#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 0.08 -3.62 0.00 2.43 -2.09 -3.45 114.38 107.74 1tk6 h ARG 8 Ca 0.00 -0.05 -0.07 0.00 -0.81 0.00 0.00 59.98 59.05 1tk6 h ARG 8 Cb 0.00 0.00 -0.13 0.00 -0.42 0.00 0.00 29.97 29.43 1tk6 h ARG 8 CO 0.00 0.59 -0.21 0.00 -1.51 0.00 0.00 179.97 178.84 1tk6 s ALA 9 N -3.86 -0.51 -0.06 2.80 0.00 -1.26 -5.14 121.76 113.72 1tk6 s ALA 9 Ca -0.03 -0.43 0.05 0.00 0.00 0.00 0.00 51.96 51.56 1tk6 s ALA 9 Cb 0.13 0.68 -0.02 0.00 0.00 0.00 0.00 23.12 23.91 1tk6 s ALA 9 CO 0.76 -0.62 -0.20 0.99 0.00 0.00 0.00 175.76 176.69 1tk6 s THR 10 N -3.86 2.54 0.17 0.00 2.01 -1.26 -5.07 115.64 110.18 1tk6 s THR 10 Ca 0.07 -0.90 -0.33 0.00 0.31 0.00 0.00 61.69 60.84 1tk6 s THR 10 Cb 0.03 -1.97 -0.14 0.00 0.01 0.00 0.00 72.50 70.43 1tk6 s THR 10 CO -0.08 0.57 1.51 0.00 -0.69 0.00 0.00 174.62 175.93 1tk6 n ALA 11 N 2.71 1.08 0.00 7.40 0.00 -1.26 -1.79 120.51 128.65 1tk6 n ALA 11 Ca -0.17 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.71 1tk6 n ALA 11 Cb 0.52 -2.30 0.00 0.00 0.00 0.00 0.00 19.45 17.67 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 3.00 3.16 3.80 0.00 0.00 -1.26 -5.06 105.19 108.83 1tk6 n GLY 12 Ca 0.16 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.43 3.59 -0.06 1.61 2.02 -0.74 -4.96 118.70 119.73 1tk6 s GLU 13 Ca 0.00 1.31 -0.01 0.00 0.02 0.00 0.00 54.97 56.29 1tk6 s GLU 13 Cb 0.00 -2.07 0.03 0.00 0.10 0.00 0.00 34.13 32.19 1tk6 s GLU 13 CO 0.00 -0.60 0.01 0.08 0.02 0.00 0.00 175.26 174.77 1tk6 s VAL 14 N -2.16 0.27 -2.32 2.63 1.01 -1.26 -3.90 120.40 114.67 1tk6 s VAL 14 Ca 0.66 0.16 0.21 0.00 0.00 0.00 0.00 61.98 63.01 1tk6 s VAL 14 Cb -0.17 -0.43 0.09 0.00 0.00 0.00 0.00 36.38 35.87 1tk6 s VAL 14 CO 0.27 0.23 1.11 -1.84 0.00 0.00 0.00 175.10 174.87 1tk6 n GLU 15 N 4.99 1.72 0.00 2.72 0.28 -0.69 -4.80 120.64 124.86 1tk6 n GLU 15 Ca -0.10 -1.40 0.00 0.00 -0.16 0.00 0.00 57.16 55.51 1tk6 n GLU 15 Cb 0.50 -1.42 0.00 0.00 1.43 0.00 0.00 31.44 31.95 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 1.28 0.32 3.10 -1.84 0.00 -1.11 -4.30 105.19 102.64 1tk6 n GLY 16 Ca 0.11 -0.93 -0.12 0.00 0.00 0.00 0.00 46.02 45.08 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 -0.25 0.12 1.61 0.15 -0.22 -3.53 113.70 107.57 1tk6 s SER 17 Ca 0.00 0.62 -0.17 0.00 0.70 0.00 0.00 55.95 57.10 1tk6 s SER 17 Cb 0.00 0.53 -0.04 0.00 -1.71 0.00 0.00 66.02 64.81 1tk6 s SER 17 CO 0.00 -0.18 1.66 0.44 1.20 0.00 0.00 173.24 176.35 1tk6 h ASP 18 N 7.32 0.46 -0.38 5.45 3.32 -1.89 -0.09 116.42 130.62 1tk6 h ASP 18 Ca -0.37 -0.18 0.02 0.00 0.02 0.00 0.00 57.03 56.52 1tk6 h ASP 18 Cb 1.16 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 40.56 1tk6 h ASP 18 CO 0.33 0.51 0.22 0.00 -1.72 0.00 0.00 179.24 178.58 1tk6 h ALA 19 N 0.97 0.47 -0.26 3.45 0.00 -1.96 -1.97 119.26 119.97 1tk6 h ALA 19 Ca 0.11 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1tk6 h ALA 19 Cb 0.20 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1tk6 h ALA 19 CO -0.01 -0.12 0.00 1.28 0.00 0.00 0.00 179.25 180.41 1tk6 n LEU 20 N -4.87 1.63 -3.94 0.00 4.77 -1.22 -4.93 117.00 108.43 1tk6 n LEU 20 Ca 0.01 -0.77 -0.25 0.00 -0.03 0.00 0.00 56.01 54.97 1tk6 n LEU 20 Cb 0.06 -0.17 -0.02 0.00 -2.33 0.00 0.00 43.42 40.96 1tk6 n LEU 20 CO 0.33 0.38 -0.23 0.54 -1.33 0.00 0.00 177.39 177.08 1tk6 n ARG 21 N 0.35 -3.33 -3.96 3.23 5.12 -0.74 -4.95 116.66 112.37 1tk6 n ARG 21 Ca 0.13 0.41 -0.31 0.00 -1.93 0.00 0.00 57.85 56.15 1tk6 n ARG 21 Cb 0.28 -4.54 -0.15 0.00 -1.16 0.00 0.00 32.46 26.89 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 -6.53 1.65 0.70 5.56 1.75 -0.10 -5.02 119.30 117.32 1tk6 s MET 22 Ca 0.00 -1.21 -0.16 0.00 -1.25 0.00 0.00 55.69 53.07 1tk6 s MET 22 Cb -0.00 -2.70 0.02 0.00 2.84 0.00 0.00 34.83 34.99 1tk6 s MET 22 CO 0.89 -0.68 1.26 0.16 -0.65 0.00 0.00 175.02 175.99 1tk6 s ASP 23 N 1.27 4.28 0.44 1.11 -4.77 -1.26 -1.06 116.67 116.68 1tk6 s ASP 23 Ca -0.03 2.51 0.13 0.00 -3.30 0.00 0.00 52.55 51.87 1tk6 s ASP 23 Cb -0.19 -2.61 1.03 0.00 -1.09 0.00 0.00 42.92 40.07 1tk6 s ASP 23 CO -0.08 -2.22 2.01 0.00 0.70 0.00 0.00 175.17 175.58 1tk6 h ALA 24 N 0.04 1.98 -0.07 2.11 0.00 -1.87 -0.76 119.26 120.69 1tk6 h ALA 24 Ca -0.49 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.40 1tk6 h ALA 24 Cb 1.32 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 19.02 1tk6 h ALA 24 CO 0.51 -0.09 0.04 0.22 0.00 0.00 0.00 179.25 179.93 1tk6 h ASP 25 N 0.39 0.09 -0.42 0.00 1.82 -1.91 0.15 116.42 116.54 1tk6 h ASP 25 Ca 0.23 -0.09 -0.02 0.00 -0.39 0.00 0.00 57.03 56.76 1tk6 h ASP 25 Cb 0.42 -0.02 -0.02 0.00 0.68 0.00 0.00 39.33 40.39 1tk6 h ASP 25 CO -0.06 0.15 0.17 -0.09 -1.61 0.00 0.00 179.24 177.80 1tk6 h ARG 26 N 0.02 0.62 -0.35 0.28 2.43 -1.84 -3.18 114.38 112.36 1tk6 h ARG 26 Ca 0.02 -0.11 -0.10 0.00 -0.81 0.00 0.00 59.98 58.99 1tk6 h ARG 26 Cb 0.08 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.52 1tk6 h ARG 26 CO -0.00 0.58 -0.16 0.00 -1.51 0.00 0.00 179.97 178.88 1tk6 h ALA 27 N 1.01 0.49 -0.88 2.80 0.00 -1.10 -3.08 119.26 118.50 1tk6 h ALA 27 Ca 0.14 -0.34 0.12 0.00 0.00 0.00 0.00 54.91 54.83 1tk6 h ALA 27 Cb 0.19 -0.12 -0.08 0.00 0.00 0.00 0.00 17.79 17.77 1tk6 h ALA 27 CO -0.01 0.40 0.50 1.49 0.00 0.00 0.00 179.25 181.63 1tk6 h GLU 28 N 0.50 0.75 -0.25 0.00 4.81 -0.95 0.35 114.58 119.80 1tk6 h GLU 28 Ca 0.08 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.26 1tk6 h GLU 28 Cb 0.69 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.89 1tk6 h GLU 28 CO 0.05 0.50 0.12 1.96 -0.73 0.00 0.00 179.01 180.91 1tk6 h GLN 29 N 0.78 0.35 -0.54 1.92 4.20 -1.52 -0.79 115.11 119.50 1tk6 h GLN 29 Ca 0.45 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 59.11 1tk6 h GLN 29 Cb 0.52 -0.07 -0.03 0.00 0.30 0.00 0.00 27.48 28.21 1tk6 h GLN 29 CO -0.30 0.34 0.31 0.00 -0.67 0.00 0.00 178.83 178.51 1tk6 h VAL 31 N 0.73 1.17 -0.78 0.00 2.07 -0.12 0.18 116.25 119.49 1tk6 h VAL 31 Ca 0.19 -0.37 -0.03 0.00 0.82 0.00 0.00 66.70 67.31 1tk6 h VAL 31 Cb 0.03 0.36 -0.04 0.00 -1.52 0.00 0.00 31.29 30.11 1tk6 h VAL 31 CO -0.03 0.17 0.37 0.44 0.02 0.00 0.00 177.57 178.55 1tk6 h ASP 32 N 0.80 1.02 -0.26 0.57 3.32 -1.12 0.18 116.42 120.92 1tk6 h ASP 32 Ca 0.21 -0.12 -0.13 0.00 0.02 0.00 0.00 57.03 57.01 1tk6 h ASP 32 Cb -0.03 -0.26 -0.00 0.00 0.22 0.00 0.00 39.33 39.26 1tk6 h ASP 32 CO -0.04 0.86 -0.36 0.00 -1.72 0.00 0.00 179.24 177.98 1tk6 h ALA 33 N 1.30 0.39 -0.46 3.45 0.00 -1.22 -2.82 119.26 119.90 1tk6 h ALA 33 Ca 0.27 -0.44 -0.08 0.00 0.00 0.00 0.00 54.91 54.66 1tk6 h ALA 33 Cb 0.11 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1tk6 h ALA 33 CO -0.03 0.46 -0.05 -0.07 0.00 0.00 0.00 179.25 179.56 1tk6 h LEU 34 N 0.42 0.77 -0.68 0.00 3.38 -0.14 -1.62 115.31 117.44 1tk6 h LEU 34 Ca 0.03 -0.20 -0.14 0.00 0.09 0.00 0.00 57.88 57.65 1tk6 h LEU 34 Cb 0.95 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.48 1tk6 h LEU 34 CO 0.08 0.86 -0.57 -1.13 0.09 0.00 0.00 178.44 177.77 1tk6 h ASN 35 N 0.73 0.31 -0.28 -0.43 -0.73 -0.69 0.14 115.58 114.62 1tk6 h ASN 35 Ca 0.13 -0.17 -0.16 0.00 1.87 0.00 0.00 56.30 57.98 1tk6 h ASN 35 Cb 0.51 -0.09 -0.01 0.00 0.27 0.00 0.00 38.32 39.01 1tk6 h ASN 35 CO 0.03 0.81 -0.42 0.00 -0.37 0.00 0.00 177.43 177.48 1tk6 h ALA 36 N 1.19 0.61 -0.19 1.57 0.00 -1.15 -2.43 119.26 118.87 1tk6 h ALA 36 Ca -0.00 -0.47 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 1tk6 h ALA 36 Cb 1.07 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 1tk6 h ALA 36 CO 0.09 0.67 0.09 -0.44 0.00 0.00 0.00 179.25 179.66 1tk6 h ASP 37 N 0.68 0.25 -0.55 0.00 3.32 -0.91 -2.84 116.42 116.37 1tk6 h ASP 37 Ca 0.05 -0.14 0.11 0.00 0.02 0.00 0.00 57.03 57.07 1tk6 h ASP 37 Cb 1.00 -0.06 -0.10 0.00 0.22 0.00 0.00 39.33 40.39 1tk6 h ASP 37 CO 0.10 0.32 -0.08 0.25 -1.72 0.00 0.00 179.24 178.11 1tk6 h LEU 38 N 0.16 -0.39 -0.62 1.55 5.85 -0.60 0.25 115.31 121.52 1tk6 h LEU 38 Ca 0.06 0.15 0.01 0.00 0.84 0.00 0.00 57.88 58.95 1tk6 h LEU 38 Cb 0.14 0.30 -0.03 0.00 0.37 0.00 0.00 40.66 41.43 1tk6 h LEU 38 CO -0.01 -0.14 0.41 0.00 -0.34 0.00 0.00 178.44 178.35 1tk6 h ALA 39 N 1.53 0.79 -0.41 1.25 0.00 -1.36 0.41 119.26 121.47 1tk6 h ALA 39 Ca 0.27 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 55.01 1tk6 h ALA 39 Cb 0.43 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1tk6 h ALA 39 CO -0.52 0.20 -0.29 -0.91 0.00 0.00 0.00 179.25 177.73 1tk6 h ASN 40 N 0.82 0.92 -0.33 0.00 2.35 -1.16 -2.24 115.58 115.94 1tk6 h ASN 40 Ca 0.23 -0.37 -0.08 0.00 -0.55 0.00 0.00 56.30 55.53 1tk6 h ASN 40 Cb -0.07 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.02 1tk6 h ASN 40 CO -0.06 1.14 -0.06 0.58 -1.65 0.00 0.00 177.43 177.38 1tk6 h VAL 41 N 0.75 1.25 -0.10 2.81 2.07 0.41 -0.04 116.25 123.40 1tk6 h VAL 41 Ca 0.08 -1.06 -0.20 0.00 0.82 0.00 0.00 66.70 66.34 1tk6 h VAL 41 Cb 0.85 0.98 0.00 0.00 -1.52 0.00 0.00 31.29 31.60 1tk6 h VAL 41 CO 0.07 0.37 -0.75 1.88 0.02 0.00 0.00 177.57 179.16 1tk6 h TYR 42 N 0.68 0.72 -0.47 1.57 0.99 -0.93 0.23 116.97 119.75 1tk6 h TYR 42 Ca 0.13 -0.32 -0.04 0.00 2.00 0.00 0.00 58.73 60.50 1tk6 h TYR 42 Cb 0.51 -0.11 -0.02 0.00 1.00 0.00 0.00 36.73 38.11 1tk6 h TYR 42 CO 0.02 1.10 0.13 -0.39 -0.00 0.00 0.00 178.16 179.02 1tk6 h VAL 43 N 0.36 1.20 -0.25 -2.88 -1.51 -1.28 -0.93 116.25 110.96 1tk6 h VAL 43 Ca -0.04 -0.70 0.02 0.00 -1.23 0.00 0.00 66.70 64.75 1tk6 h VAL 43 Cb 1.35 0.71 -0.02 0.00 -2.13 0.00 0.00 31.29 31.20 1tk6 h VAL 43 CO 0.14 0.26 0.12 0.25 -1.23 0.00 0.00 177.57 177.10 1tk6 h LEU 44 N 0.68 0.17 -0.48 4.19 5.85 -0.29 -1.50 115.31 123.93 1tk6 h LEU 44 Ca 0.16 0.01 0.08 0.00 0.84 0.00 0.00 57.88 58.97 1tk6 h LEU 44 Cb 0.23 -0.02 -0.07 0.00 0.37 0.00 0.00 40.66 41.18 1tk6 h LEU 44 CO -0.01 0.13 0.11 0.22 -0.34 0.00 0.00 178.44 178.55 1tk6 h TYR 45 N 0.25 0.17 -0.16 1.25 3.20 -0.78 0.17 116.97 121.08 1tk6 h TYR 45 Ca 0.10 0.03 -0.06 0.00 3.14 0.00 0.00 58.73 61.94 1tk6 h TYR 45 Cb 0.03 -0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.29 1tk6 h TYR 45 CO -0.10 0.01 -0.19 0.45 -1.64 0.00 0.00 178.16 176.69 1tk6 h HIS 46 N 0.24 0.28 0.06 -3.82 3.86 -0.74 -1.38 115.15 113.66 1tk6 h HIS 46 Ca 0.24 -0.04 -0.28 0.00 -1.16 0.00 0.00 60.37 59.13 1tk6 h HIS 46 Cb 0.31 -0.08 -0.02 0.00 1.06 0.00 0.00 27.41 28.68 1tk6 h HIS 46 CO -0.22 0.45 -1.44 0.37 0.86 0.00 0.00 177.93 177.95 1tk6 h GLN 47 N 0.25 0.13 -0.81 2.45 4.15 -0.38 -2.18 115.11 118.71 1tk6 h GLN 47 Ca 0.05 -0.22 -0.04 0.00 0.77 0.00 0.00 58.65 59.20 1tk6 h GLN 47 Cb 0.48 0.08 -0.04 0.00 0.21 0.00 0.00 27.48 28.21 1tk6 h GLN 47 CO 0.03 0.95 0.35 -0.07 -1.93 0.00 0.00 178.83 178.16 1tk6 h LEU 48 N 0.04 1.09 0.10 -2.39 3.38 -0.48 0.60 115.31 117.64 1tk6 h LEU 48 Ca -0.20 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 57.61 1tk6 h LEU 48 Cb 1.95 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 42.42 1tk6 h LEU 48 CO 0.13 0.95 -0.05 0.11 0.09 0.00 0.00 178.44 179.67 1tk6 h LYS 49 N 1.17 -0.13 -0.31 1.13 1.79 -1.21 0.51 116.57 119.51 1tk6 h LYS 49 Ca 0.27 0.01 0.07 0.00 -2.18 0.00 0.00 60.65 58.82 1tk6 h LYS 49 Cb 0.17 0.03 -0.07 0.00 -1.58 0.00 0.00 32.23 30.78 1tk6 h LYS 49 CO -0.03 -0.09 -0.17 -0.22 -1.08 0.00 0.00 179.45 177.87 1tk6 h LYS 50 N -0.14 -0.12 -0.29 3.15 3.64 -1.09 0.23 116.57 121.95 1tk6 h LYS 50 Ca -0.01 0.01 -0.07 0.00 -1.27 0.00 0.00 60.65 59.31 1tk6 h LYS 50 Cb 0.11 0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 31.94 1tk6 h LYS 50 CO 0.02 -0.08 -0.11 0.45 -2.27 0.00 0.00 179.45 177.47 1tk6 h HIS 51 N -0.13 0.52 -0.58 1.91 3.86 -0.05 -1.82 115.15 118.86 1tk6 h HIS 51 Ca 0.16 -0.07 -0.05 0.00 -1.16 0.00 0.00 60.37 59.25 1tk6 h HIS 51 Cb 0.37 -0.14 -0.02 0.00 1.06 0.00 0.00 27.41 28.68 1tk6 h HIS 51 CO -0.37 0.59 0.16 1.25 0.86 0.00 0.00 177.93 180.42 1tk6 h HIS 52 N 0.46 0.96 -0.36 2.45 -0.00 0.18 -0.44 115.15 118.39 1tk6 h HIS 52 Ca 0.09 -0.11 -0.07 0.00 -0.00 0.00 0.00 60.37 60.28 1tk6 h HIS 52 Cb 0.47 -0.27 -0.02 0.00 -0.00 0.00 0.00 27.41 27.58 1tk6 h HIS 52 CO 0.02 0.81 -0.07 -1.49 -0.00 0.00 0.00 177.93 177.20 1tk6 h TRP 53 N 0.83 0.65 0.00 5.26 6.55 -0.10 -3.33 115.95 125.80 1tk6 h TRP 53 Ca 0.18 -0.09 0.00 0.00 0.95 0.00 0.00 58.89 59.93 1tk6 h TRP 53 Cb 0.32 -0.18 0.00 0.00 -0.86 0.00 0.00 29.16 28.44 1tk6 h TRP 53 CO 0.02 0.66 -0.71 0.09 -1.05 0.00 0.00 178.44 177.45 1tk6 n ASN 54 N -4.22 0.71 -4.74 -3.49 3.02 -0.73 -4.98 115.26 100.83 1tk6 n ASN 54 Ca 0.01 -0.82 -0.42 0.00 -0.03 0.00 0.00 54.58 53.33 1tk6 n ASN 54 Cb 0.31 1.02 -0.01 0.00 -0.61 0.00 0.00 39.78 40.49 1tk6 n ASN 54 CO 0.00 0.00 0.00 0.55 -2.62 0.00 0.00 177.26 175.19 1tk6 n VAL 55 N -1.36 1.85 -3.99 2.41 3.14 -0.21 -4.97 118.33 115.20 1tk6 n VAL 55 Ca 0.03 -0.46 -0.08 0.00 -2.96 0.00 0.00 64.34 60.86 1tk6 n VAL 55 Cb 0.23 -1.81 -0.09 0.00 -1.06 0.00 0.00 33.84 31.11 1tk6 n VAL 55 CO 0.00 0.00 0.00 -1.61 -6.46 0.00 0.00 176.83 168.76 1tk6 s GLU 56 N -1.78 0.65 0.00 1.45 2.02 -1.26 -4.91 118.70 114.86 1tk6 s GLU 56 Ca 0.56 -1.02 0.00 0.00 0.02 0.00 0.00 54.97 54.52 1tk6 s GLU 56 Cb -0.52 0.25 0.00 0.00 0.10 0.00 0.00 34.13 33.96 1tk6 s GLU 56 CO 0.61 -0.16 0.00 0.41 0.02 0.00 0.00 175.26 176.14 1tk6 n GLY 57 N 0.27 -0.80 0.24 -1.39 0.00 -1.26 -4.56 105.19 97.70 1tk6 n GLY 57 Ca -0.16 -2.16 0.01 0.00 0.00 0.00 0.00 46.02 43.71 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 1.40 -0.55 4.61 0.00 -2.06 -0.21 119.26 122.45 1tk6 h ALA 58 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1tk6 h ALA 58 Cb 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1tk6 h ALA 58 CO 0.00 0.41 0.00 0.39 0.00 0.00 0.00 179.25 180.05 1tk6 n GLU 59 N -4.24 3.93 0.22 0.00 4.71 -1.26 -4.78 120.64 119.23 1tk6 n GLU 59 Ca -0.00 -2.92 0.09 0.00 -0.01 0.00 0.00 57.16 54.32 1tk6 n GLU 59 Cb 0.30 -1.97 0.51 0.00 -1.01 0.00 0.00 31.44 29.27 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 3.61 0.00 0.14 -0.32 -5.15 -1.27 -2.70 116.94 111.25 1tk6 h PHE 60 Ca 0.00 0.00 -0.21 0.00 -0.20 0.00 0.00 57.97 57.56 1tk6 h PHE 60 Cb 1.57 0.00 0.02 0.00 0.22 0.00 0.00 35.95 37.77 1tk6 h PHE 60 CO 0.80 0.24 -0.89 -0.09 -2.00 0.00 0.00 178.31 176.37 1tk6 h ARG 61 N 0.00 0.36 -0.74 6.09 2.43 -1.86 0.59 114.38 121.24 1tk6 h ARG 61 Ca -0.00 -0.57 -0.01 0.00 -0.81 0.00 0.00 59.98 58.58 1tk6 h ARG 61 Cb 0.64 0.21 -0.04 0.00 -0.42 0.00 0.00 29.97 30.36 1tk6 h ARG 61 CO 0.03 1.26 0.42 0.22 -1.51 0.00 0.00 179.97 180.38 1tk6 h ASP 62 N -0.24 0.91 -0.56 -3.80 1.82 -1.94 -1.83 116.42 110.79 1tk6 h ASP 62 Ca -0.15 -0.07 -0.08 0.00 -0.39 0.00 0.00 57.03 56.34 1tk6 h ASP 62 Cb 1.68 -0.23 -0.02 0.00 0.68 0.00 0.00 39.33 41.44 1tk6 h ASP 62 CO 0.17 0.73 0.02 -0.07 -1.61 0.00 0.00 179.24 178.48 1tk6 h LEU 63 N 1.04 0.95 -0.65 2.28 3.38 -1.45 -1.43 115.31 119.42 1tk6 h LEU 63 Ca 0.26 -0.30 0.05 0.00 0.09 0.00 0.00 57.88 57.99 1tk6 h LEU 63 Cb 0.01 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 40.46 1tk6 h LEU 63 CO -0.04 1.01 0.37 -0.74 0.09 0.00 0.00 178.44 179.12 1tk6 h HIS 64 N 0.86 0.67 -0.17 1.13 2.76 -0.49 0.10 115.15 120.01 1tk6 h HIS 64 Ca 0.16 0.02 -0.04 0.00 -2.20 0.00 0.00 60.37 58.31 1tk6 h HIS 64 Cb 0.51 -0.21 -0.00 0.00 1.55 0.00 0.00 27.41 29.26 1tk6 h HIS 64 CO 0.04 0.33 -0.05 -0.07 -1.30 0.00 0.00 177.93 176.88 1tk6 h LEU 65 N 0.68 0.34 -0.13 0.26 3.38 -1.32 -0.48 115.31 118.04 1tk6 h LEU 65 Ca 0.29 -0.38 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1tk6 h LEU 65 Cb 0.16 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 1tk6 h LEU 65 CO -0.17 0.64 0.07 0.15 0.09 0.00 0.00 178.44 179.23 1tk6 h PHE 66 N 0.03 0.14 -0.12 1.13 3.57 -1.09 -1.54 116.94 119.05 1tk6 h PHE 66 Ca 0.04 0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.46 1tk6 h PHE 66 Cb 0.50 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 39.19 1tk6 h PHE 66 CO 0.06 0.08 -0.31 -0.07 -2.23 0.00 0.00 178.31 175.84 1tk6 h LEU 67 N 0.15 0.24 -0.49 0.59 3.38 -0.76 0.14 115.31 118.56 1tk6 h LEU 67 Ca 0.05 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 1tk6 h LEU 67 Cb -0.00 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 1tk6 h LEU 67 CO -0.02 0.55 0.25 1.23 0.09 0.00 0.00 178.44 180.53 1tk6 h GLY 68 N 1.05 0.76 1.05 0.83 0.00 -0.89 -0.79 103.07 105.08 1tk6 h GLY 68 Ca 0.03 -0.37 -0.12 0.00 0.00 0.00 0.00 47.33 46.87 1tk6 h GLY 68 CO 0.05 0.35 -0.19 0.83 0.00 0.00 0.00 176.54 177.58 1tk6 h GLU 69 N 0.66 0.90 -0.70 4.80 5.08 -0.69 -2.12 114.58 122.50 1tk6 h GLU 69 Ca 0.17 -0.38 -0.01 0.00 -1.00 0.00 0.00 59.36 58.14 1tk6 h GLU 69 Cb 0.10 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.29 1tk6 h GLU 69 CO -0.02 1.03 0.40 0.00 -1.00 0.00 0.00 179.01 179.42 1tk6 h ALA 70 N 0.84 0.89 -0.86 3.43 0.00 -0.58 -0.19 119.26 122.79 1tk6 h ALA 70 Ca 0.10 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1tk6 h ALA 70 Cb 0.75 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 18.22 1tk6 h ALA 70 CO 0.06 0.40 0.55 0.00 0.00 0.00 0.00 179.25 180.26 1tk6 h ALA 71 N 1.20 1.10 -0.53 0.00 0.00 -1.01 0.17 119.26 120.19 1tk6 h ALA 71 Ca 0.25 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 1tk6 h ALA 71 Cb 0.02 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.43 1tk6 h ALA 71 CO -0.04 0.52 0.05 1.49 0.00 0.00 0.00 179.25 181.27 1tk6 h GLU 72 N 1.18 0.87 -0.30 0.00 4.81 -0.68 0.14 114.58 120.60 1tk6 h GLU 72 Ca 0.31 -0.23 -0.10 0.00 -0.13 0.00 0.00 59.36 59.22 1tk6 h GLU 72 Cb -0.10 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.16 1tk6 h GLU 72 CO -0.06 0.84 -0.19 1.15 -0.73 0.00 0.00 179.01 180.02 1tk6 h THR 73 N 0.82 1.30 -0.97 0.32 2.02 -0.24 -1.85 112.91 114.30 1tk6 h THR 73 Ca 0.16 -1.31 0.05 0.00 0.77 0.00 0.00 66.41 66.08 1tk6 h THR 73 Cb 0.43 1.49 -0.06 0.00 -1.74 0.00 0.00 68.15 68.27 1tk6 h THR 73 CO 0.01 0.42 0.64 0.00 0.37 0.00 0.00 175.52 176.96 1tk6 h ALA 74 N 0.74 1.40 -0.24 6.16 0.00 -0.29 -1.26 119.26 125.77 1tk6 h ALA 74 Ca 0.06 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.84 1tk6 h ALA 74 Cb 0.72 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1tk6 h ALA 74 CO 0.05 0.49 -0.26 1.49 0.00 0.00 0.00 179.25 181.03 1tk6 h GLU 75 N 1.19 0.47 -0.23 0.00 4.81 -0.06 0.13 114.58 120.90 1tk6 h GLU 75 Ca 0.40 -0.18 -0.19 0.00 -0.13 0.00 0.00 59.36 59.26 1tk6 h GLU 75 Cb 0.07 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.42 1tk6 h GLU 75 CO -0.14 0.69 -0.62 0.93 -0.73 0.00 0.00 179.01 179.14 1tk6 h GLU 76 N 0.41 0.79 -0.64 1.92 5.08 -0.87 0.59 114.58 121.86 1tk6 h GLU 76 Ca 0.06 -0.54 -0.06 0.00 -1.00 0.00 0.00 59.36 57.82 1tk6 h GLU 76 Cb 0.67 0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.98 1tk6 h GLU 76 CO 0.05 1.17 0.17 0.28 -1.00 0.00 0.00 179.01 179.68 1tk6 h VAL 77 N 0.58 1.25 -0.76 3.13 2.07 -0.95 -1.24 116.25 120.34 1tk6 h VAL 77 Ca -0.01 -0.91 0.02 0.00 0.82 0.00 0.00 66.70 66.62 1tk6 h VAL 77 Cb 1.23 0.62 -0.04 0.00 -1.52 0.00 0.00 31.29 31.58 1tk6 h VAL 77 CO 0.13 0.34 0.50 0.00 0.02 0.00 0.00 177.57 178.56 1tk6 h ALA 78 N 1.06 0.98 -0.25 1.67 0.00 -0.35 -1.14 119.26 121.23 1tk6 h ALA 78 Ca 0.20 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 1tk6 h ALA 78 Cb 0.34 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1tk6 h ALA 78 CO -0.00 0.35 0.12 0.22 0.00 0.00 0.00 179.25 179.94 1tk6 h ASP 79 N 1.00 0.32 -0.41 0.00 3.58 -0.68 -0.25 116.42 119.99 1tk6 h ASP 79 Ca 0.29 -0.13 -0.02 0.00 0.42 0.00 0.00 57.03 57.59 1tk6 h ASP 79 Cb -0.07 -0.08 -0.02 0.00 1.72 0.00 0.00 39.33 40.88 1tk6 h ASP 79 CO -0.08 0.36 0.16 -0.33 -2.88 0.00 0.00 179.24 176.48 1tk6 h GLU 80 N 0.27 0.61 -0.58 0.28 4.39 -0.98 -0.68 114.58 117.89 1tk6 h GLU 80 Ca 0.08 -0.11 0.08 0.00 0.34 0.00 0.00 59.36 59.76 1tk6 h GLU 80 Cb 0.12 -0.10 -0.07 0.00 -0.10 0.00 0.00 28.75 28.61 1tk6 h GLU 80 CO -0.01 0.57 0.23 -0.07 -1.16 0.00 0.00 179.01 178.57 1tk6 h LEU 81 N 0.51 0.25 -0.21 1.33 4.07 -1.02 -1.64 115.31 118.61 1tk6 h LEU 81 Ca 0.14 0.07 -0.14 0.00 0.08 0.00 0.00 57.88 58.02 1tk6 h LEU 81 Cb 0.19 0.04 0.00 0.00 1.08 0.00 0.00 40.66 41.96 1tk6 h LEU 81 CO -0.01 0.16 -0.42 0.00 -1.08 0.00 0.00 178.44 177.08 1tk6 h ALA 82 N 1.38 0.34 -0.48 1.53 0.00 -0.75 -0.28 119.26 120.99 1tk6 h ALA 82 Ca 0.28 -0.46 -0.05 0.00 0.00 0.00 0.00 54.91 54.68 1tk6 h ALA 82 Cb 0.32 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1tk6 h ALA 82 CO -0.27 0.45 0.08 0.93 0.00 0.00 0.00 179.25 180.44 1tk6 h GLU 83 N 0.36 0.75 -0.44 0.00 5.08 -1.09 -1.62 114.58 117.62 1tk6 h GLU 83 Ca 0.01 -0.16 -0.14 0.00 -1.00 0.00 0.00 59.36 58.07 1tk6 h GLU 83 Cb 1.03 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.16 1tk6 h GLU 83 CO 0.09 0.70 -0.26 -0.09 -1.00 0.00 0.00 179.01 178.45 1tk6 h ARG 84 N 0.72 0.95 -0.50 2.33 9.65 -1.04 -0.34 114.38 126.14 1tk6 h ARG 84 Ca 0.15 -0.44 0.10 0.00 -1.10 0.00 0.00 59.98 58.70 1tk6 h ARG 84 Cb 0.32 -0.02 -0.10 0.00 -1.39 0.00 0.00 29.97 28.79 1tk6 h ARG 84 CO 0.00 1.10 -0.13 0.28 2.80 0.00 0.00 179.97 184.02 1tk6 h VAL 85 N 0.79 0.48 -0.22 0.20 2.07 -0.83 -1.32 116.25 117.43 1tk6 h VAL 85 Ca 0.09 0.00 -0.18 0.00 0.82 0.00 0.00 66.70 67.43 1tk6 h VAL 85 Cb 0.84 0.48 -0.00 0.00 -1.52 0.00 0.00 31.29 31.10 1tk6 h VAL 85 CO 0.07 0.00 -0.58 -0.61 0.02 0.00 0.00 177.57 176.48 1tk6 h GLN 86 N -0.01 0.69 -0.33 1.57 -0.00 -1.02 -1.27 115.11 114.75 1tk6 h GLN 86 Ca 0.24 -0.46 -0.00 0.00 -0.00 0.00 0.00 58.65 58.43 1tk6 h GLN 86 Cb 0.38 0.06 -0.02 0.00 0.00 0.00 0.00 27.48 27.90 1tk6 h GLN 86 CO -0.52 1.08 0.19 0.00 0.00 0.00 0.00 178.83 179.57 1tk6 h ALA 87 N 0.82 1.70 -0.15 3.38 0.00 -0.70 -1.62 119.26 122.70 1tk6 h ALA 87 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1tk6 h ALA 87 Cb 1.16 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.81 1tk6 h ALA 87 CO 0.12 0.26 0.00 1.28 0.00 0.00 0.00 179.25 180.90 1tk6 n LEU 88 N -4.45 0.87 0.00 0.00 4.77 -0.53 -4.57 117.00 113.09 1tk6 n LEU 88 Ca 0.02 -0.42 0.00 0.00 -0.03 0.00 0.00 56.01 55.58 1tk6 n LEU 88 Cb 0.09 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.08 1tk6 n LEU 88 CO 0.36 0.21 0.00 0.61 -1.33 0.00 0.00 177.39 177.24 1tk6 n GLY 89 N 0.80 0.61 3.64 -0.72 0.00 -0.61 -2.76 105.19 106.15 1tk6 n GLY 89 Ca 0.08 -0.61 -0.19 0.00 0.00 0.00 0.00 46.02 45.30 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 -2.65 2.04 3.12 -0.02 0.00 -0.52 -1.71 105.19 105.45 1tk6 n GLY 90 Ca 0.00 -2.23 -0.33 0.00 0.00 0.00 0.00 46.02 43.46 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 -2.38 2.58 0.43 1.61 1.01 -1.25 -4.10 120.40 118.31 1tk6 s VAL 91 Ca 0.54 -1.50 -0.25 0.00 0.00 0.00 0.00 61.98 60.77 1tk6 s VAL 91 Cb -0.04 -2.50 -0.08 0.00 0.00 0.00 0.00 36.38 33.76 1tk6 s VAL 91 CO 0.34 -0.06 1.24 -2.16 0.00 0.00 0.00 175.10 174.46 1tk6 s PRO 92 N 1.18 3.83 0.29 2.72 0.04 -1.26 -4.71 135.00 137.09 1tk6 s PRO 92 Ca -0.07 2.00 -0.29 0.00 0.04 0.00 0.00 61.00 62.67 1tk6 s PRO 92 Cb -0.20 -2.59 -0.10 0.00 0.04 0.00 0.00 34.50 31.65 1tk6 s PRO 92 CO -0.03 -0.55 1.45 -1.01 0.04 0.00 0.00 177.00 176.90 1tk6 s HIS 93 N -1.37 2.91 0.00 0.56 3.76 -1.26 -4.91 115.29 114.97 1tk6 s HIS 93 Ca 0.60 1.07 0.00 0.00 -0.15 0.00 0.00 55.06 56.58 1tk6 s HIS 93 Cb -0.34 -3.87 0.00 0.00 1.11 0.00 0.00 32.58 29.47 1tk6 s HIS 93 CO 0.43 -2.75 0.00 0.00 -0.85 0.00 0.00 174.74 171.57 1tk6 n ALA 94 N 1.76 2.81 -1.87 -1.40 0.00 -1.26 -4.91 120.51 115.64 1tk6 n ALA 94 Ca 0.05 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.16 1tk6 n ALA 94 Cb 0.40 0.43 -0.07 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 -4.78 6.93 0.20 0.00 1.04 -1.26 -4.83 113.70 111.00 1tk6 s SER 95 Ca 0.00 1.63 -0.11 0.00 0.48 0.00 0.00 55.95 57.95 1tk6 s SER 95 Cb 0.00 -2.52 0.23 0.00 0.10 0.00 0.00 66.02 63.84 1tk6 s SER 95 CO 0.00 -0.32 1.75 -0.65 0.98 0.00 0.00 173.24 175.00 1tk6 h PRO 96 N 2.03 0.39 -0.29 4.02 0.11 -1.98 0.11 132.00 136.39 1tk6 h PRO 96 Ca -0.49 -0.02 -0.09 0.00 0.11 0.00 0.00 66.00 65.51 1tk6 h PRO 96 Cb 1.18 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 1tk6 h PRO 96 CO 0.62 0.26 -0.20 1.05 -0.21 0.00 0.00 178.00 179.52 1tk6 h GLU 97 N 0.40 0.54 -0.57 1.05 4.11 -2.00 -1.18 114.58 116.94 1tk6 h GLU 97 Ca 0.28 -0.19 -0.03 0.00 0.07 0.00 0.00 59.36 59.49 1tk6 h GLU 97 Cb 0.32 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.50 1tk6 h GLU 97 CO -0.27 0.71 0.23 1.15 0.07 0.00 0.00 179.01 180.89 1tk6 h THR 98 N 0.48 1.22 -0.47 -1.06 2.02 -1.68 -1.57 112.91 111.86 1tk6 h THR 98 Ca 0.08 -0.70 -0.00 0.00 0.77 0.00 0.00 66.41 66.56 1tk6 h THR 98 Cb 0.61 0.62 -0.02 0.00 -1.74 0.00 0.00 68.15 67.62 1tk6 h THR 98 CO 0.04 0.27 0.28 -0.07 0.37 0.00 0.00 175.52 176.41 1tk6 h LEU 99 N 0.78 0.56 -0.62 2.58 3.38 -0.32 0.12 115.31 121.79 1tk6 h LEU 99 Ca 0.19 -0.06 -0.14 0.00 0.09 0.00 0.00 57.88 57.96 1tk6 h LEU 99 Cb 0.20 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 1tk6 h LEU 99 CO -0.02 0.46 -0.45 -0.61 0.09 0.00 0.00 178.44 177.92 1tk6 h GLN 100 N 0.62 0.57 -0.22 1.13 4.15 -1.07 -2.05 115.11 118.23 1tk6 h GLN 100 Ca 0.17 -0.31 -0.10 0.00 0.77 0.00 0.00 58.65 59.17 1tk6 h GLN 100 Cb 0.01 0.02 -0.01 0.00 0.21 0.00 0.00 27.48 27.70 1tk6 h GLN 100 CO -0.03 0.90 -0.31 0.00 -1.93 0.00 0.00 178.83 177.47 1tk6 h ALA 101 N 1.05 1.07 -0.00 3.38 0.00 -0.79 -2.46 119.26 121.52 1tk6 h ALA 101 Ca 0.03 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1tk6 h ALA 101 Cb 0.96 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.64 1tk6 h ALA 101 CO 0.09 0.57 -0.36 0.39 0.00 0.00 0.00 179.25 179.94 1tk6 n GLU 102 N -4.09 0.11 -2.40 0.00 -0.58 0.37 -4.86 120.64 109.18 1tk6 n GLU 102 Ca -0.01 -0.06 -0.35 0.00 -0.42 0.00 0.00 57.16 56.33 1tk6 n GLU 102 Cb 0.43 -1.50 -0.02 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 -2.93 2.80 -0.59 0.62 0.00 -0.79 -4.82 121.76 116.06 1tk6 s ALA 103 Ca 0.14 0.73 0.19 0.00 0.00 0.00 0.00 51.96 53.01 1tk6 s ALA 103 Cb 0.18 -3.31 -0.23 0.00 0.00 0.00 0.00 23.12 19.76 1tk6 s ALA 103 CO 0.64 -0.53 0.66 -1.13 0.00 0.00 0.00 175.76 175.40 1tk6 n SER 104 N -1.07 0.79 -4.84 0.00 3.41 -1.26 -4.97 113.62 105.68 1tk6 n SER 104 Ca 0.10 -0.62 -0.32 0.00 -0.26 0.00 0.00 58.87 57.77 1tk6 n SER 104 Cb 0.51 1.29 -0.01 0.00 -0.26 0.00 0.00 64.21 65.75 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 -2.94 4.45 0.24 -3.33 -7.23 -1.26 -5.03 120.40 105.30 1tk6 s VAL 105 Ca 0.02 1.01 -0.26 0.00 -1.81 0.00 0.00 61.98 60.95 1tk6 s VAL 105 Cb 0.13 -3.69 -0.09 0.00 0.56 0.00 0.00 36.38 33.29 1tk6 s VAL 105 CO 0.77 -0.83 0.86 -1.81 -0.31 0.00 0.00 175.10 173.79 1tk6 s ASP 106 N -3.45 7.39 -0.05 4.85 1.01 -1.26 -5.07 116.67 120.09 1tk6 s ASP 106 Ca 0.58 1.75 0.04 0.00 0.71 0.00 0.00 52.55 55.63 1tk6 s ASP 106 Cb -0.11 -2.54 -0.00 0.00 1.01 0.00 0.00 42.92 41.27 1tk6 s ASP 106 CO 0.41 0.09 -0.18 0.54 0.21 0.00 0.00 175.17 176.24 1tk6 s VAL 107 N -1.35 1.53 0.71 -1.27 0.11 -1.26 -4.87 120.40 113.99 1tk6 s VAL 107 Ca 0.43 -0.76 -0.16 0.00 -2.93 0.00 0.00 61.98 58.56 1tk6 s VAL 107 Cb -0.22 -1.32 0.01 0.00 -1.53 0.00 0.00 36.38 33.33 1tk6 s VAL 107 CO 0.26 0.44 1.10 -0.62 -3.33 0.00 0.00 175.10 172.95 1tk6 n GLU 108 N 3.26 0.64 -1.09 1.54 1.02 -1.26 -5.03 120.64 119.73 1tk6 n GLU 108 Ca -0.19 0.28 -0.20 0.00 -0.02 0.00 0.00 57.16 57.03 1tk6 n GLU 108 Cb 0.53 -2.35 0.15 0.00 -0.02 0.00 0.00 31.44 29.75 1tk6 n GLU 108 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1tk6 n ASP 109 N -1.98 -0.50 -0.15 1.62 5.75 -1.26 -4.92 116.55 115.11 1tk6 n ASP 109 Ca 0.14 -1.20 0.15 0.00 -0.01 0.00 0.00 54.79 53.87 1tk6 n ASP 109 Cb 0.49 -0.68 0.73 0.00 -1.03 0.00 0.00 41.12 40.64 1tk6 n ASP 109 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1tk6 n GLU 110 N -3.15 1.03 -1.56 0.11 -0.58 -1.26 -4.73 120.64 110.49 1tk6 n GLU 110 Ca 0.11 -0.30 -0.29 0.00 -0.42 0.00 0.00 57.16 56.26 1tk6 n GLU 110 Cb 0.39 -1.49 0.11 0.00 -0.57 0.00 0.00 31.44 29.88 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 -2.18 3.97 -0.17 1.62 1.01 -1.26 -5.05 116.67 114.61 1tk6 s ASP 111 Ca 0.39 1.09 -0.02 0.00 0.71 0.00 0.00 52.55 54.72 1tk6 s ASP 111 Cb 0.21 -1.73 -0.01 0.00 1.01 0.00 0.00 42.92 42.40 1tk6 s ASP 111 CO 0.40 -2.28 -0.08 -0.69 0.21 0.00 0.00 175.17 172.73 1tk6 s VAL 112 N -3.24 3.34 0.33 -1.27 1.01 -1.26 -5.08 120.40 114.23 1tk6 s VAL 112 Ca 0.62 -0.54 0.08 0.00 0.00 0.00 0.00 61.98 62.14 1tk6 s VAL 112 Cb -0.14 -2.46 -0.03 0.00 0.00 0.00 0.00 36.38 33.74 1tk6 s VAL 112 CO 0.53 0.48 0.26 -0.31 0.00 0.00 0.00 175.10 176.06 1tk6 s TYR 113 N 0.80 2.87 1.03 5.22 1.51 -1.26 -5.10 117.35 122.42 1tk6 s TYR 113 Ca -0.03 -0.31 -0.12 0.00 -1.01 0.00 0.00 57.07 55.60 1tk6 s TYR 113 Cb -0.15 -1.75 0.21 0.00 -0.11 0.00 0.00 41.96 40.16 1tk6 s TYR 113 CO 0.01 0.23 1.07 0.16 -1.11 0.00 0.00 175.55 175.91 1tk6 s ASP 114 N -3.96 2.22 0.28 2.29 -4.77 -1.26 -4.71 116.67 106.76 1tk6 s ASP 114 Ca 0.40 1.50 0.02 0.00 -3.30 0.00 0.00 52.55 51.18 1tk6 s ASP 114 Cb -0.05 -2.19 0.40 0.00 -1.09 0.00 0.00 42.92 39.99 1tk6 s ASP 114 CO 0.26 -3.43 1.72 -0.29 0.70 0.00 0.00 175.17 174.12 1tk6 h ILE 115 N -2.09 1.27 -0.28 2.11 6.09 -1.98 -1.74 117.51 120.89 1tk6 h ILE 115 Ca -0.55 -1.29 -0.01 0.00 -1.37 0.00 0.00 64.86 61.65 1tk6 h ILE 115 Cb 1.31 1.37 -0.01 0.00 0.47 0.00 0.00 36.82 39.96 1tk6 h ILE 115 CO 0.52 0.41 0.14 0.03 -3.07 0.00 0.00 178.15 176.18 1tk6 h ARG 116 N 0.42 0.39 -0.50 2.19 3.08 -1.99 0.09 114.38 118.06 1tk6 h ARG 116 Ca 0.06 -0.05 -0.05 0.00 0.07 0.00 0.00 59.98 60.00 1tk6 h ARG 116 Cb 0.68 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.64 1tk6 h ARG 116 CO 0.05 0.37 0.11 1.15 -1.07 0.00 0.00 179.97 180.58 1tk6 h THR 117 N 0.32 1.24 -0.29 2.04 2.02 -1.87 0.23 112.91 116.60 1tk6 h THR 117 Ca 0.10 -0.87 -0.02 0.00 0.77 0.00 0.00 66.41 66.39 1tk6 h THR 117 Cb 0.10 0.85 -0.01 0.00 -1.74 0.00 0.00 68.15 67.35 1tk6 h THR 117 CO -0.01 0.31 0.12 0.28 0.37 0.00 0.00 175.52 176.59 1tk6 h SER 118 N 0.69 0.40 -0.53 4.18 0.02 -1.01 -0.76 113.55 116.55 1tk6 h SER 118 Ca 0.16 -0.16 -0.06 0.00 -0.84 0.00 0.00 61.79 60.89 1tk6 h SER 118 Cb 0.35 -0.10 -0.03 0.00 0.14 0.00 0.00 62.40 62.76 1tk6 h SER 118 CO 0.00 0.45 0.11 -0.07 -1.14 0.00 0.00 176.83 176.19 1tk6 h LEU 119 N 0.33 0.85 -0.81 5.07 4.07 -0.71 -1.45 115.31 122.65 1tk6 h LEU 119 Ca 0.10 -0.17 -0.08 0.00 0.08 0.00 0.00 57.88 57.80 1tk6 h LEU 119 Cb 0.17 -0.22 -0.02 0.00 1.08 0.00 0.00 40.66 41.67 1tk6 h LEU 119 CO -0.01 0.85 -0.02 0.00 -1.08 0.00 0.00 178.44 178.17 1tk6 h ALA 120 N 1.26 1.01 -0.69 1.53 0.00 -0.67 0.37 119.26 122.06 1tk6 h ALA 120 Ca 0.18 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 1tk6 h ALA 120 Cb 0.35 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 1tk6 h ALA 120 CO 0.00 0.61 0.39 -0.91 0.00 0.00 0.00 179.25 179.34 1tk6 h ASN 121 N 0.80 0.85 -0.31 0.00 2.35 -0.56 -2.42 115.58 116.28 1tk6 h ASN 121 Ca 0.15 -0.06 -0.14 0.00 -0.55 0.00 0.00 56.30 55.69 1tk6 h ASN 121 Cb 0.51 -0.21 -0.00 0.00 0.05 0.00 0.00 38.32 38.66 1tk6 h ASN 121 CO 0.03 0.68 -0.36 0.44 -1.65 0.00 0.00 177.43 176.57 1tk6 h ASP 122 N 0.96 0.86 -0.98 5.81 3.32 0.01 -2.88 116.42 123.52 1tk6 h ASP 122 Ca 0.25 -0.48 0.04 0.00 0.02 0.00 0.00 57.03 56.85 1tk6 h ASP 122 Cb 0.01 -0.24 -0.06 0.00 0.22 0.00 0.00 39.33 39.26 1tk6 h ASP 122 CO -0.04 1.17 0.64 -0.03 -1.72 0.00 0.00 179.24 179.26 1tk6 h MET 123 N 0.57 1.21 -0.59 3.56 4.05 -0.00 0.56 114.93 124.28 1tk6 h MET 123 Ca 0.04 -0.07 -0.08 0.00 -0.28 0.00 0.00 59.70 59.31 1tk6 h MET 123 Cb 0.94 -0.27 -0.02 0.00 -0.80 0.00 0.00 31.60 31.45 1tk6 h MET 123 CO 0.09 0.80 0.06 0.00 0.23 0.00 0.00 176.91 178.09 1tk6 h ALA 124 N 1.40 0.79 -0.34 0.39 0.00 -1.33 -1.11 119.26 119.05 1tk6 h ALA 124 Ca 0.39 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 55.04 1tk6 h ALA 124 Cb -0.00 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1tk6 h ALA 124 CO -0.12 0.57 0.20 0.82 0.00 0.00 0.00 179.25 180.71 1tk6 h ILE 125 N 0.89 1.04 -0.68 0.00 2.04 -0.98 -1.90 117.51 117.93 1tk6 h ILE 125 Ca 0.17 -0.14 0.09 0.00 1.00 0.00 0.00 64.86 65.99 1tk6 h ILE 125 Cb 0.47 0.59 -0.07 0.00 -0.74 0.00 0.00 36.82 37.07 1tk6 h ILE 125 CO 0.02 0.07 0.31 1.88 0.00 0.00 0.00 178.15 180.44 1tk6 h TYR 126 N 0.41 0.56 -0.60 1.37 -1.99 -0.63 -1.23 116.97 114.85 1tk6 h TYR 126 Ca 0.13 0.03 -0.04 0.00 2.00 0.00 0.00 58.73 60.86 1tk6 h TYR 126 Cb -0.00 -0.15 -0.03 0.00 2.00 0.00 0.00 36.73 38.55 1tk6 h TYR 126 CO -0.07 0.19 0.23 0.78 -0.00 0.00 0.00 178.16 179.29 1tk6 h GLY 127 N 0.54 0.97 1.01 3.88 0.00 -0.72 0.69 103.07 109.44 1tk6 h GLY 127 Ca 0.34 -0.54 0.00 0.00 0.00 0.00 0.00 47.33 47.14 1tk6 h GLY 127 CO -0.28 0.50 0.58 -0.55 0.00 0.00 0.00 176.54 176.79 1tk6 h ASP 128 N 0.84 1.04 -0.45 0.19 5.19 -0.89 -1.34 116.42 121.00 1tk6 h ASP 128 Ca 0.20 -0.04 -0.14 0.00 -0.62 0.00 0.00 57.03 56.43 1tk6 h ASP 128 Cb 0.22 -0.26 -0.01 0.00 0.18 0.00 0.00 39.33 39.45 1tk6 h ASP 128 CO -0.01 0.77 -0.28 0.40 -3.12 0.00 0.00 179.24 177.00 1tk6 h ILE 129 N 1.22 1.27 -0.53 0.35 2.04 -0.29 -1.91 117.51 119.65 1tk6 h ILE 129 Ca 0.32 -1.45 -0.01 0.00 1.00 0.00 0.00 64.86 64.73 1tk6 h ILE 129 Cb -0.11 1.21 -0.03 0.00 -0.74 0.00 0.00 36.82 37.15 1tk6 h ILE 129 CO -0.07 0.49 0.30 0.40 0.00 0.00 0.00 178.15 179.27 1tk6 h ILE 130 N 0.83 1.18 -0.23 -0.67 2.04 0.83 -1.05 117.51 120.44 1tk6 h ILE 130 Ca 0.09 -0.45 -0.08 0.00 1.00 0.00 0.00 64.86 65.42 1tk6 h ILE 130 Cb 0.86 0.50 -0.00 0.00 -0.74 0.00 0.00 36.82 37.44 1tk6 h ILE 130 CO 0.08 0.19 -0.18 -0.33 0.00 0.00 0.00 178.15 177.91 1tk6 h GLU 131 N 0.72 0.53 -0.93 2.37 5.08 -1.17 -1.94 114.58 119.24 1tk6 h GLU 131 Ca 0.19 -0.26 -0.00 0.00 -1.00 0.00 0.00 59.36 58.28 1tk6 h GLU 131 Cb 0.04 -0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.25 1tk6 h GLU 131 CO -0.03 0.83 0.56 0.00 -1.00 0.00 0.00 179.01 179.37 1tk6 h ALA 132 N 0.69 1.18 -0.60 3.43 0.00 -1.26 -2.32 119.26 120.39 1tk6 h ALA 132 Ca 0.04 -0.10 -0.10 0.00 0.00 0.00 0.00 54.91 54.75 1tk6 h ALA 132 Cb 0.71 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 1tk6 h ALA 132 CO 0.05 0.63 -0.01 1.15 0.00 0.00 0.00 179.25 181.07 1tk6 h THR 133 N 1.27 1.26 -0.45 0.00 2.02 -0.93 0.70 112.91 116.79 1tk6 h THR 133 Ca 0.33 -1.16 0.06 0.00 0.77 0.00 0.00 66.41 66.41 1tk6 h THR 133 Cb -0.06 0.81 -0.05 0.00 -1.74 0.00 0.00 68.15 67.11 1tk6 h THR 133 CO -0.06 0.42 0.15 0.03 0.37 0.00 0.00 175.52 176.42 1tk6 h ARG 134 N 0.96 0.30 -0.69 6.66 3.08 -1.19 0.65 114.38 124.16 1tk6 h ARG 134 Ca 0.17 -0.02 -0.07 0.00 0.07 0.00 0.00 59.98 60.13 1tk6 h ARG 134 Cb 0.57 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.52 1tk6 h ARG 134 CO 0.03 0.20 0.15 0.93 -1.07 0.00 0.00 179.97 180.21 1tk6 h GLU 135 N 0.31 1.11 -0.05 0.04 5.08 -0.78 -2.91 114.58 117.38 1tk6 h GLU 135 Ca 0.21 -0.27 -0.10 0.00 -1.00 0.00 0.00 59.36 58.20 1tk6 h GLU 135 Cb 0.23 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 1tk6 h GLU 135 CO -0.23 0.99 -0.44 0.45 -1.00 0.00 0.00 179.01 178.77 1tk6 h HIS 136 N 1.05 0.14 -0.45 4.33 3.86 -0.54 -0.99 115.15 122.54 1tk6 h HIS 136 Ca 0.21 -0.04 -0.13 0.00 -1.16 0.00 0.00 60.37 59.26 1tk6 h HIS 136 Cb 0.39 -0.03 -0.01 0.00 1.06 0.00 0.00 27.41 28.81 1tk6 h HIS 136 CO 0.03 0.54 -0.22 1.79 0.86 0.00 0.00 177.93 180.93 1tk6 h THR 137 N 0.10 1.27 -0.70 2.45 1.35 -0.69 -0.17 112.91 116.52 1tk6 h THR 137 Ca 0.01 -1.37 -0.05 0.00 -0.55 0.00 0.00 66.41 64.45 1tk6 h THR 137 Cb 0.82 1.15 -0.03 0.00 -1.73 0.00 0.00 68.15 68.37 1tk6 h THR 137 CO 0.06 0.47 0.25 -0.33 -0.25 0.00 0.00 175.52 175.72 1tk6 h GLU 138 N 0.79 1.06 -0.24 4.72 5.08 -1.28 -0.44 114.58 124.27 1tk6 h GLU 138 Ca 0.10 -0.21 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 1tk6 h GLU 138 Cb 0.77 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.84 1tk6 h GLU 138 CO 0.06 0.90 0.15 1.25 -1.00 0.00 0.00 179.01 180.37 1tk6 h LEU 139 N 1.01 0.28 -0.77 1.33 5.85 -0.79 -0.78 115.31 121.44 1tk6 h LEU 139 Ca 0.23 -0.03 0.03 0.00 0.84 0.00 0.00 57.88 58.96 1tk6 h LEU 139 Cb 0.25 -0.07 -0.05 0.00 0.37 0.00 0.00 40.66 41.16 1tk6 h LEU 139 CO -0.01 0.22 0.49 0.00 -0.34 0.00 0.00 178.44 178.80 1tk6 h ALA 140 N 1.07 1.02 -0.54 1.25 0.00 -0.48 -1.18 119.26 120.40 1tk6 h ALA 140 Ca 0.09 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.86 1tk6 h ALA 140 Cb -0.01 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 1tk6 h ALA 140 CO -0.02 0.29 -0.10 0.93 0.00 0.00 0.00 179.25 180.35 1tk6 h GLU 141 N 0.95 1.02 0.00 0.00 4.39 -0.56 0.20 114.58 120.58 1tk6 h GLU 141 Ca 0.31 -0.37 -0.10 0.00 0.34 0.00 0.00 59.36 59.54 1tk6 h GLU 141 Cb 0.03 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.60 1tk6 h GLU 141 CO -0.12 1.06 -0.48 -0.91 -1.16 0.00 0.00 179.01 177.39 1tk6 h ASN 142 N 0.91 0.00 0.15 1.42 -0.26 -0.78 0.20 115.58 117.23 1tk6 h ASN 142 Ca 0.14 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.88 1tk6 h ASN 142 Cb 0.66 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.92 1tk6 h ASN 142 CO 0.05 0.48 0.00 0.18 -1.06 0.00 0.00 177.43 177.08 1tk6 n LEU 143 N -3.64 0.00 0.00 1.61 4.77 -0.48 -4.88 117.00 114.38 1tk6 n LEU 143 Ca -0.01 0.10 0.00 0.00 -0.03 0.00 0.00 56.01 56.07 1tk6 n LEU 143 Cb 0.56 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.55 1tk6 n LEU 143 CO 0.39 -0.02 0.00 0.61 -1.33 0.00 0.00 177.39 177.04 1tk6 n GLY 144 N 0.60 0.46 3.08 -0.72 0.00 0.71 -4.94 105.19 104.37 1tk6 n GLY 144 Ca 0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.15 4.94 0.20 1.61 4.64 0.68 -4.80 116.55 123.67 1tk6 n ASP 145 Ca 0.00 -3.02 0.09 0.00 -1.38 0.00 0.00 54.79 50.48 1tk6 n ASP 145 Cb 0.07 -1.56 0.28 0.00 -1.04 0.00 0.00 41.12 38.88 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 6.34 0.00 -0.28 -0.67 3.86 -1.90 -2.15 115.15 120.36 1tk6 h HIS 146 Ca 0.40 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.59 1tk6 h HIS 146 Cb 0.72 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.18 1tk6 h HIS 146 CO 1.26 0.24 0.08 0.00 0.86 0.00 0.00 177.93 180.36 1tk6 h ALA 147 N 1.76 0.36 -0.47 2.45 0.00 -1.95 -0.85 119.26 120.56 1tk6 h ALA 147 Ca -0.00 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 1tk6 h ALA 147 Cb 0.98 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 1tk6 h ALA 147 CO 0.03 0.00 0.29 1.15 0.00 0.00 0.00 179.25 180.72 1tk6 h THR 148 N 0.28 1.14 -0.35 0.00 2.02 -1.89 -0.52 112.91 113.60 1tk6 h THR 148 Ca 0.09 -0.31 0.03 0.00 0.77 0.00 0.00 66.41 66.99 1tk6 h THR 148 Cb 0.26 0.50 -0.03 0.00 -1.74 0.00 0.00 68.15 67.14 1tk6 h THR 148 CO -0.00 0.14 0.15 0.00 0.37 0.00 0.00 175.52 176.18 1tk6 h ALA 149 N 1.14 0.42 0.30 6.16 0.00 -1.33 0.92 119.26 126.87 1tk6 h ALA 149 Ca 0.17 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 1tk6 h ALA 149 Cb -0.02 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1tk6 h ALA 149 CO -0.03 -0.23 -0.21 1.25 0.00 0.00 0.00 179.25 180.02 1tk6 h HIS 150 N 0.32 -0.56 -0.67 0.00 -0.00 -1.02 -1.39 115.15 111.82 1tk6 h HIS 150 Ca 0.15 -0.00 0.12 0.00 -0.00 0.00 0.00 60.37 60.64 1tk6 h HIS 150 Cb 0.09 0.21 -0.09 0.00 -0.00 0.00 0.00 27.41 27.62 1tk6 h HIS 150 CO -0.12 -0.33 0.22 1.98 -0.00 0.00 0.00 177.93 179.69 1tk6 h MET 151 N -0.51 0.36 -0.86 5.26 -1.53 -0.89 -1.51 114.93 115.25 1tk6 h MET 151 Ca -0.02 -0.02 0.01 0.00 -3.44 0.00 0.00 59.70 56.23 1tk6 h MET 151 Cb 0.44 -0.08 -0.04 0.00 -0.55 0.00 0.00 31.60 31.37 1tk6 h MET 151 CO 0.01 0.24 0.57 -0.07 0.14 0.00 0.00 176.91 177.79 1tk6 h LEU 152 N 0.37 0.97 -0.54 3.39 3.38 -0.65 -0.59 115.31 121.64 1tk6 h LEU 152 Ca 0.36 -0.02 -0.16 0.00 0.09 0.00 0.00 57.88 58.14 1tk6 h LEU 152 Cb 0.52 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 1tk6 h LEU 152 CO -0.38 0.70 -0.70 0.03 0.09 0.00 0.00 178.44 178.17 1tk6 h ARG 153 N 1.14 0.18 -0.19 1.13 3.08 -0.55 0.16 114.38 119.33 1tk6 h ARG 153 Ca 0.32 -0.15 -0.10 0.00 0.07 0.00 0.00 59.98 60.12 1tk6 h ARG 153 Cb -0.10 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 29.97 1tk6 h ARG 153 CO -0.08 0.81 -0.32 0.93 -1.07 0.00 0.00 179.97 180.24 1tk6 h GLU 154 N 0.12 0.38 -0.13 0.04 4.39 -0.81 -2.48 114.58 116.09 1tk6 h GLU 154 Ca -0.02 -0.16 -0.04 0.00 0.34 0.00 0.00 59.36 59.49 1tk6 h GLU 154 Cb 1.25 -0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 29.88 1tk6 h GLU 154 CO 0.10 0.66 -0.06 0.78 -1.16 0.00 0.00 179.01 179.34 1tk6 h GLY 155 N 1.08 0.29 0.75 -3.84 0.00 -0.67 -3.29 103.07 97.39 1tk6 h GLY 155 Ca 0.04 -0.26 0.05 0.00 0.00 0.00 0.00 47.33 47.16 1tk6 h GLY 155 CO 0.06 0.24 0.46 -2.00 0.00 0.00 0.00 176.54 175.30 1tk6 h LEU 156 N -0.08 0.73 -1.50 3.11 5.85 -0.45 -0.94 115.31 122.02 1tk6 h LEU 156 Ca 0.03 0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.71 1tk6 h LEU 156 Cb 0.53 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.41 1tk6 h LEU 156 CO 0.02 0.48 -0.24 -0.29 -0.34 0.00 0.00 178.44 178.07 1tk6 h ILE 157 N 0.86 0.84 0.24 4.05 2.10 -1.54 0.34 117.51 124.41 1tk6 h ILE 157 Ca 0.33 -0.94 -0.32 0.00 1.08 0.00 0.00 64.86 65.01 1tk6 h ILE 157 Cb 0.13 1.56 0.04 0.00 -1.09 0.00 0.00 36.82 37.46 1tk6 h ILE 157 CO -0.16 0.23 -1.40 -0.33 -1.08 0.00 0.00 178.15 175.42 1tk6 h GLU 158 N 0.00 0.53 -0.50 2.19 4.39 -1.28 -1.98 114.58 117.93 1tk6 h GLU 158 Ca -0.00 -0.89 -0.01 0.00 0.34 0.00 0.00 59.36 58.80 1tk6 h GLU 158 Cb 0.54 0.33 -0.02 0.00 -0.10 0.00 0.00 28.75 29.49 1tk6 h GLU 158 CO 0.03 1.42 0.26 -0.07 -1.16 0.00 0.00 179.01 179.50 1tk6 h LEU 159 N 0.10 0.63 -0.99 1.33 4.07 -0.91 -2.20 115.31 117.34 1tk6 h LEU 159 Ca -0.24 -0.10 -0.04 0.00 0.08 0.00 0.00 57.88 57.57 1tk6 h LEU 159 Cb 2.10 -0.16 -0.03 0.00 1.08 0.00 0.00 40.66 43.65 1tk6 h LEU 159 CO 0.26 0.55 0.24 -0.33 -1.08 0.00 0.00 178.44 178.09 1tk6 h GLU 160 N 0.66 0.97 -0.67 1.13 5.08 -0.34 -0.07 114.58 121.33 1tk6 h GLU 160 Ca 0.17 -0.17 0.02 0.00 -1.00 0.00 0.00 59.36 58.38 1tk6 h GLU 160 Cb 0.07 -0.16 -0.04 0.00 0.50 0.00 0.00 28.75 29.12 1tk6 h GLU 160 CO -0.03 0.81 0.43 0.22 -1.00 0.00 0.00 179.01 179.45 1tk6 h ASP 161 N 0.95 0.73 -0.32 1.42 -0.00 -1.03 -0.49 116.42 117.67 1tk6 h ASP 161 Ca 0.22 -0.01 -0.09 0.00 -0.00 0.00 0.00 57.03 57.15 1tk6 h ASP 161 Cb 0.22 -0.17 -0.01 0.00 -0.00 0.00 0.00 39.33 39.37 1tk6 h ASP 161 CO -0.02 0.52 -0.15 0.44 -0.00 0.00 0.00 179.24 180.03 1tk6 h ASP 162 N 0.87 0.69 -0.66 2.28 3.32 -0.85 -1.70 116.42 120.37 1tk6 h ASP 162 Ca 0.26 -0.40 -0.01 0.00 0.02 0.00 0.00 57.03 56.89 1tk6 h ASP 162 Cb -0.04 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.28 1tk6 h ASP 162 CO -0.08 0.94 0.37 0.00 -1.72 0.00 0.00 179.24 178.76 1tk6 h ALA 163 N 0.77 1.38 -0.15 3.45 0.00 -0.87 -1.30 119.26 122.55 1tk6 h ALA 163 Ca 0.07 -0.10 -0.16 0.00 0.00 0.00 0.00 54.91 54.72 1tk6 h ALA 163 Cb 0.68 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 1tk6 h ALA 163 CO 0.05 0.51 -0.58 1.25 0.00 0.00 0.00 179.25 180.47 1tk6 h HIS 164 N 0.95 0.60 -0.86 0.00 -0.00 -0.96 -1.61 115.15 113.28 1tk6 h HIS 164 Ca 0.24 -0.22 0.02 0.00 -0.00 0.00 0.00 60.37 60.41 1tk6 h HIS 164 Cb 0.02 -0.11 -0.05 0.00 -0.00 0.00 0.00 27.41 27.27 1tk6 h HIS 164 CO 0.01 0.94 0.56 0.45 -0.00 0.00 0.00 177.93 179.89 1tk6 h HIS 165 N 0.36 1.06 -0.56 5.26 -0.00 -0.89 -0.57 115.15 119.81 1tk6 h HIS 165 Ca -0.00 0.03 -0.08 0.00 -0.00 0.00 0.00 60.37 60.32 1tk6 h HIS 165 Cb 1.12 -0.35 -0.02 0.00 -0.00 0.00 0.00 27.41 28.16 1tk6 h HIS 165 CO 0.04 0.64 0.04 0.82 -0.00 0.00 0.00 177.93 179.47 1tk6 h ILE 166 N 1.12 1.26 -0.31 2.45 2.04 -0.80 -1.31 117.51 121.97 1tk6 h ILE 166 Ca 0.33 -1.06 0.06 0.00 1.00 0.00 0.00 64.86 65.18 1tk6 h ILE 166 Cb -0.07 0.84 -0.05 0.00 -0.74 0.00 0.00 36.82 36.80 1tk6 h ILE 166 CO -0.09 0.38 -0.03 -0.08 0.00 0.00 0.00 178.15 178.34 1tk6 h GLU 167 N 0.86 0.05 -0.22 2.37 4.81 -1.01 -1.36 114.58 120.09 1tk6 h GLU 167 Ca 0.16 -0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.34 1tk6 h GLU 167 Cb 0.49 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.84 1tk6 h GLU 167 CO 0.02 0.04 -0.11 0.45 -0.73 0.00 0.00 179.01 178.68 1tk6 h HIS 168 N 0.06 0.37 0.00 0.92 3.86 -0.41 -1.99 115.15 117.96 1tk6 h HIS 168 Ca 0.15 -0.05 -0.03 0.00 -1.16 0.00 0.00 60.37 59.29 1tk6 h HIS 168 Cb 0.21 -0.10 -0.00 0.00 1.06 0.00 0.00 27.41 28.57 1tk6 h HIS 168 CO -0.25 0.46 -0.13 1.88 0.86 0.00 0.00 177.93 180.76 1tk6 h TYR 169 N 0.34 0.00 -0.01 2.45 0.05 -0.16 -2.24 116.97 117.39 1tk6 h TYR 169 Ca 0.07 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.85 1tk6 h TYR 169 Cb 0.40 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.14 1tk6 h TYR 169 CO 0.01 0.13 -0.24 1.28 -1.05 0.00 0.00 178.16 178.29 1tk6 n LEU 170 N -3.83 1.38 -4.79 3.88 4.77 -0.77 -4.96 117.00 112.68 1tk6 n LEU 170 Ca -0.02 -0.42 -0.30 0.00 -0.03 0.00 0.00 56.01 55.23 1tk6 n LEU 170 Cb 0.23 -0.07 0.09 0.00 -2.33 0.00 0.00 43.42 41.34 1tk6 n LEU 170 CO 0.31 0.25 0.70 -1.61 -1.33 0.00 0.00 177.39 175.72 1tk6 s GLU 171 N -2.39 2.05 -1.19 3.23 0.41 -0.85 -4.91 118.70 115.06 1tk6 s GLU 171 Ca 0.26 0.76 -0.05 0.00 -0.41 0.00 0.00 54.97 55.53 1tk6 s GLU 171 Cb 0.19 -1.90 0.23 0.00 -1.78 0.00 0.00 34.13 30.87 1tk6 s GLU 171 CO 0.49 -1.68 1.87 -0.40 -0.49 0.00 0.00 175.26 175.05 1tk6 n ASP 172 N -3.49 6.55 -4.01 -0.19 5.75 -1.26 -4.85 116.55 115.04 1tk6 n ASP 172 Ca 0.07 -3.31 -0.08 0.00 -0.01 0.00 0.00 54.79 51.46 1tk6 n ASP 172 Cb 0.55 -1.34 -0.09 0.00 -1.03 0.00 0.00 41.12 39.22 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 -0.43 0.36 -0.06 -1.12 2.15 -1.26 -5.17 116.67 111.14 1tk6 s ASP 173 Ca 0.40 -0.87 -0.30 0.00 0.43 0.00 0.00 52.55 52.22 1tk6 s ASP 173 Cb 0.12 0.24 0.11 0.00 -0.30 0.00 0.00 42.92 43.09 1tk6 s ASP 173 CO -0.01 -0.63 0.94 0.28 -0.17 0.00 0.00 175.17 175.58 1tk6 s THR 174 N -3.81 0.00 -0.56 1.71 -1.32 -1.26 -4.99 115.64 105.41 1tk6 s THR 174 Ca 0.06 0.00 0.24 0.00 -1.21 0.00 0.00 61.69 60.78 1tk6 s THR 174 Cb 0.06 -1.00 0.19 0.00 -1.51 0.00 0.00 72.50 70.24 1tk6 s THR 174 CO -0.10 0.00 1.49 -0.07 -2.21 0.00 0.00 174.62 173.74 1tk6 h LEU 175 N 2.16 0.00 -9.72 9.08 3.38 -2.03 -3.46 115.31 114.72 1tk6 h LEU 175 Ca -0.20 -0.06 -0.53 0.00 0.09 0.00 0.00 57.88 57.18 1tk6 h LEU 175 Cb 1.21 0.00 0.06 0.00 0.09 0.00 0.00 40.66 42.02 1tk6 h LEU 175 CO 0.30 0.03 0.79 -0.69 0.09 0.00 0.00 178.44 178.96 1tk6 s VAL 176 N -3.19 2.62 0.28 1.22 1.01 -1.26 -5.04 120.40 116.04 1tk6 s VAL 176 Ca 0.07 0.51 0.12 0.00 0.00 0.00 0.00 61.98 62.67 1tk6 s VAL 176 Cb 0.10 -3.32 -0.05 0.00 0.00 0.00 0.00 36.38 33.11 1tk6 s VAL 176 CO 0.68 0.07 -0.19 0.42 0.00 0.00 0.00 175.10 176.08 1tk6 s THR 177 N 0.25 2.54 0.38 3.92 -4.23 -1.26 -5.02 115.64 112.21 1tk6 s THR 177 Ca 0.62 -2.37 0.04 0.00 -1.18 0.00 0.00 61.69 58.81 1tk6 s THR 177 Cb -0.43 -2.33 0.26 0.00 1.34 0.00 0.00 72.50 71.34 1tk6 s THR 177 CO 0.41 -0.39 2.02 -0.61 -0.54 0.00 0.00 174.62 175.51 1tk6 h GLN 178 N 2.27 0.69 -0.93 3.99 5.75 -2.00 -1.10 115.11 123.78 1tk6 h GLN 178 Ca -0.40 -0.05 0.09 0.00 -0.15 0.00 0.00 58.65 58.14 1tk6 h GLN 178 Cb 1.26 -0.15 -0.07 0.00 1.07 0.00 0.00 27.48 29.59 1tk6 h GLN 178 CO 0.60 0.47 0.60 0.78 -2.65 0.00 0.00 178.83 178.63 1tk6 h GLY 179 N 0.72 1.39 2.00 2.39 0.00 -2.01 -1.03 103.07 106.53 1tk6 h GLY 179 Ca 0.19 -0.40 -0.05 0.00 0.00 0.00 0.00 47.33 47.06 1tk6 h GLY 179 CO -0.04 0.24 -0.24 0.00 0.00 0.00 0.00 176.54 176.50 1tk6 h ALA 180 N 1.53 1.02 0.00 3.60 0.00 -1.62 -3.55 119.26 120.23 1tk6 h ALA 180 Ca 0.43 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1tk6 h ALA 180 Cb 0.34 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1tk6 h ALA 180 CO -0.18 0.30 0.00 1.28 0.00 0.00 0.00 179.25 180.65