0.00 0.00 57.03 57.03 1tk6 h ASP 128 Cb 0.03 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.44 1tk6 h ASP 128 CO -0.02 0.49 -0.43 0.40 -1.72 0.00 0.00 179.24 177.95 1tk6 h ILE 129 N 0.87 1.28 -0.46 0.35 2.04 0.08 -2.39 117.51 119.29 1tk6 h ILE 129 Ca 0.32 -1.61 -0.08 0.00 1.00 0.00 0.00 64.86 64.49 1tk6 h ILE 129 Cb 0.11 1.49 -0.02 0.00 -0.74 0.00 0.00 36.82 37.66 1tk6 h ILE 129 CO -0.15 0.53 -0.01 0.40 0.00 0.00 0.00 178.15 178.92 1tk6 h ILE 130 N 0.66 1.26 -0.42 -0.67 2.04 0.98 0.72 117.51 122.08 1tk6 h ILE 130 Ca 0.04 -1.07 -0.15 0.00 1.00 0.00 0.00 64.86 64.68 1tk6 h ILE 130 Cb 1.01 1.05 -0.01 0.00 -0.74 0.00 0.00 36.82 38.13 1tk6 h ILE 130 CO 0.10 0.37 -0.32 -0.33 0.00 0.00 0.00 178.15 177.97 1tk6 h GLU 131 N 0.66 0.96 -0.96 2.37 5.08 -1.23 -1.34 114.58 120.12 1tk6 h GLU 131 Ca 0.13 -0.47 0.02 0.00 -1.00 0.00 0.00 59.36 58.04 1tk6 h GLU 131 Cb 0.52 -0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.72 1tk6 h GLU 131 CO 0.03 1.13 0.63 0.00 -1.00 0.00 0.00 179.01 179.80 1tk6 h ALA 132 N 0.81 1.25 -0.26 3.43 0.00 -1.26 -1.98 119.26 121.24 1tk6 h ALA 132 Ca 0.08 -0.06 -0.17 0.00 0.00 0.00 0.00 54.91 54.76 1tk6 h ALA 132 Cb 0.91 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1tk6 h ALA 132 CO 0.08 0.57 -0.50 1.15 0.00 0.00 0.00 179.25 180.56 1tk6 h THR 133 N 1.27 1.29 -0.49 0.00 2.02 -0.37 0.15 112.91 116.77 1tk6 h THR 133 Ca 0.37 -1.69 0.05 0.00 0.77 0.00 0.00 66.41 65.91 1tk6 h THR 133 Cb -0.08 1.72 -0.05 0.00 -1.74 0.00 0.00 68.15 67.99 1tk6 h THR 133 CO -0.10 0.54 0.21 0.03 0.37 0.00 0.00 175.52 176.58 1tk6 h ARG 134 N 0.54 0.41 -0.85 6.66 3.08 -1.13 0.45 114.38 123.54 1tk6 h ARG 134 Ca 0.01 -0.02 0.02 0.00 0.07 0.00 0.00 59.98 60.06 1tk6 h ARG 134 Cb 1.11 -0.09 -0.05 0.00 0.08 0.00 0.00 29.97 31.02 1tk6 h ARG 134 CO 0.11 0.27 0.56 0.93 -1.07 0.00 0.00 179.97 180.76 1tk6 h GLU 135 N 0.42 1.07 -0.01 0.04 5.08 -0.80 -2.67 114.58 117.71 1tk6 h GLU 135 Ca 0.23 -0.06 -0.11 0.00 -1.00 0.00 0.00 59.36 58.41 1tk6 h GLU 135 Cb 0.19 -0.24 -0.02 0.00 0.50 0.00 0.00 28.75 29.18 1tk6 h GLU 135 CO -0.20 0.71 -0.52 0.45 -1.00 0.00 0.00 179.01 178.45 1tk6 h HIS 136 N 1.10 0.03 -0.08 4.33 3.86 -0.24 -1.29 115.15 122.85 1tk6 h HIS 136 Ca 0.33 -0.01 -0.17 0.00 -1.16 0.00 0.00 60.37 59.36 1tk6 h HIS 136 Cb -0.04 -0.01 -0.01 0.00 1.06 0.00 0.00 27.41 28.41 1tk6 h HIS 136 CO -0.02 0.54 -0.68 1.79 0.86 0.00 0.00 177.93 180.43 1tk6 h THR 137 N 0.02 1.38 -0.46 2.45 1.35 -0.59 0.49 112.91 117.55 1tk6 h THR 137 Ca -0.00 -2.07 -0.00 0.00 -0.55 0.00 0.00 66.41 63.78 1tk6 h THR 137 Cb 0.93 2.05 -0.02 0.00 -1.73 0.00 0.00 68.15 69.38 1tk6 h THR 137 CO 0.07 0.62 0.28 -0.33 -0.25 0.00 0.00 175.52 175.91 1tk6 h GLU 138 N 0.26 0.63 0.23 4.72 5.08 -1.23 -1.49 114.58 122.78 1tk6 h GLU 138 Ca -0.02 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.28 1tk6 h GLU 138 Cb 1.23 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.34 1tk6 h GLU 138 CO 0.11 0.47 -0.18 1.25 -1.00 0.00 0.00 179.01 179.67 1tk6 h LEU 139 N 0.62 -0.46 -0.52 1.33 5.85 -0.84 -0.59 115.31 120.70 1tk6 h LEU 139 Ca 0.17 0.04 0.08 0.00 0.84 0.00 0.00 57.88 59.00 1tk6 h LEU 139 Cb 0.00 0.15 -0.06 0.00 0.37 0.00 0.00 40.66 41.12 1tk6 h LEU 139 CO -0.03 -0.28 0.16 0.00 -0.34 0.00 0.00 178.44 177.95 1tk6 h ALA 140 N 0.32 0.63 -0.81 1.25 0.00 -0.88 -0.30 119.26 119.47 1tk6 h ALA 140 Ca -0.01 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1tk6 h ALA 140 Cb 0.37 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.20 1tk6 h ALA 140 CO -0.01 -0.25 0.43 1.49 0.00 0.00 0.00 179.25 180.91 1tk6 h GLU 141 N 0.32 1.14 0.00 0.00 4.57 -0.84 0.30 114.58 120.07 1tk6 h GLU 141 Ca 0.26 -0.14 -0.13 0.00 -1.18 0.00 0.00 59.36 58.16 1tk6 h GLU 141 Cb 0.31 -0.22 -0.02 0.00 -0.16 0.00 0.00 28.75 28.66 1tk6 h GLU 141 CO -0.29 0.85 -0.63 -0.91 -1.18 0.00 0.00 179.01 176.85 1tk6 h ASN 142 N 1.13 0.00 0.00 1.04 -0.26 -0.53 0.36 115.58 117.32 1tk6 h ASN 142 Ca 0.28 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.02 1tk6 h ASN 142 Cb 0.06 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.32 1tk6 h ASN 142 CO -0.04 0.63 0.00 0.18 -1.06 0.00 0.00 177.43 177.14 1tk6 n LEU 143 N -3.69 0.00 -0.55 1.61 4.77 -0.18 -4.89 117.00 114.08 1tk6 n LEU 143 Ca -0.01 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 55.90 1tk6 n LEU 143 Cb 0.64 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.70 1tk6 n LEU 143 CO 0.42 0.00 -0.07 0.61 -1.33 0.00 0.00 177.39 177.02 1tk6 n GLY 144 N 0.64 0.89 3.34 -0.72 0.00 0.12 -4.93 105.19 104.52 1tk6 n GLY 144 Ca 0.13 -0.40 -0.44 0.00 0.00 0.00 0.00 46.02 45.31 1tk6 n GLY 144 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1tk6 n ASP 145 N 0.12 5.38 0.19 1.61 4.64 0.97 -4.85 116.55 124.62 1tk6 n ASP 145 Ca -0.07 -3.04 0.06 0.00 -1.38 0.00 0.00 54.79 50.36 1tk6 n ASP 145 Cb 0.30 -1.48 0.32 0.00 -1.04 0.00 0.00 41.12 39.22 1tk6 n ASP 145 CO 0.00 0.00 0.00 0.45 -0.82 0.00 0.00 177.20 176.83 1tk6 h HIS 146 N 6.72 0.00 -0.25 -0.67 3.86 -1.90 -1.90 115.15 121.02 1tk6 h HIS 146 Ca 0.28 0.00 -0.14 0.00 -1.16 0.00 0.00 60.37 59.34 1tk6 h HIS 146 Cb 0.83 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.30 1tk6 h HIS 146 CO 1.00 0.36 -0.40 0.00 0.86 0.00 0.00 177.93 179.76 1tk6 h ALA 147 N 1.64 0.38 -0.48 2.45 0.00 -1.95 -0.48 119.26 120.82 1tk6 h ALA 147 Ca -0.00 -0.45 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 1tk6 h ALA 147 Cb 0.93 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 1tk6 h ALA 147 CO 0.05 0.48 0.24 1.15 0.00 0.00 0.00 179.25 181.17 1tk6 h THR 148 N 0.43 1.18 -0.33 0.00 2.02 -1.92 0.87 112.91 115.16 1tk6 h THR 148 Ca 0.02 -0.49 -0.01 0.00 0.77 0.00 0.00 66.41 66.71 1tk6 h THR 148 Cb 0.99 0.63 -0.02 0.00 -1.74 0.00 0.00 68.15 68.02 1tk6 h THR 148 CO 0.09 0.19 0.18 0.00 0.37 0.00 0.00 175.52 176.35 1tk6 h ALA 149 N 1.09 0.43 0.06 6.16 0.00 -1.08 -0.23 119.26 125.69 1tk6 h ALA 149 Ca 0.17 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 55.02 1tk6 h ALA 149 Cb 0.09 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 1tk6 h ALA 149 CO -0.02 -0.04 -0.24 1.25 0.00 0.00 0.00 179.25 180.20 1tk6 h HIS 150 N 0.41 -0.63 -0.32 0.00 -0.00 -0.95 -0.54 115.15 113.12 1tk6 h HIS 150 Ca 0.12 0.02 0.06 0.00 -0.00 0.00 0.00 60.37 60.56 1tk6 h HIS 150 Cb 0.08 0.27 -0.06 0.00 -0.00 0.00 0.00 27.41 27.70 1tk6 h HIS 150 CO -0.03 -0.33 -0.04 1.98 -0.00 0.00 0.00 177.93 179.52 1tk6 h MET 151 N -0.40 0.05 -0.92 5.26 -1.53 -0.55 -0.96 114.93 115.87 1tk6 h MET 151 Ca 0.04 -0.00 0.06 0.00 -3.44 0.00 0.00 59.70 56.36 1tk6 h MET 151 Cb 0.45 -0.01 -0.06 0.00 -0.55 0.00 0.00 31.60 31.43 1tk6 h MET 151 CO -0.17 0.03 0.58 -0.07 0.14 0.00 0.00 176.91 177.42 1tk6 h LEU 152 N 0.05 0.93 -1.11 3.39 3.38 -0.77 -1.11 115.31 120.07 1tk6 h LEU 152 Ca 0.15 0.01 -0.08 0.00 0.09 0.00 0.00 57.88 58.06 1tk6 h LEU 152 Cb 0.22 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1tk6 h LEU 152 CO -0.29 0.60 -0.23 0.03 0.09 0.00 0.00 178.44 178.63 1tk6 h ARG 153 N 1.07 0.34 -0.27 1.13 3.08 -0.52 0.28 114.38 119.48 1tk6 h ARG 153 Ca 0.40 -0.11 -0.13 0.00 0.07 0.00 0.00 59.98 60.20 1tk6 h ARG 153 Cb 0.16 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.17 1tk6 h ARG 153 CO -0.17 0.56 -0.37 0.93 -1.07 0.00 0.00 179.97 179.85 1tk6 h GLU 154 N 0.31 0.62 -0.48 0.04 4.39 -0.10 -2.50 114.58 116.85 1tk6 h GLU 154 Ca 0.05 -0.30 -0.05 0.00 0.34 0.00 0.00 59.36 59.40 1tk6 h GLU 154 Cb 0.58 -0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.21 1tk6 h GLU 154 CO 0.04 0.89 0.11 0.78 -1.16 0.00 0.00 179.01 179.68 1tk6 h GLY 155 N 1.02 0.83 0.73 -3.84 0.00 -0.86 -3.26 103.07 97.68 1tk6 h GLY 155 Ca 0.05 -0.52 0.05 0.00 0.00 0.00 0.00 47.33 46.91 1tk6 h GLY 155 CO 0.08 0.48 0.37 -2.00 0.00 0.00 0.00 176.54 175.47 1tk6 h LEU 156 N 0.65 0.57 -1.28 3.11 5.85 -0.31 -1.51 115.31 122.39 1tk6 h LEU 156 Ca 0.15 0.02 -0.07 0.00 0.84 0.00 0.00 57.88 58.82 1tk6 h LEU 156 Cb 0.33 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 1tk6 h LEU 156 CO 0.00 0.37 -0.27 -0.29 -0.34 0.00 0.00 178.44 177.92 1tk6 h ILE 157 N 0.70 1.23 0.08 4.05 -0.00 -1.49 0.29 117.51 122.37 1tk6 h ILE 157 Ca 0.28 -1.07 -0.29 0.00 -0.00 0.00 0.00 64.86 63.79 1tk6 h ILE 157 Cb 0.14 1.46 0.03 0.00 -0.00 0.00 0.00 36.82 38.45 1tk6 h ILE 157 CO -0.16 0.32 -1.18 -0.33 -0.00 0.00 0.00 178.15 176.80 1tk6 h GLU 158 N 0.13 0.63 -0.25 2.19 4.39 -1.39 -1.56 114.58 118.74 1tk6 h GLU 158 Ca 0.02 -0.79 -0.02 0.00 0.34 0.00 0.00 59.36 58.91 1tk6 h GLU 158 Cb 0.55 0.25 -0.01 0.00 -0.10 0.00 0.00 28.75 29.44 1tk6 h GLU 158 CO 0.04 1.35 0.08 -0.07 -1.16 0.00 0.00 179.01 179.25 1tk6 h LEU 159 N 0.31 0.36 -1.43 1.33 4.07 -1.15 -2.55 115.31 116.25 1tk6 h LEU 159 Ca -0.17 -0.20 -0.01 0.00 0.08 0.00 0.00 57.88 57.58 1tk6 h LEU 159 Cb 1.85 -0.09 -0.02 0.00 1.08 0.00 0.00 40.66 43.47 1tk6 h LEU 159 CO 0.23 0.46 0.20 -0.33 -1.08 0.00 0.00 178.44 177.92 1tk6 h GLU 160 N 0.23 0.58 -0.11 1.13 5.08 -0.84 -0.11 114.58 120.54 1tk6 h GLU 160 Ca 0.08 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1tk6 h GLU 160 Cb 0.23 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 1tk6 h GLU 160 CO -0.00 0.46 0.06 0.22 -1.00 0.00 0.00 179.01 178.74 1tk6 h ASP 161 N 0.59 0.15 -0.70 1.42 -0.00 -1.13 0.38 116.42 117.12 1tk6 h ASP 161 Ca 0.15 -0.11 -0.04 0.00 -0.00 0.00 0.00 57.03 57.03 1tk6 h ASP 161 Cb 0.07 -0.04 -0.03 0.00 -0.00 0.00 0.00 39.33 39.33 1tk6 h ASP 161 CO -0.02 0.21 0.27 0.44 -0.00 0.00 0.00 179.24 180.14 1tk6 h ASP 162 N 0.07 0.97 -0.73 2.28 3.32 -1.16 -0.89 116.42 120.28 1tk6 h ASP 162 Ca 0.04 -0.18 -0.05 0.00 0.02 0.00 0.00 57.03 56.86 1tk6 h ASP 162 Cb 0.10 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.37 1tk6 h ASP 162 CO -0.01 0.88 0.26 0.00 -1.72 0.00 0.00 179.24 178.66 1tk6 h ALA 163 N 1.13 0.96 -0.49 3.45 0.00 -0.79 -1.37 119.26 122.15 1tk6 h ALA 163 Ca 0.23 -0.20 -0.13 0.00 0.00 0.00 0.00 54.91 54.81 1tk6 h ALA 163 Cb 0.22 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1tk6 h ALA 163 CO -0.02 0.60 -0.21 1.25 0.00 0.00 0.00 179.25 180.88 1tk6 h HIS 164 N 1.07 1.14 -0.77 0.00 -0.00 -0.64 -2.03 115.15 113.91 1tk6 h HIS 164 Ca 0.24 -0.27 0.06 0.00 -0.00 0.00 0.00 60.37 60.40 1tk6 h HIS 164 Cb 0.26 -0.27 -0.06 0.00 -0.00 0.00 0.00 27.41 27.34 1tk6 h HIS 164 CO 0.02 1.10 0.46 0.45 -0.00 0.00 0.00 177.93 179.96 1tk6 h HIS 165 N 0.86 0.85 -0.79 5.26 -0.00 -0.93 0.45 115.15 120.84 1tk6 h HIS 165 Ca 0.11 0.03 -0.02 0.00 -0.00 0.00 0.00 60.37 60.49 1tk6 h HIS 165 Cb 0.78 -0.27 -0.04 0.00 -0.00 0.00 0.00 27.41 27.89 1tk6 h HIS 165 CO 0.05 0.42 0.43 0.82 -0.00 0.00 0.00 177.93 179.65 1tk6 h ILE 166 N 0.84 1.24 -0.93 2.45 2.04 -0.65 -0.86 117.51 121.64 1tk6 h ILE 166 Ca 0.34 -0.60 0.08 0.00 1.00 0.00 0.00 64.86 65.68 1tk6 h ILE 166 Cb 0.19 0.19 -0.07 0.00 -0.74 0.00 0.00 36.82 36.39 1tk6 h ILE 166 CO -0.18 0.27 0.58 -0.08 0.00 0.00 0.00 178.15 178.73 1tk6 h GLU 167 N 1.10 0.98 -0.34 2.37 4.81 -0.78 -1.96 114.58 120.75 1tk6 h GLU 167 Ca 0.28 -0.06 -0.17 0.00 -0.13 0.00 0.00 59.36 59.28 1tk6 h GLU 167 Cb 0.04 -0.22 -0.00 0.00 0.63 0.00 0.00 28.75 29.20 1tk6 h GLU 167 CO -0.04 0.65 -0.45 0.45 -0.73 0.00 0.00 179.01 178.88 1tk6 h HIS 168 N 1.00 1.11 -0.20 0.92 3.86 -0.16 -2.57 115.15 119.11 1tk6 h HIS 168 Ca 0.42 -0.36 0.06 0.00 -1.16 0.00 0.00 60.37 59.33 1tk6 h HIS 168 Cb 0.27 -0.22 -0.01 0.00 1.06 0.00 0.00 27.41 28.51 1tk6 h HIS 168 CO -0.02 1.18 0.15 1.88 0.86 0.00 0.00 177.93 181.98 1tk6 h TYR 169 N 0.72 0.00 -0.01 2.45 0.05 -0.52 -2.46 116.97 117.20 1tk6 h TYR 169 Ca 0.04 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.82 1tk6 h TYR 169 Cb 1.05 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.79 1tk6 h TYR 169 CO 0.07 0.00 -0.35 1.28 -1.05 0.00 0.00 178.16 178.11 1tk6 n LEU 170 N -4.35 1.53 -4.75 3.88 4.77 -0.80 -4.97 117.00 112.31 1tk6 n LEU 170 Ca 0.02 -0.51 -0.33 0.00 -0.03 0.00 0.00 56.01 55.16 1tk6 n LEU 170 Cb 0.29 -0.06 0.08 0.00 -2.33 0.00 0.00 43.42 41.40 1tk6 n LEU 170 CO 0.34 0.28 0.73 -1.61 -1.33 0.00 0.00 177.39 175.81 1tk6 s GLU 171 N -2.47 2.36 -1.21 3.23 0.41 -0.93 -4.90 118.70 115.19 1tk6 s GLU 171 Ca 0.22 1.41 -0.07 0.00 -0.41 0.00 0.00 54.97 56.12 1tk6 s GLU 171 Cb 0.19 -1.89 0.00 0.00 -1.78 0.00 0.00 34.13 30.65 1tk6 s GLU 171 CO 0.54 -1.59 2.75 -0.40 -0.49 0.00 0.00 175.26 176.06 1tk6 n ASP 172 N -2.94 7.88 -4.01 -0.19 5.75 -1.26 -4.81 116.55 116.97 1tk6 n ASP 172 Ca 0.11 -2.89 -0.08 0.00 -0.01 0.00 0.00 54.79 51.92 1tk6 n ASP 172 Cb 0.52 -1.42 -0.10 0.00 -1.03 0.00 0.00 41.12 39.09 1tk6 n ASP 172 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1tk6 s ASP 173 N 1.15 0.33 -0.03 -1.12 -1.08 -1.26 -5.16 116.67 109.50 1tk6 s ASP 173 Ca 0.61 -0.75 -0.29 0.00 -0.52 0.00 0.00 52.55 51.61 1tk6 s ASP 173 Cb 0.22 0.19 0.10 0.00 -1.46 0.00 0.00 42.92 41.97 1tk6 s ASP 173 CO -0.09 -0.52 0.88 0.28 0.52 0.00 0.00 175.17 176.24 1tk6 s THR 174 N -3.04 0.00 -0.56 1.71 -1.32 -1.26 -5.01 115.64 106.16 1tk6 s THR 174 Ca -0.01 0.00 0.24 0.00 -1.21 0.00 0.00 61.69 60.71 1tk6 s THR 174 Cb 0.01 -1.00 0.32 0.00 -1.51 0.00 0.00 72.50 70.32 1tk6 s THR 174 CO -0.07 0.00 1.69 -0.07 -2.21 0.00 0.00 174.62 173.96 1tk6 h LEU 175 N 2.17 0.00 -9.94 9.08 3.38 -2.03 -3.46 115.31 114.50 1tk6 h LEU 175 Ca -0.22 0.00 -0.51 0.00 0.09 0.00 0.00 57.88 57.24 1tk6 h LEU 175 Cb 1.22 0.00 0.06 0.00 0.09 0.00 0.00 40.66 42.03 1tk6 h LEU 175 CO 0.32 0.00 0.53 -0.69 0.09 0.00 0.00 178.44 178.68 1tk6 s VAL 176 N -3.17 3.04 0.23 1.22 1.01 -1.26 -5.03 120.40 116.44 1tk6 s VAL 176 Ca 0.09 0.89 0.08 0.00 0.00 0.00 0.00 61.98 63.03 1tk6 s VAL 176 Cb 0.08 -3.50 -0.05 0.00 0.00 0.00 0.00 36.38 32.91 1tk6 s VAL 176 CO 0.64 0.09 -0.13 0.42 0.00 0.00 0.00 175.10 176.12 1tk6 s THR 177 N -1.38 1.74 0.27 3.92 -4.23 -1.26 -5.03 115.64 109.67 1tk6 s THR 177 Ca 0.57 -2.20 -0.01 0.00 -1.18 0.00 0.00 61.69 58.87 1tk6 s THR 177 Cb -0.32 -2.15 0.25 0.00 1.34 0.00 0.00 72.50 71.62 1tk6 s THR 177 CO 0.41 -0.51 1.81 1.56 -0.54 0.00 0.00 174.62 177.34 1tk6 h GLN 178 N 2.48 0.81 -0.87 3.99 1.08 -1.99 -1.05 115.11 119.56 1tk6 h GLN 178 Ca -0.39 -0.05 0.11 0.00 -1.45 0.00 0.00 58.65 56.87 1tk6 h GLN 178 Cb 1.23 -0.18 -0.08 0.00 -0.05 0.00 0.00 27.48 28.39 1tk6 h GLN 178 CO 0.63 0.54 0.51 0.78 -0.95 0.00 0.00 178.83 180.33 1tk6 h GLY 179 N 0.84 1.38 2.00 3.46 0.00 -2.01 -0.79 103.07 107.95 1tk6 h GLY 179 Ca 0.46 -0.33 -0.04 0.00 0.00 0.00 0.00 47.33 47.42 1tk6 h GLY 179 CO -0.29 0.11 -0.18 0.00 0.00 0.00 0.00 176.54 176.19 1tk6 h ALA 180 N 1.49 1.01 0.00 3.60 0.00 -1.61 -3.55 119.26 120.19 1tk6 h ALA 180 Ca 0.43 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.18 1tk6 h ALA 180 Cb 0.43 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1tk6 h ALA 180 CO -0.27 0.23 0.00 1.28 0.00 0.00 0.00 179.25 180.49