#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tug s ASN 2 N 0.00 5.73 0.44 0.00 2.20 0.57 -4.94 114.94 118.94 1tug s ASN 2 Ca 0.00 1.87 0.30 0.00 -0.94 0.00 0.00 52.86 54.09 1tug s ASN 2 Cb 0.00 -2.54 1.53 0.00 -2.00 0.00 0.00 41.25 38.24 1tug s ASN 2 CO 0.00 -1.20 1.91 1.55 -2.94 0.00 0.00 177.10 176.42 1tug h PRO 3 N 0.52 0.00 -0.00 3.55 0.13 -1.94 -2.63 132.00 131.62 1tug h PRO 3 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1tug h PRO 3 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 1tug h PRO 3 CO 0.57 0.00 -0.88 1.28 -0.23 0.00 0.00 178.00 178.74 1tug n LEU 4 N -2.58 1.14 -4.65 1.56 4.77 -1.26 -4.90 117.00 111.07 1tug n LEU 4 Ca -0.01 -0.54 -0.47 0.00 -0.03 0.00 0.00 56.01 54.96 1tug n LEU 4 Cb 0.11 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.16 1tug n LEU 4 CO 0.16 0.26 1.06 0.00 -1.33 0.00 0.00 177.39 177.54 1tug n TYR 5 N -1.23 2.05 -1.68 -1.77 -0.00 -0.99 -0.37 117.16 113.16 1tug n TYR 5 Ca 0.05 0.41 -0.19 0.00 -0.00 0.00 0.00 57.90 58.16 1tug n TYR 5 Cb 0.34 -2.46 -0.07 0.00 -0.00 0.00 0.00 39.34 37.14 1tug n TYR 5 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.86 177.90 1tug n GLN 6 N 2.71 -1.48 -3.82 2.98 1.13 0.52 -4.96 117.38 114.46 1tug n GLN 6 Ca 0.15 1.11 -0.29 0.00 -1.94 0.00 0.00 57.00 56.03 1tug n GLN 6 Cb 0.28 -5.51 -0.04 0.00 0.11 0.00 0.00 30.24 25.08 1tug n GLN 6 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 1tug s LYS 7 N -3.84 3.49 -0.00 -1.09 -0.14 0.50 -4.82 119.74 113.85 1tug s LYS 7 Ca 0.00 -0.39 -0.26 0.00 -1.36 0.00 0.00 55.97 53.95 1tug s LYS 7 Cb 0.00 -2.94 -0.04 0.00 -1.68 0.00 0.00 37.83 33.17 1tug s LYS 7 CO 0.00 0.51 0.83 -1.01 -0.76 0.00 0.00 175.35 174.92 1tug s HIS 8 N -1.69 3.67 -0.60 3.18 3.76 -1.26 -4.64 115.29 117.71 1tug s HIS 8 Ca 0.37 1.50 -0.08 0.00 -0.15 0.00 0.00 55.06 56.69 1tug s HIS 8 Cb -0.12 -2.93 0.16 0.00 1.11 0.00 0.00 32.58 30.80 1tug s HIS 8 CO 0.28 0.12 0.48 0.42 -0.85 0.00 0.00 174.74 175.18 1tug s ILE 9 N 0.57 4.40 -0.14 0.60 -1.09 -0.53 -4.87 121.20 120.14 1tug s ILE 9 Ca 0.43 -2.31 -0.03 0.00 -2.23 0.00 0.00 60.65 56.51 1tug s ILE 9 Cb -0.20 -3.84 -0.07 0.00 -1.58 0.00 0.00 42.46 36.77 1tug s ILE 9 CO 0.23 -0.87 -0.15 -0.38 -1.23 0.00 0.00 174.94 172.55 1tug n ILE 10 N 4.25 0.77 -4.11 2.92 2.08 -1.26 -0.94 119.36 123.06 1tug n ILE 10 Ca 0.02 -0.25 -0.11 0.00 0.56 0.00 0.00 62.75 62.98 1tug n ILE 10 Cb 0.41 -1.30 -0.10 0.00 -0.75 0.00 0.00 39.64 37.90 1tug n ILE 10 CO 0.00 0.00 0.00 -0.55 0.56 0.00 0.00 176.55 176.56 1tug s SER 11 N -5.74 0.89 0.44 4.38 0.15 -1.26 -4.72 113.70 107.85 1tug s SER 11 Ca -0.19 -0.85 0.24 0.00 0.70 0.00 0.00 55.95 55.86 1tug s SER 11 Cb 0.06 0.10 0.83 0.00 -1.71 0.00 0.00 66.02 65.29 1tug s SER 11 CO 0.28 -0.41 1.78 -0.29 1.20 0.00 0.00 173.24 175.80 1tug h ILE 12 N 3.52 0.43 0.00 6.45 6.09 -1.95 -3.08 117.51 128.97 1tug h ILE 12 Ca -0.35 -1.14 0.00 0.00 -1.37 0.00 0.00 64.86 62.00 1tug h ILE 12 Cb 1.17 1.83 0.00 0.00 0.47 0.00 0.00 36.82 40.29 1tug h ILE 12 CO 0.57 0.19 0.00 0.78 -3.07 0.00 0.00 178.15 176.62 1tug h ASN 13 N 0.00 0.00 0.66 2.19 4.21 -1.97 -2.62 115.58 118.05 1tug h ASN 13 Ca -0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 1tug h ASN 13 Cb 0.81 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.01 1tug h ASN 13 CO 0.03 0.00 -0.30 0.47 -1.29 0.00 0.00 177.43 176.34 1tug n ASP 14 N -2.57 0.34 -4.86 5.81 8.00 -1.16 -4.84 116.55 117.26 1tug n ASP 14 Ca 0.03 -0.02 -0.37 0.00 0.71 0.00 0.00 54.79 55.14 1tug n ASP 14 Cb 0.37 -0.03 -0.06 0.00 -0.02 0.00 0.00 41.12 41.38 1tug n ASP 14 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1tug s LEU 15 N -2.96 4.41 0.45 0.64 1.43 -0.99 -5.07 118.68 116.60 1tug s LEU 15 Ca 0.13 0.62 0.01 0.00 -1.03 0.00 0.00 54.13 53.87 1tug s LEU 15 Cb 0.18 -2.24 0.00 0.00 0.03 0.00 0.00 46.19 44.17 1tug s LEU 15 CO 0.62 0.38 0.67 -0.94 0.23 0.00 0.00 176.35 177.31 1tug s SER 16 N -1.01 5.77 0.24 2.29 1.04 -1.26 -4.90 113.70 115.86 1tug s SER 16 Ca 0.18 0.21 -0.09 0.00 0.48 0.00 0.00 55.95 56.73 1tug s SER 16 Cb -0.13 -1.42 0.38 0.00 0.10 0.00 0.00 66.02 64.95 1tug s SER 16 CO 0.07 -0.74 1.63 -0.09 0.98 0.00 0.00 173.24 175.09 1tug h ARG 17 N 0.39 0.07 0.95 4.02 2.43 -1.96 0.22 114.38 120.50 1tug h ARG 17 Ca -0.46 -0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 58.66 1tug h ARG 17 Cb 1.26 -0.02 0.01 0.00 -0.42 0.00 0.00 29.97 30.80 1tug h ARG 17 CO 0.56 0.05 -0.46 -0.44 -1.51 0.00 0.00 179.97 178.17 1tug h ASP 18 N 0.07 -1.08 -0.82 -3.80 3.32 -1.98 0.79 116.42 112.91 1tug h ASP 18 Ca 0.38 0.04 0.15 0.00 0.02 0.00 0.00 57.03 57.62 1tug h ASP 18 Cb 0.65 0.28 -0.15 0.00 0.22 0.00 0.00 39.33 40.33 1tug h ASP 18 CO -0.67 -0.77 -0.31 0.44 -1.72 0.00 0.00 179.24 176.21 1tug h ASP 19 N -1.30 -1.12 -0.34 6.45 3.45 -1.81 0.51 116.42 122.27 1tug h ASP 19 Ca -0.13 0.27 0.07 0.00 0.43 0.00 0.00 57.03 57.66 1tug h ASP 19 Cb 0.98 0.62 -0.06 0.00 -0.56 0.00 0.00 39.33 40.31 1tug h ASP 19 CO 0.21 -0.29 -0.06 -0.07 -1.57 0.00 0.00 179.24 177.46 1tug h LEU 20 N -0.05 -0.27 -0.66 1.55 3.38 -0.12 -1.37 115.31 117.77 1tug h LEU 20 Ca 0.34 0.09 -0.05 0.00 0.09 0.00 0.00 57.88 58.35 1tug h LEU 20 Cb 0.59 0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.51 1tug h LEU 20 CO -0.86 -0.09 0.20 0.78 0.09 0.00 0.00 178.44 178.56 1tug h ASN 21 N 0.02 0.96 -0.35 -0.43 -0.26 0.39 -2.06 115.58 113.85 1tug h ASN 21 Ca 0.16 -0.21 0.03 0.00 -0.56 0.00 0.00 56.30 55.72 1tug h ASN 21 Cb 0.24 -0.25 -0.03 0.00 -1.06 0.00 0.00 38.32 37.22 1tug h ASN 21 CO -0.33 0.92 0.17 0.25 -1.06 0.00 0.00 177.43 177.38 1tug h LEU 22 N 0.95 0.23 -1.14 1.61 5.85 0.26 0.22 115.31 123.30 1tug h LEU 22 Ca 0.21 0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.98 1tug h LEU 22 Cb 0.31 -0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.27 1tug h LEU 22 CO -0.00 0.18 0.59 0.58 -0.34 0.00 0.00 178.44 179.44 1tug h VAL 23 N 0.35 1.18 0.02 1.05 2.07 -1.07 -2.41 116.25 117.43 1tug h VAL 23 Ca 0.15 -0.40 -0.21 0.00 0.82 0.00 0.00 66.70 67.07 1tug h VAL 23 Cb 0.07 -0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 29.76 1tug h VAL 23 CO -0.12 0.21 -0.93 -0.07 0.02 0.00 0.00 177.57 176.69 1tug h LEU 24 N 1.15 0.29 -0.58 2.57 3.38 -0.51 -1.25 115.31 120.37 1tug h LEU 24 Ca 0.34 -0.25 -0.10 0.00 0.09 0.00 0.00 57.88 57.97 1tug h LEU 24 Cb -0.05 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 1tug h LEU 24 CO -0.09 1.07 -0.02 0.00 0.09 0.00 0.00 178.44 179.49 1tug h ALA 25 N 0.91 0.78 0.07 1.53 0.00 -0.39 -2.25 119.26 119.92 1tug h ALA 25 Ca -0.06 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.54 1tug h ALA 25 Cb 1.58 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 19.16 1tug h ALA 25 CO 0.14 0.63 -0.03 1.15 0.00 0.00 0.00 179.25 181.14 1tug h THR 26 N 0.92 0.98 -0.92 0.00 2.02 -1.41 -1.02 112.91 113.49 1tug h THR 26 Ca 0.16 -0.16 0.11 0.00 0.77 0.00 0.00 66.41 67.28 1tug h THR 26 Cb 0.58 1.08 -0.07 0.00 -1.74 0.00 0.00 68.15 68.00 1tug h THR 26 CO 0.03 0.04 0.59 0.00 0.37 0.00 0.00 175.52 176.55 1tug h ALA 27 N 0.75 1.63 0.07 6.16 0.00 -1.09 0.26 119.26 127.05 1tug h ALA 27 Ca -0.01 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1tug h ALA 27 Cb 0.14 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1tug h ALA 27 CO 0.02 0.17 -0.03 0.00 0.00 0.00 0.00 179.25 179.40 1tug h ALA 28 N 1.55 -0.09 -0.39 0.00 0.00 -1.09 0.37 119.26 119.62 1tug h ALA 28 Ca 0.43 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.29 1tug h ALA 28 Cb 0.45 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 1tug h ALA 28 CO -0.20 -0.51 0.25 0.87 0.00 0.00 0.00 179.25 179.67 1tug h LYS 29 N -0.18 0.50 0.00 0.00 1.57 0.35 -2.30 116.57 116.51 1tug h LYS 29 Ca -0.01 -0.03 -0.07 0.00 -1.87 0.00 0.00 60.65 58.67 1tug h LYS 29 Cb 0.15 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 1tug h LYS 29 CO 0.02 0.33 -0.34 -0.07 -0.57 0.00 0.00 179.45 178.82 1tug h LEU 30 N 0.52 0.00 -1.22 2.94 3.38 -0.47 0.35 115.31 120.81 1tug h LEU 30 Ca 0.14 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.03 1tug h LEU 30 Cb -0.06 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 1tug h LEU 30 CO -0.03 0.34 -0.38 0.50 0.09 0.00 0.00 178.44 178.96 1tug h LYS 31 N 0.00 0.00 0.04 1.13 3.64 -0.37 -3.10 116.57 117.90 1tug h LYS 31 Ca -0.00 0.00 -0.36 0.00 -1.27 0.00 0.00 60.65 59.02 1tug h LYS 31 Cb 0.66 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 32.43 1tug h LYS 31 CO 0.04 0.38 -2.18 0.00 -2.27 0.00 0.00 179.45 175.43 1tug n ALA 32 N -2.43 1.29 -3.53 5.00 0.00 -0.96 -4.75 120.51 115.13 1tug n ALA 32 Ca -0.02 -0.94 -0.29 0.00 0.00 0.00 0.00 53.44 52.20 1tug n ALA 32 Cb 0.43 -0.42 -0.12 0.00 0.00 0.00 0.00 19.45 19.33 1tug n ALA 32 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1tug s ASN 33 N -6.40 2.92 0.67 0.00 3.04 0.07 -5.11 114.94 110.13 1tug s ASN 33 Ca -0.21 -2.54 -0.17 0.00 0.04 0.00 0.00 52.86 49.99 1tug s ASN 33 Cb 0.07 -0.62 0.00 0.00 -1.54 0.00 0.00 41.25 39.17 1tug s ASN 33 CO 0.74 -0.26 1.23 -2.84 -3.04 0.00 0.00 177.10 172.92 1tug s PRO 34 N 0.59 2.51 -0.48 0.43 0.02 -1.17 -4.44 135.00 132.46 1tug s PRO 34 Ca 0.21 1.85 0.07 0.00 0.02 0.00 0.00 61.00 63.15 1tug s PRO 34 Cb -0.17 -1.87 0.23 0.00 0.02 0.00 0.00 34.50 32.71 1tug s PRO 34 CO -0.04 -1.57 0.55 1.04 -0.33 0.00 0.00 177.00 176.65 1tug n GLN 35 N -2.17 1.18 0.00 5.54 1.13 -1.26 -5.01 117.38 116.79 1tug n GLN 35 Ca 0.14 -3.67 0.08 0.00 -1.94 0.00 0.00 57.00 51.60 1tug n GLN 35 Cb 0.50 -1.62 0.45 0.00 0.11 0.00 0.00 30.24 29.68 1tug n GLN 35 CO 0.00 0.00 0.00 -0.35 -1.44 0.00 0.00 177.06 175.27 1tug n PRO 36 N 1.51 0.89 -0.40 -1.09 -0.04 -1.26 -2.36 135.00 132.25 1tug n PRO 36 Ca 0.25 0.00 0.03 0.00 -0.04 0.00 0.00 63.50 63.73 1tug n PRO 36 Cb 0.48 -1.27 0.04 0.00 -0.04 0.00 0.00 33.50 32.71 1tug n PRO 36 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1tug n GLU 37 N -0.77 0.33 -0.16 0.54 -0.58 -1.25 -3.39 120.64 115.36 1tug n GLU 37 Ca 0.11 -1.42 -0.08 0.00 -0.42 0.00 0.00 57.16 55.35 1tug n GLU 37 Cb 0.05 -0.75 0.06 0.00 -0.57 0.00 0.00 31.44 30.23 1tug n GLU 37 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 1tug h LEU 38 N 0.02 0.95 -3.28 -4.62 5.85 -1.21 -3.14 115.31 109.88 1tug h LEU 38 Ca -0.00 -0.29 -0.03 0.00 0.84 0.00 0.00 57.88 58.40 1tug h LEU 38 Cb 1.30 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 42.06 1tug h LEU 38 CO 0.00 1.05 0.00 0.18 -0.34 0.00 0.00 178.44 179.33 1tug n LEU 39 N -4.16 3.96 -4.20 2.25 4.77 0.96 -5.02 117.00 115.57 1tug n LEU 39 Ca 0.02 -3.11 -0.37 0.00 -0.03 0.00 0.00 56.01 52.52 1tug n LEU 39 Cb 0.37 -0.56 0.04 0.00 -2.33 0.00 0.00 43.42 40.94 1tug n LEU 39 CO 0.44 0.74 -0.76 1.17 -1.33 0.00 0.00 177.39 177.65 1tug n LYS 40 N -0.58 0.04 -0.31 3.23 4.81 -1.19 -1.25 118.16 122.91 1tug n LYS 40 Ca 0.23 0.02 0.00 0.00 -0.87 0.00 0.00 58.31 57.70 1tug n LYS 40 Cb 0.92 -1.19 0.00 0.00 0.02 0.00 0.00 35.03 34.78 1tug n LYS 40 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 1tug n HIS 41 N -2.15 0.00 -3.53 5.64 8.25 -1.26 -4.94 115.22 117.23 1tug n HIS 41 Ca 0.04 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.16 1tug n HIS 41 Cb 0.51 -1.02 -0.05 0.00 1.12 0.00 0.00 29.99 30.55 1tug n HIS 41 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 1tug s LYS 42 N -0.62 3.80 -0.12 -0.41 -0.14 -0.38 -4.99 119.74 116.88 1tug s LYS 42 Ca 0.00 0.23 0.02 0.00 -1.36 0.00 0.00 55.97 54.86 1tug s LYS 42 Cb 0.00 -2.95 -0.01 0.00 -1.68 0.00 0.00 37.83 33.19 1tug s LYS 42 CO 0.00 0.52 -0.18 0.08 -0.76 0.00 0.00 175.35 175.01 1tug s VAL 43 N -1.45 2.58 -0.03 3.17 1.01 -1.26 -1.26 120.40 123.15 1tug s VAL 43 Ca 0.35 -0.83 0.06 0.00 0.00 0.00 0.00 61.98 61.57 1tug s VAL 43 Cb -0.14 -2.05 -0.01 0.00 0.00 0.00 0.00 36.38 34.18 1tug s VAL 43 CO 0.19 0.54 -0.23 -0.63 0.00 0.00 0.00 175.10 174.97 1tug s ILE 44 N 0.41 1.81 0.02 2.22 1.01 -0.68 -0.15 121.20 125.84 1tug s ILE 44 Ca -0.13 -0.96 -0.24 0.00 0.00 0.00 0.00 60.65 59.32 1tug s ILE 44 Cb -0.17 -1.52 -0.05 0.00 0.01 0.00 0.00 42.46 40.74 1tug s ILE 44 CO 0.06 0.51 0.74 0.00 0.00 0.00 0.00 174.94 176.25 1tug s ALA 45 N -0.34 3.37 -0.76 9.38 0.00 -0.63 -2.22 121.76 130.57 1tug s ALA 45 Ca 0.03 0.23 -0.03 0.00 0.00 0.00 0.00 51.96 52.19 1tug s ALA 45 Cb -0.11 -2.97 0.19 0.00 0.00 0.00 0.00 23.12 20.24 1tug s ALA 45 CO 0.01 0.04 0.61 0.45 0.00 0.00 0.00 175.76 176.87 1tug s SER 46 N 0.11 5.67 -0.91 0.00 0.15 0.58 -0.96 113.70 118.35 1tug s SER 46 Ca 0.38 -3.23 -0.17 0.00 0.70 0.00 0.00 55.95 53.63 1tug s SER 46 Cb -0.20 -1.90 0.16 0.00 -1.71 0.00 0.00 66.02 62.37 1tug s SER 46 CO 0.22 -0.30 1.03 0.00 1.20 0.00 0.00 173.24 175.38 1tug n PHE 48 N 5.67 4.76 0.16 0.00 3.01 0.65 -2.09 117.46 129.62 1tug n PHE 48 Ca 0.21 -3.34 0.19 0.00 1.01 0.00 0.00 57.45 55.52 1tug n PHE 48 Cb 0.48 -2.11 0.79 0.00 -0.01 0.00 0.00 39.48 38.63 1tug n PHE 48 CO 0.00 0.00 0.00 0.74 1.01 0.00 0.00 176.76 178.51 1tug h PHE 49 N 6.92 0.00 -3.16 1.38 -1.00 -1.62 0.41 116.94 119.86 1tug h PHE 49 Ca 0.31 0.00 -0.64 0.00 2.81 0.00 0.00 57.97 60.45 1tug h PHE 49 Cb 0.84 0.00 -0.35 0.00 3.61 0.00 0.00 35.95 40.05 1tug h PHE 49 CO 1.09 0.00 -0.85 0.00 -1.61 0.00 0.00 178.31 176.93 1tug s ALA 50 N -4.62 2.09 0.45 2.45 0.00 -1.19 -4.46 121.76 116.48 1tug s ALA 50 Ca -0.04 -1.02 -0.25 0.00 0.00 0.00 0.00 51.96 50.64 1tug s ALA 50 Cb 0.15 -1.03 -0.08 0.00 0.00 0.00 0.00 23.12 22.17 1tug s ALA 50 CO 0.54 -0.20 1.38 0.00 0.00 0.00 0.00 175.76 177.48 1tug s ALA 51 N 1.11 3.20 -0.34 0.00 0.00 -1.18 -4.80 121.76 119.76 1tug s ALA 51 Ca -0.01 1.37 -0.07 0.00 0.00 0.00 0.00 51.96 53.25 1tug s ALA 51 Cb -0.14 -3.55 0.19 0.00 0.00 0.00 0.00 23.12 19.61 1tug s ALA 51 CO -0.07 -1.09 0.98 0.45 0.00 0.00 0.00 175.76 176.03 1tug s SER 52 N -0.64 -0.52 0.08 0.00 0.15 -1.26 -5.08 113.70 106.42 1tug s SER 52 Ca 0.61 -0.26 -0.16 0.00 0.70 0.00 0.00 55.95 56.83 1tug s SER 52 Cb -0.41 0.68 -0.12 0.00 -1.71 0.00 0.00 66.02 64.45 1tug s SER 52 CO 0.53 -0.06 1.35 0.74 1.20 0.00 0.00 173.24 177.00 1tug h THR 53 N 3.69 1.32 -0.45 6.45 2.02 -1.97 -0.73 112.91 123.24 1tug h THR 53 Ca -0.02 -1.56 0.00 0.00 0.77 0.00 0.00 66.41 65.60 1tug h THR 53 Cb 1.23 1.80 -0.02 0.00 -1.74 0.00 0.00 68.15 69.41 1tug h THR 53 CO -0.05 0.48 0.29 -0.09 0.37 0.00 0.00 175.52 176.53 1tug h ARG 54 N 0.30 0.59 -0.13 6.66 2.43 -1.98 0.48 114.38 122.74 1tug h ARG 54 Ca 0.02 -0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 59.15 1tug h ARG 54 Cb 0.93 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 30.35 1tug h ARG 54 CO 0.08 0.41 0.08 1.15 -1.51 0.00 0.00 179.97 180.17 1tug h THR 55 N 0.60 1.06 0.95 0.20 2.02 -1.97 -1.80 112.91 113.98 1tug h THR 55 Ca 0.16 -0.15 -0.05 0.00 0.77 0.00 0.00 66.41 67.14 1tug h THR 55 Cb -0.05 0.94 0.01 0.00 -1.74 0.00 0.00 68.15 67.31 1tug h THR 55 CO -0.03 0.06 -0.47 -0.09 0.37 0.00 0.00 175.52 175.35 1tug h ARG 56 N 0.14 -1.25 -0.98 6.66 2.43 -0.90 -1.02 114.38 119.46 1tug h ARG 56 Ca 0.05 0.09 0.29 0.00 -0.81 0.00 0.00 59.98 59.59 1tug h ARG 56 Cb 0.03 0.28 -0.14 0.00 -0.42 0.00 0.00 29.97 29.72 1tug h ARG 56 CO -0.01 -0.83 0.51 -0.07 -1.51 0.00 0.00 179.97 178.06 1tug h LEU 57 N -1.30 0.46 0.17 3.80 3.38 -0.07 0.25 115.31 122.00 1tug h LEU 57 Ca -0.13 0.18 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 1tug h LEU 57 Cb 1.00 0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.89 1tug h LEU 57 CO 0.20 -0.08 -0.08 -1.28 0.09 0.00 0.00 178.44 177.29 1tug h SER 58 N 0.36 -0.19 -0.31 -0.43 0.87 -1.04 -1.88 113.55 110.94 1tug h SER 58 Ca 0.68 -0.21 0.04 0.00 -1.23 0.00 0.00 61.79 61.07 1tug h SER 58 Cb 1.46 0.05 -0.04 0.00 -0.44 0.00 0.00 62.40 63.43 1tug h SER 58 CO -0.58 0.12 0.07 -0.26 -0.53 0.00 0.00 176.83 175.65 1tug h PHE 59 N -0.52 0.12 -0.56 2.24 -1.00 0.06 -1.37 116.94 115.92 1tug h PHE 59 Ca -0.02 0.02 -0.11 0.00 2.81 0.00 0.00 57.97 60.66 1tug h PHE 59 Cb 0.40 -0.01 -0.02 0.00 3.61 0.00 0.00 35.95 39.93 1tug h PHE 59 CO 0.02 0.04 -0.08 0.93 -1.61 0.00 0.00 178.31 177.60 1tug h GLU 60 N 0.19 1.04 -0.45 1.51 5.08 -0.59 -1.14 114.58 120.22 1tug h GLU 60 Ca 0.14 -0.37 0.02 0.00 -1.00 0.00 0.00 59.36 58.15 1tug h GLU 60 Cb 0.15 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.29 1tug h GLU 60 CO -0.18 1.07 0.26 1.15 -1.00 0.00 0.00 179.01 180.31 1tug h THR 61 N 0.93 1.04 -0.99 1.13 2.02 -1.15 0.09 112.91 115.98 1tug h THR 61 Ca 0.15 -0.18 0.08 0.00 0.77 0.00 0.00 66.41 67.22 1tug h THR 61 Cb 0.65 0.47 -0.07 0.00 -1.74 0.00 0.00 68.15 67.46 1tug h THR 61 CO 0.05 0.10 0.64 0.28 0.37 0.00 0.00 175.52 176.95 1tug h SER 62 N 0.53 0.99 -0.05 4.18 0.02 -0.63 0.37 113.55 118.96 1tug h SER 62 Ca 0.18 0.02 -0.00 0.00 -0.84 0.00 0.00 61.79 61.14 1tug h SER 62 Cb 0.02 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 62.36 1tug h SER 62 CO -0.08 0.62 0.03 0.24 -1.14 0.00 0.00 176.83 176.49 1tug h MET 63 N 1.12 0.08 0.00 3.45 2.07 -0.12 -2.30 114.93 119.22 1tug h MET 63 Ca 0.44 -0.01 -0.11 0.00 -2.07 0.00 0.00 59.70 57.95 1tug h MET 63 Cb 0.23 -0.01 -0.02 0.00 -1.87 0.00 0.00 31.60 29.93 1tug h MET 63 CO -0.18 0.16 -0.50 0.45 1.07 0.00 0.00 176.91 177.91 1tug h HIS 64 N -0.03 0.00 0.00 -0.22 3.86 -0.53 -1.55 115.15 116.68 1tug h HIS 64 Ca 0.02 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.23 1tug h HIS 64 Cb 0.11 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.58 1tug h HIS 64 CO -0.04 0.50 0.00 0.54 0.86 0.00 0.00 177.93 179.80 1tug n ARG 65 N -3.85 0.14 0.00 2.45 5.12 0.13 -1.89 116.66 118.77 1tug n ARG 65 Ca -0.01 0.37 0.07 0.00 -1.93 0.00 0.00 57.85 56.35 1tug n ARG 65 Cb 0.53 -1.77 0.05 0.00 -1.16 0.00 0.00 32.46 30.12 1tug n ARG 65 CO 0.00 0.00 0.00 -0.11 -1.93 0.00 0.00 177.63 175.59 1tug n LEU 66 N -2.03 2.10 0.00 0.55 7.94 -0.94 -3.99 117.00 120.63 1tug n LEU 66 Ca 0.03 -0.97 0.00 0.00 -1.11 0.00 0.00 56.01 53.96 1tug n LEU 66 Cb 0.22 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.17 1tug n LEU 66 CO 0.18 0.38 0.00 0.61 -1.11 0.00 0.00 177.39 177.46 1tug n GLY 67 N 0.84 0.84 3.84 -3.96 0.00 -0.79 -0.03 105.19 105.93 1tug n GLY 67 Ca 0.08 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.75 1tug n GLY 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tug s ALA 68 N -2.08 3.51 0.49 4.61 0.00 -0.63 -3.44 121.76 124.22 1tug s ALA 68 Ca 0.00 -0.06 -0.19 0.00 0.00 0.00 0.00 51.96 51.71 1tug s ALA 68 Cb 0.00 -2.61 -0.09 0.00 0.00 0.00 0.00 23.12 20.43 1tug s ALA 68 CO 0.00 0.42 0.99 -1.12 0.00 0.00 0.00 175.76 176.05 1tug s SER 69 N -1.85 6.60 -0.05 0.00 0.01 -0.39 -4.24 113.70 113.79 1tug s SER 69 Ca 0.42 1.70 0.05 0.00 1.31 0.00 0.00 55.95 59.43 1tug s SER 69 Cb -0.14 -2.53 -0.01 0.00 0.21 0.00 0.00 66.02 63.55 1tug s SER 69 CO 0.20 -0.60 -0.20 -0.69 0.41 0.00 0.00 173.24 172.35 1tug s VAL 70 N -2.34 1.68 0.10 3.43 1.01 -1.26 -1.69 120.40 121.33 1tug s VAL 70 Ca 0.62 -0.86 0.06 0.00 0.00 0.00 0.00 61.98 61.80 1tug s VAL 70 Cb -0.11 -1.43 -0.03 0.00 0.00 0.00 0.00 36.38 34.80 1tug s VAL 70 CO 0.23 0.48 -0.16 0.68 0.00 0.00 0.00 175.10 176.33 1tug s VAL 71 N -0.08 1.33 -1.96 2.92 -7.23 -0.94 -4.97 120.40 109.47 1tug s VAL 71 Ca -0.03 -1.50 0.00 0.00 -1.81 0.00 0.00 61.98 58.64 1tug s VAL 71 Cb -0.12 -1.34 0.00 0.00 0.56 0.00 0.00 36.38 35.48 1tug s VAL 71 CO 0.02 -0.25 0.00 0.61 -0.31 0.00 0.00 175.10 175.17 1tug n GLY 72 N 0.97 -0.53 3.48 2.32 0.00 -1.26 -0.31 105.19 109.87 1tug n GLY 72 Ca -0.19 -0.80 -0.10 0.00 0.00 0.00 0.00 46.02 44.93 1tug n GLY 72 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1tug s PHE 73 N -3.00 -0.80 -0.11 1.61 -0.12 -0.22 -4.94 117.98 110.40 1tug s PHE 73 Ca 0.00 1.71 -0.23 0.00 -0.05 0.00 0.00 56.93 58.36 1tug s PHE 73 Cb 0.00 0.40 -0.03 0.00 -0.63 0.00 0.00 43.02 42.76 1tug s PHE 73 CO 0.00 -0.41 0.70 0.45 -0.05 0.00 0.00 175.22 175.91 1tug s SER 74 N 1.15 6.91 -0.02 1.98 0.15 -1.26 -0.25 113.70 122.36 1tug s SER 74 Ca -0.07 1.10 0.08 0.00 0.70 0.00 0.00 55.95 57.76 1tug s SER 74 Cb -0.06 -2.40 -0.02 0.00 -1.71 0.00 0.00 66.02 61.83 1tug s SER 74 CO -0.11 -0.18 -0.25 -0.62 1.20 0.00 0.00 173.24 173.28 1tug s ASP 75 N 0.92 3.16 0.00 5.45 -1.08 0.14 -4.90 116.67 120.35 1tug s ASP 75 Ca 0.35 -0.46 0.00 0.00 -0.52 0.00 0.00 52.55 51.93 1tug s ASP 75 Cb -0.17 -0.38 0.00 0.00 -1.46 0.00 0.00 42.92 40.91 1tug s ASP 75 CO 0.15 0.32 0.00 -0.24 0.52 0.00 0.00 175.17 175.92 1tug n SER 76 N 2.35 0.00 -4.12 -0.34 2.88 -1.26 -3.07 113.62 110.05 1tug n SER 76 Ca -0.16 -0.66 -0.33 0.00 -1.33 0.00 0.00 58.87 56.39 1tug n SER 76 Cb 0.51 0.00 -0.16 0.00 -0.75 0.00 0.00 64.21 63.81 1tug n SER 76 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1tug s ALA 77 N 0.00 2.37 -1.59 -1.46 0.00 -1.26 -4.18 121.76 115.64 1tug s ALA 77 Ca 0.00 -1.27 0.00 0.00 0.00 0.00 0.00 51.96 50.69 1tug s ALA 77 Cb 0.00 -1.24 0.00 0.00 0.00 0.00 0.00 23.12 21.88 1tug s ALA 77 CO 0.00 -0.43 0.00 0.09 0.00 0.00 0.00 175.76 175.42 1tug n ASN 78 N 4.61 -4.91 -4.02 0.00 3.02 -1.26 -4.95 115.26 107.75 1tug n ASN 78 Ca -0.20 0.37 -0.31 0.00 -0.03 0.00 0.00 54.58 54.41 1tug n ASN 78 Cb 0.49 -3.73 -0.15 0.00 -0.61 0.00 0.00 39.78 35.78 1tug n ASN 78 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1tug s THR 79 N -2.52 2.23 0.00 3.41 -4.23 -1.26 -4.10 115.64 109.17 1tug s THR 79 Ca 0.00 -2.18 0.00 0.00 -1.18 0.00 0.00 61.69 58.33 1tug s THR 79 Cb 0.00 -2.58 0.00 0.00 1.34 0.00 0.00 72.50 71.26 1tug s THR 79 CO 0.00 -0.48 0.00 -1.20 -0.54 0.00 0.00 174.62 172.40 1tug n SER 80 N 4.30 0.00 -2.71 3.99 7.64 -1.26 -4.83 113.62 120.75 1tug n SER 80 Ca 0.00 0.00 -0.03 0.00 1.01 0.00 0.00 58.87 59.85 1tug n SER 80 Cb 0.42 0.00 0.10 0.00 -1.01 0.00 0.00 64.21 63.72 1tug n SER 80 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1tug n LEU 81 N -0.02 -0.66 -1.15 -3.43 4.32 -1.26 -4.92 117.00 109.88 1tug n LEU 81 Ca 0.00 -3.27 0.11 0.00 -0.02 0.00 0.00 56.01 52.84 1tug n LEU 81 Cb 0.00 0.19 0.26 0.00 -1.62 0.00 0.00 43.42 42.25 1tug n LEU 81 CO 0.00 1.60 0.73 0.61 -1.22 0.00 0.00 177.39 179.11 1tug n GLY 82 N -1.03 1.78 0.11 -0.72 0.00 -1.26 -3.96 105.19 100.11 1tug n GLY 82 Ca -0.07 -0.72 -0.00 0.00 0.00 0.00 0.00 46.02 45.23 1tug n GLY 82 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1tug h LYS 83 N 4.12 0.00 -0.85 1.61 1.79 -1.91 -2.98 116.57 118.35 1tug h LYS 83 Ca 0.00 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.43 1tug h LYS 83 Cb 0.92 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.55 1tug h LYS 83 CO 0.00 0.60 0.05 0.36 -1.08 0.00 0.00 179.45 179.38 1tug n LYS 84 N -3.22 2.47 -1.05 3.15 2.85 -1.25 -4.83 118.16 116.28 1tug n LYS 84 Ca 0.00 -1.34 0.00 0.00 -1.05 0.00 0.00 58.31 55.92 1tug n LYS 84 Cb 0.80 -1.77 0.00 0.00 -0.65 0.00 0.00 35.03 33.41 1tug n LYS 84 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1tug n GLY 85 N 0.18 4.21 3.90 2.58 0.00 -1.12 -5.13 105.19 109.81 1tug n GLY 85 Ca 0.14 -2.13 -0.29 0.00 0.00 0.00 0.00 46.02 43.74 1tug n GLY 85 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1tug s GLU 86 N -0.66 2.42 1.00 1.61 -1.05 -1.26 -5.04 118.70 115.73 1tug s GLU 86 Ca 0.00 0.22 -0.11 0.00 -0.15 0.00 0.00 54.97 54.92 1tug s GLU 86 Cb 0.00 -2.02 0.19 0.00 -0.44 0.00 0.00 34.13 31.86 1tug s GLU 86 CO 0.00 -1.27 1.09 0.95 0.95 0.00 0.00 175.26 176.98 1tug s THR 87 N -3.42 2.25 0.20 1.83 -4.23 -1.26 -4.93 115.64 106.08 1tug s THR 87 Ca 0.60 0.08 -0.04 0.00 -1.18 0.00 0.00 61.69 61.15 1tug s THR 87 Cb -0.11 -2.25 -0.03 0.00 1.34 0.00 0.00 72.50 71.44 1tug s THR 87 CO 0.49 -0.11 1.54 0.25 -0.54 0.00 0.00 174.62 176.25 1tug h LEU 88 N -2.04 0.67 0.22 4.79 5.85 -1.99 -2.63 115.31 120.18 1tug h LEU 88 Ca -0.51 -0.32 0.01 0.00 0.84 0.00 0.00 57.88 57.89 1tug h LEU 88 Cb 1.29 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 42.10 1tug h LEU 88 CO 0.48 1.03 -0.39 0.00 -0.34 0.00 0.00 178.44 179.23 1tug h ALA 89 N 0.99 -0.74 -0.90 1.25 0.00 -1.94 -1.08 119.26 116.84 1tug h ALA 89 Ca 0.03 -0.09 0.06 0.00 0.00 0.00 0.00 54.91 54.91 1tug h ALA 89 Cb 1.00 0.61 -0.06 0.00 0.00 0.00 0.00 17.79 19.34 1tug h ALA 89 CO 0.09 -0.97 0.59 -0.44 0.00 0.00 0.00 179.25 178.52 1tug h ASP 90 N -0.68 0.91 -0.84 0.00 3.45 -1.95 -1.43 116.42 115.88 1tug h ASP 90 Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.47 1tug h ASP 90 Cb 0.67 -0.19 -0.04 0.00 -0.56 0.00 0.00 39.33 39.21 1tug h ASP 90 CO -0.17 0.59 0.53 0.74 -1.57 0.00 0.00 179.24 179.36 1tug h THR 91 N 1.03 1.23 -0.30 0.35 2.02 -0.99 -2.16 112.91 114.08 1tug h THR 91 Ca 0.38 -0.47 -0.12 0.00 0.77 0.00 0.00 66.41 66.98 1tug h THR 91 Cb 0.18 0.02 -0.01 0.00 -1.74 0.00 0.00 68.15 66.60 1tug h THR 91 CO -0.14 0.23 -0.27 0.40 0.37 0.00 0.00 175.52 176.11 1tug h ILE 92 N 1.15 1.30 -0.19 3.11 1.08 -0.34 -2.04 117.51 121.58 1tug h ILE 92 Ca 0.31 -1.43 -0.06 0.00 -0.39 0.00 0.00 64.86 63.29 1tug h ILE 92 Cb -0.08 1.54 -0.01 0.00 -3.07 0.00 0.00 36.82 35.20 1tug h ILE 92 CO -0.06 0.46 -0.13 0.28 -0.69 0.00 0.00 178.15 178.01 1tug h SER 93 N 0.47 0.29 -0.00 1.72 0.02 -1.07 0.49 113.55 115.47 1tug h SER 93 Ca 0.05 -0.06 -0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1tug h SER 93 Cb 0.83 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 63.29 1tug h SER 93 CO 0.07 0.45 -0.00 0.58 -1.14 0.00 0.00 176.83 176.79 1tug h VAL 94 N 0.29 1.47 -0.34 2.27 2.07 -1.28 -3.23 116.25 117.50 1tug h VAL 94 Ca 0.06 -1.38 -0.05 0.00 0.82 0.00 0.00 66.70 66.14 1tug h VAL 94 Cb 0.41 2.41 -0.02 0.00 -1.52 0.00 0.00 31.29 32.57 1tug h VAL 94 CO 0.02 0.36 -0.02 0.40 0.02 0.00 0.00 177.57 178.35 1tug h ILE 95 N -0.58 1.20 0.00 4.57 2.04 -0.95 -1.68 117.51 122.12 1tug h ILE 95 Ca -0.00 -0.83 0.00 0.00 1.00 0.00 0.00 64.86 65.03 1tug h ILE 95 Cb 0.59 0.97 0.00 0.00 -0.74 0.00 0.00 36.82 37.64 1tug h ILE 95 CO 0.00 0.28 0.00 0.77 0.00 0.00 0.00 178.15 179.20 1tug h SER 96 N 0.51 0.00 1.26 1.72 4.64 -0.05 0.92 113.55 122.55 1tug h SER 96 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 1tug h SER 96 Cb 0.36 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 1tug h SER 96 CO 0.01 0.00 0.00 0.71 -0.87 0.00 0.00 176.83 176.68 1tug h THR 97 N 0.00 0.00 0.00 2.95 1.35 -1.33 -3.38 112.91 112.51 1tug h THR 97 Ca 0.00 -0.47 -0.37 0.00 -0.55 0.00 0.00 66.41 65.02 1tug h THR 97 Cb 0.13 1.38 -0.06 0.00 -1.73 0.00 0.00 68.15 67.87 1tug h THR 97 CO 0.00 0.00 -2.33 -1.22 -0.25 0.00 0.00 175.52 171.72 1tug n TYR 98 N -2.43 0.00 -3.89 4.73 0.53 0.31 -5.07 117.16 111.34 1tug n TYR 98 Ca 0.04 0.00 -0.22 0.00 -1.02 0.00 0.00 57.90 56.70 1tug n TYR 98 Cb 0.37 -0.88 -0.04 0.00 -1.03 0.00 0.00 39.34 37.76 1tug n TYR 98 CO 0.00 0.00 0.00 0.14 -1.02 0.00 0.00 176.86 175.98 1tug s VAL 99 N -2.45 3.33 -0.29 -0.72 -7.23 -1.14 -4.97 120.40 106.92 1tug s VAL 99 Ca -0.32 -1.47 0.22 0.00 -1.81 0.00 0.00 61.98 58.61 1tug s VAL 99 Cb 0.10 -3.11 -0.14 0.00 0.56 0.00 0.00 36.38 33.79 1tug s VAL 99 CO 0.49 -0.17 0.86 0.47 -0.31 0.00 0.00 175.10 176.45 1tug n ASP 100 N -1.32 0.52 -3.56 4.85 8.00 0.79 -4.87 116.55 120.96 1tug n ASP 100 Ca -0.02 0.06 -0.10 0.00 0.71 0.00 0.00 54.79 55.44 1tug n ASP 100 Cb 0.60 1.03 -0.02 0.00 -0.02 0.00 0.00 41.12 42.71 1tug n ASP 100 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1tug s ALA 101 N -3.36 -1.57 -0.18 2.24 0.00 -1.22 -4.36 121.76 113.31 1tug s ALA 101 Ca -0.02 0.39 0.00 0.00 0.00 0.00 0.00 51.96 52.33 1tug s ALA 101 Cb 0.12 0.77 0.04 0.00 0.00 0.00 0.00 23.12 24.06 1tug s ALA 101 CO 0.83 -0.83 -0.08 0.42 0.00 0.00 0.00 175.76 176.10 1tug s ILE 102 N -3.63 1.37 -0.18 0.00 1.01 0.17 -1.60 121.20 118.34 1tug s ILE 102 Ca 0.05 -0.80 -0.14 0.00 0.00 0.00 0.00 60.65 59.76 1tug s ILE 102 Cb -0.02 -1.49 -0.04 0.00 0.01 0.00 0.00 42.46 40.92 1tug s ILE 102 CO -0.07 0.16 0.30 -0.69 0.00 0.00 0.00 174.94 174.65 1tug s VAL 103 N 1.52 5.28 -0.09 2.92 1.01 -0.13 -1.20 120.40 129.71 1tug s VAL 103 Ca 0.00 0.54 -0.08 0.00 0.00 0.00 0.00 61.98 62.44 1tug s VAL 103 Cb -0.16 -3.64 0.03 0.00 0.00 0.00 0.00 36.38 32.61 1tug s VAL 103 CO -0.08 0.35 0.25 0.00 0.00 0.00 0.00 175.10 175.61 1tug s MET 104 N 0.78 0.28 -0.09 2.72 0.00 -0.73 -0.98 119.30 121.27 1tug s MET 104 Ca 0.16 0.37 -0.01 0.00 0.00 0.00 0.00 55.69 56.21 1tug s MET 104 Cb -0.13 0.11 -0.03 0.00 0.00 0.00 0.00 34.83 34.78 1tug s MET 104 CO 0.05 -0.05 -0.05 0.50 0.00 0.00 0.00 175.02 175.47 1tug s ARG 105 N 0.26 3.04 -0.10 3.16 3.52 -0.89 -0.99 118.95 126.94 1tug s ARG 105 Ca -0.01 -0.51 -0.17 0.00 -0.13 0.00 0.00 55.73 54.91 1tug s ARG 105 Cb -0.03 -2.71 0.04 0.00 -1.56 0.00 0.00 34.95 30.69 1tug s ARG 105 CO -0.01 0.56 0.43 -1.58 -0.81 0.00 0.00 175.30 173.90 1tug s HIS 106 N -0.52 -0.41 0.44 5.12 2.46 0.35 -2.04 115.29 120.69 1tug s HIS 106 Ca 0.08 0.89 0.19 0.00 0.47 0.00 0.00 55.06 56.69 1tug s HIS 106 Cb -0.12 0.17 1.14 0.00 -0.13 0.00 0.00 32.58 33.65 1tug s HIS 106 CO 0.02 -0.33 1.87 -1.00 -2.47 0.00 0.00 174.74 172.83 1tug h PRO 107 N 4.65 0.33 -5.70 2.88 0.13 -1.87 -0.38 132.00 132.04 1tug h PRO 107 Ca -0.28 -0.02 -0.66 0.00 -0.87 0.00 0.00 66.00 64.17 1tug h PRO 107 Cb 1.17 -0.07 -0.07 0.00 0.13 0.00 0.00 31.00 32.16 1tug h PRO 107 CO 0.30 0.22 -0.44 -0.65 -0.23 0.00 0.00 178.00 177.20 1tug s GLN 108 N -5.35 3.50 0.38 0.86 1.11 -1.26 -3.93 119.66 114.97 1tug s GLN 108 Ca -0.08 -0.06 -0.26 0.00 0.01 0.00 0.00 55.36 54.97 1tug s GLN 108 Cb 0.22 -3.19 -0.09 0.00 -1.01 0.00 0.00 33.01 28.94 1tug s GLN 108 CO 0.78 0.76 1.24 -1.21 0.01 0.00 0.00 175.29 176.87 1tug s GLU 109 N -1.07 4.10 0.00 2.91 8.01 -1.25 -2.93 118.70 128.47 1tug s GLU 109 Ca 0.17 2.03 0.00 0.00 0.01 0.00 0.00 54.97 57.17 1tug s GLU 109 Cb -0.13 -2.80 0.00 0.00 -4.31 0.00 0.00 34.13 26.89 1tug s GLU 109 CO 0.06 -0.34 0.00 0.41 0.01 0.00 0.00 175.26 175.40 1tug n GLY 110 N 0.71 1.51 0.20 -1.39 0.00 -1.26 -4.93 105.19 100.03 1tug n GLY 110 Ca 0.03 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.00 1tug n GLY 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tug h ALA 111 N 0.00 0.18 -0.44 4.61 0.00 -1.87 -0.91 119.26 120.84 1tug h ALA 111 Ca 0.00 0.14 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 1tug h ALA 111 Cb 0.00 0.36 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1tug h ALA 111 CO 0.00 -0.50 0.06 0.00 0.00 0.00 0.00 179.25 178.80 1tug h ALA 112 N 1.27 1.28 -0.26 0.00 0.00 -1.91 -1.51 119.26 118.13 1tug h ALA 112 Ca 0.18 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 1tug h ALA 112 Cb 0.34 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1tug h ALA 112 CO -0.41 0.49 0.05 -0.09 0.00 0.00 0.00 179.25 179.29 1tug h ARG 113 N 0.65 0.43 -0.76 0.00 2.43 -1.70 -2.63 114.38 112.79 1tug h ARG 113 Ca 0.14 -0.11 0.07 0.00 -0.81 0.00 0.00 59.98 59.27 1tug h ARG 113 Cb 0.32 -0.05 -0.06 0.00 -0.42 0.00 0.00 29.97 29.76 1tug h ARG 113 CO 0.01 0.55 0.44 1.25 -1.51 0.00 0.00 179.97 180.70 1tug h LEU 114 N 0.25 0.65 -0.90 3.80 6.46 -0.94 -2.47 115.31 122.16 1tug h LEU 114 Ca 0.08 0.03 0.17 0.00 -0.12 0.00 0.00 57.88 58.05 1tug h LEU 114 Cb 0.32 -0.09 -0.10 0.00 -0.73 0.00 0.00 40.66 40.05 1tug h LEU 114 CO 0.00 0.40 0.47 0.00 -0.62 0.00 0.00 178.44 178.69 1tug h ALA 115 N 1.40 1.41 0.00 1.25 0.00 -0.92 0.87 119.26 123.27 1tug h ALA 115 Ca 0.35 0.10 -0.03 0.00 0.00 0.00 0.00 54.91 55.34 1tug h ALA 115 Cb 0.25 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 1tug h ALA 115 CO -0.21 -0.14 -0.12 1.79 0.00 0.00 0.00 179.25 180.57 1tug h THR 116 N 0.61 0.39 0.00 0.00 1.35 -1.20 -0.80 112.91 113.25 1tug h THR 116 Ca 0.51 -0.71 0.00 0.00 -0.55 0.00 0.00 66.41 65.67 1tug h THR 116 Cb 0.81 1.51 0.00 0.00 -1.73 0.00 0.00 68.15 68.74 1tug h THR 116 CO -0.41 0.12 0.00 -0.62 -0.25 0.00 0.00 175.52 174.37 1tug n GLU 117 N -3.38 0.15 0.00 4.72 1.02 0.30 -3.98 120.64 119.47 1tug n GLU 117 Ca -0.01 0.16 0.00 0.00 -0.02 0.00 0.00 57.16 57.29 1tug n GLU 117 Cb 0.31 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.23 1tug n GLU 117 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 1tug n PHE 118 N -1.37 0.00 1.65 -0.32 3.01 -0.40 -4.76 117.46 115.27 1tug n PHE 118 Ca 0.06 0.00 0.15 0.00 1.01 0.00 0.00 57.45 58.67 1tug n PHE 118 Cb 0.16 0.00 0.67 0.00 -0.01 0.00 0.00 39.48 40.30 1tug n PHE 118 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 1tug n SER 119 N -0.04 0.87 0.00 4.37 3.41 -0.66 -4.09 113.62 117.47 1tug n SER 119 Ca 0.00 -1.21 0.00 0.00 -0.26 0.00 0.00 58.87 57.40 1tug n SER 119 Cb 0.15 -0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.10 1tug n SER 119 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1tug n GLY 120 N 1.13 1.50 0.87 5.00 0.00 -1.26 -0.58 105.19 111.85 1tug n GLY 120 Ca 0.20 0.13 0.08 0.00 0.00 0.00 0.00 46.02 46.43 1tug n GLY 120 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1tug n ASN 121 N 11.14 3.79 -4.66 1.61 3.02 -1.26 -4.93 115.26 123.96 1tug n ASN 121 Ca 0.00 -2.90 -0.39 0.00 -0.03 0.00 0.00 54.58 51.25 1tug n ASN 121 Cb 0.00 -0.51 -0.06 0.00 -0.61 0.00 0.00 39.78 38.60 1tug n ASN 121 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1tug s VAL 122 N -2.62 5.07 0.29 2.41 1.01 0.25 -5.03 120.40 121.78 1tug s VAL 122 Ca 0.40 1.04 -0.29 0.00 0.00 0.00 0.00 61.98 63.13 1tug s VAL 122 Cb 0.32 -3.88 -0.10 0.00 0.00 0.00 0.00 36.38 32.72 1tug s VAL 122 CO 0.10 0.15 1.17 -2.84 0.00 0.00 0.00 175.10 173.68 1tug s PRO 123 N 1.74 4.54 -0.23 2.72 0.02 -1.26 -4.77 135.00 137.76 1tug s PRO 123 Ca 0.26 1.93 -0.06 0.00 0.02 0.00 0.00 61.00 63.15 1tug s PRO 123 Cb -0.16 -3.16 -0.03 0.00 0.02 0.00 0.00 34.50 31.18 1tug s PRO 123 CO 0.10 0.07 0.04 0.08 -0.33 0.00 0.00 177.00 176.96 1tug s VAL 124 N -1.07 4.12 -0.20 3.83 1.01 -1.26 -0.65 120.40 126.18 1tug s VAL 124 Ca 0.46 -0.24 -0.03 0.00 0.00 0.00 0.00 61.98 62.17 1tug s VAL 124 Cb -0.34 -2.90 -0.01 0.00 0.00 0.00 0.00 36.38 33.12 1tug s VAL 124 CO 0.44 0.38 -0.05 -0.76 0.00 0.00 0.00 175.10 175.10 1tug s LEU 125 N 1.39 2.93 -0.33 3.92 1.02 -0.34 -1.45 118.68 125.82 1tug s LEU 125 Ca 0.05 -0.34 -0.28 0.00 0.02 0.00 0.00 54.13 53.58 1tug s LEU 125 Cb -0.15 -1.73 0.02 0.00 0.02 0.00 0.00 46.19 44.35 1tug s LEU 125 CO 0.02 0.04 1.04 0.21 0.02 0.00 0.00 176.35 177.68 1tug s ASN 126 N 1.13 6.88 0.00 2.29 2.47 -0.11 -1.78 114.94 125.82 1tug s ASN 126 Ca 0.02 0.97 0.19 0.00 0.42 0.00 0.00 52.86 54.46 1tug s ASN 126 Cb -0.15 -2.53 0.54 0.00 -1.45 0.00 0.00 41.25 37.67 1tug s ASN 126 CO -0.01 -0.86 1.45 0.00 -3.72 0.00 0.00 177.10 173.96 1tug n ALA 127 N 6.83 2.40 0.00 1.71 0.00 -0.16 -4.28 120.51 127.01 1tug n ALA 127 Ca 0.11 -1.07 0.00 0.00 0.00 0.00 0.00 53.44 52.48 1tug n ALA 127 Cb 0.47 -0.95 0.00 0.00 0.00 0.00 0.00 19.45 18.97 1tug n ALA 127 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1tug n GLY 128 N 1.48 3.51 2.70 0.00 0.00 -1.24 -4.72 105.19 106.91 1tug n GLY 128 Ca 0.20 -0.49 -0.29 0.00 0.00 0.00 0.00 46.02 45.45 1tug n GLY 128 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1tug s ASP 129 N 0.00 3.54 0.87 1.61 -4.77 -1.07 0.13 116.67 116.99 1tug s ASP 129 Ca 0.00 -2.90 0.00 0.00 -3.30 0.00 0.00 52.55 46.35 1tug s ASP 129 Cb 0.00 -1.06 0.00 0.00 -1.09 0.00 0.00 42.92 40.77 1tug s ASP 129 CO 0.00 -0.22 0.00 0.61 0.70 0.00 0.00 175.17 176.26 1tug n GLY 130 N 3.18 2.75 0.72 2.12 0.00 -0.15 -2.18 105.19 111.62 1tug n GLY 130 Ca 0.13 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.82 1tug n GLY 130 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1tug n SER 131 N 0.66 1.84 0.00 1.61 3.41 -1.26 -4.57 113.62 115.31 1tug n SER 131 Ca 0.00 -1.97 0.00 0.00 -0.26 0.00 0.00 58.87 56.64 1tug n SER 131 Cb 0.00 -0.49 0.00 0.00 -0.26 0.00 0.00 64.21 63.46 1tug n SER 131 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1tug n ASN 132 N 0.22 0.00 -4.32 4.04 5.15 -0.93 -4.96 115.26 114.46 1tug n ASN 132 Ca 0.00 0.00 -0.17 0.00 -0.60 0.00 0.00 54.58 53.81 1tug n ASN 132 Cb 0.35 -0.12 -0.10 0.00 -0.53 0.00 0.00 39.78 39.38 1tug n ASN 132 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1tug s GLN 133 N -0.30 1.32 -0.47 1.20 -1.52 -1.26 -4.99 119.66 113.64 1tug s GLN 133 Ca 0.00 -1.67 0.06 0.00 -1.95 0.00 0.00 55.36 51.80 1tug s GLN 133 Cb 0.00 -0.57 0.29 0.00 -0.22 0.00 0.00 33.01 32.51 1tug s GLN 133 CO 0.00 -0.11 1.02 1.58 -0.25 0.00 0.00 175.29 177.53 1tug n HIS 134 N -0.41 -3.00 0.09 0.91 -0.00 -1.26 -2.58 115.22 108.98 1tug n HIS 134 Ca -0.05 -2.02 0.05 0.00 -0.00 0.00 0.00 57.72 55.70 1tug n HIS 134 Cb 0.64 1.56 0.49 0.00 -0.00 0.00 0.00 29.99 32.68 1tug n HIS 134 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 1tug h PRO 135 N 3.40 0.34 0.00 1.57 0.11 -1.85 -0.68 132.00 134.89 1tug h PRO 135 Ca -0.11 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.97 1tug h PRO 135 Cb 1.07 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.10 1tug h PRO 135 CO 0.22 0.24 0.00 1.79 -0.21 0.00 0.00 178.00 180.04 1tug h THR 136 N 0.35 0.00 -0.13 -1.15 1.35 -1.96 -1.31 112.91 110.06 1tug h THR 136 Ca 0.09 -0.73 -0.03 0.00 -0.55 0.00 0.00 66.41 65.19 1tug h THR 136 Cb -0.01 1.72 -0.00 0.00 -1.73 0.00 0.00 68.15 68.12 1tug h THR 136 CO -0.02 0.00 -0.04 -0.61 -0.25 0.00 0.00 175.52 174.61 1tug h GLN 137 N 0.00 0.26 -0.76 4.72 5.75 -1.50 -1.83 115.11 121.76 1tug h GLN 137 Ca 0.00 -0.10 0.04 0.00 -0.15 0.00 0.00 58.65 58.44 1tug h GLN 137 Cb 0.84 -0.01 -0.05 0.00 1.07 0.00 0.00 27.48 29.33 1tug h GLN 137 CO 0.00 0.56 0.47 1.15 -2.65 0.00 0.00 178.83 178.36 1tug h THR 138 N -0.05 1.09 -0.37 2.39 2.02 -1.29 -1.57 112.91 115.13 1tug h THR 138 Ca 0.03 -0.31 -0.08 0.00 0.77 0.00 0.00 66.41 66.82 1tug h THR 138 Cb 0.46 0.10 -0.02 0.00 -1.74 0.00 0.00 68.15 66.96 1tug h THR 138 CO 0.01 0.17 -0.09 -0.07 0.37 0.00 0.00 175.52 175.91 1tug h LEU 139 N 0.91 0.61 -0.93 2.58 3.38 -1.22 -0.18 115.31 120.45 1tug h LEU 139 Ca 0.31 -0.16 -0.07 0.00 0.09 0.00 0.00 57.88 58.05 1tug h LEU 139 Cb 0.05 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1tug h LEU 139 CO -0.13 0.74 -0.34 0.17 0.09 0.00 0.00 178.44 178.98 1tug h LEU 140 N 0.58 0.00 0.11 1.67 -0.00 -0.93 -2.22 115.31 114.51 1tug h LEU 140 Ca 0.11 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 57.98 1tug h LEU 140 Cb 0.51 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.17 1tug h LEU 140 CO 0.03 0.34 -0.05 0.44 -0.00 0.00 0.00 178.44 179.20 1tug h ASP 141 N 0.00 -0.12 -0.25 0.17 3.32 -0.27 -2.08 116.42 117.18 1tug h ASP 141 Ca -0.00 -0.32 0.05 0.00 0.02 0.00 0.00 57.03 56.77 1tug h ASP 141 Cb 0.88 0.03 -0.04 0.00 0.22 0.00 0.00 39.33 40.42 1tug h ASP 141 CO 0.04 0.27 -0.02 -0.07 -1.72 0.00 0.00 179.24 177.75 1tug h LEU 142 N -0.54 -0.14 -0.76 1.55 3.38 -1.07 -1.04 115.31 116.69 1tug h LEU 142 Ca -0.01 0.06 0.16 0.00 0.09 0.00 0.00 57.88 58.18 1tug h LEU 142 Cb 0.44 0.12 -0.11 0.00 0.09 0.00 0.00 40.66 41.20 1tug h LEU 142 CO 0.02 -0.04 0.25 0.15 0.09 0.00 0.00 178.44 178.92 1tug h PHE 143 N 0.06 0.42 -0.12 1.13 -0.00 -1.41 0.55 116.94 117.56 1tug h PHE 143 Ca 0.12 0.04 -0.13 0.00 -0.00 0.00 0.00 57.97 58.00 1tug h PHE 143 Cb 0.16 -0.07 -0.01 0.00 -0.00 0.00 0.00 35.95 36.04 1tug h PHE 143 CO -0.21 -0.02 -0.51 1.15 -0.00 0.00 0.00 178.31 178.71 1tug h THR 144 N 0.35 1.34 -0.17 4.41 2.02 -0.85 0.10 112.91 120.11 1tug h THR 144 Ca 0.43 -1.76 -0.15 0.00 0.77 0.00 0.00 66.41 65.71 1tug h THR 144 Cb 0.72 1.81 0.00 0.00 -1.74 0.00 0.00 68.15 68.95 1tug h THR 144 CO -0.47 0.53 -0.49 0.40 0.37 0.00 0.00 175.52 175.86 1tug h ILE 145 N 0.26 1.33 -0.03 3.11 2.04 0.12 -2.12 117.51 122.22 1tug h ILE 145 Ca 0.01 -1.73 -0.15 0.00 1.00 0.00 0.00 64.86 63.99 1tug h ILE 145 Cb 0.99 1.95 -0.02 0.00 -0.74 0.00 0.00 36.82 39.01 1tug h ILE 145 CO 0.08 0.54 -0.66 -0.61 0.00 0.00 0.00 178.15 177.50 1tug h GLN 146 N 0.31 0.13 0.02 2.37 4.15 0.15 0.59 115.11 122.83 1tug h GLN 146 Ca -0.01 -0.10 -0.21 0.00 0.77 0.00 0.00 58.65 59.10 1tug h GLN 146 Cb 1.10 0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.80 1tug h GLN 146 CO 0.10 0.74 -0.95 1.05 -1.93 0.00 0.00 178.83 177.85 1tug h GLU 147 N 0.09 0.15 0.13 1.69 4.11 -0.77 0.13 114.58 120.11 1tug h GLU 147 Ca -0.01 -0.19 -0.31 0.00 0.07 0.00 0.00 59.36 58.92 1tug h GLU 147 Cb 1.18 0.06 -0.00 0.00 0.50 0.00 0.00 28.75 30.49 1tug h GLU 147 CO 0.10 0.99 -1.61 1.79 0.07 0.00 0.00 179.01 180.34 1tug h THR 148 N 0.07 0.93 0.17 -1.06 1.35 -1.37 -3.40 112.91 109.59 1tug h THR 148 Ca -0.05 -2.41 -0.32 0.00 -0.55 0.00 0.00 66.41 63.08 1tug h THR 148 Cb 1.62 2.67 0.01 0.00 -1.73 0.00 0.00 68.15 70.72 1tug h THR 148 CO 0.14 0.77 -1.51 1.56 -0.25 0.00 0.00 175.52 176.23 1tug h GLN 149 N -0.14 0.36 0.00 4.72 1.08 0.11 -3.48 115.11 117.76 1tug h GLN 149 Ca -0.34 -0.61 0.00 0.00 -1.45 0.00 0.00 58.65 56.25 1tug h GLN 149 Cb 1.89 0.23 0.00 0.00 -0.05 0.00 0.00 27.48 29.55 1tug h GLN 149 CO 0.09 1.26 0.00 0.41 -0.95 0.00 0.00 178.83 179.64 1tug n GLY 150 N 1.69 2.41 3.67 3.46 0.00 0.03 -5.03 105.19 111.42 1tug n GLY 150 Ca -0.17 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.74 1tug n GLY 150 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1tug s ARG 151 N -0.72 2.12 0.00 1.61 1.70 -1.25 -4.98 118.95 117.43 1tug s ARG 151 Ca 0.00 -1.60 0.00 0.00 -0.47 0.00 0.00 55.73 53.66 1tug s ARG 151 Cb 0.00 0.55 0.00 0.00 -0.57 0.00 0.00 34.95 34.93 1tug s ARG 151 CO 0.00 -0.95 0.28 1.28 -1.08 0.00 0.00 175.30 174.83 1tug n LEU 152 N -0.55 0.56 -4.64 -1.89 4.77 -1.26 -4.21 117.00 109.77 1tug n LEU 152 Ca -0.04 -0.65 -0.26 0.00 -0.03 0.00 0.00 56.01 55.03 1tug n LEU 152 Cb 0.61 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.60 1tug n LEU 152 CO 0.28 0.14 -0.28 1.51 -1.33 0.00 0.00 177.39 177.71 1tug s ASP 153 N -0.18 4.04 -1.31 -1.43 1.47 -1.26 -4.53 116.67 113.47 1tug s ASP 153 Ca 0.00 -1.19 -0.00 0.00 1.18 0.00 0.00 52.55 52.53 1tug s ASP 153 Cb 0.00 -0.44 0.00 0.00 -0.34 0.00 0.00 42.92 42.14 1tug s ASP 153 CO 0.00 -0.38 0.69 0.59 0.68 0.00 0.00 175.17 176.75 1tug n ASN 154 N -1.00 -1.12 -4.61 2.11 4.13 0.36 -4.94 115.26 110.19 1tug n ASN 154 Ca -0.04 -0.82 -0.27 0.00 1.68 0.00 0.00 54.58 55.13 1tug n ASN 154 Cb 0.65 -4.04 -0.09 0.00 -1.54 0.00 0.00 39.78 34.76 1tug n ASN 154 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1tug s LEU 155 N -6.68 3.11 -0.43 3.41 1.43 -1.25 -4.95 118.68 113.32 1tug s LEU 155 Ca 0.00 -0.49 -0.09 0.00 -1.03 0.00 0.00 54.13 52.52 1tug s LEU 155 Cb -0.00 -1.79 0.09 0.00 0.03 0.00 0.00 46.19 44.52 1tug s LEU 155 CO 0.81 0.11 0.29 -1.00 0.23 0.00 0.00 176.35 176.79 1tug s HIS 156 N -1.66 3.36 -0.26 0.29 3.76 -1.26 -0.73 115.29 118.79 1tug s HIS 156 Ca 0.25 -1.61 -0.07 0.00 -0.15 0.00 0.00 55.06 53.49 1tug s HIS 156 Cb -0.09 -3.11 -0.02 0.00 1.11 0.00 0.00 32.58 30.47 1tug s HIS 156 CO 0.16 -0.89 0.07 0.08 -0.85 0.00 0.00 174.74 173.32 1tug s VAL 157 N 1.41 4.21 -0.24 -0.90 1.01 -0.55 -0.56 120.40 124.78 1tug s VAL 157 Ca 0.04 -0.30 -0.08 0.00 0.00 0.00 0.00 61.98 61.64 1tug s VAL 157 Cb -0.24 -3.01 -0.04 0.00 0.00 0.00 0.00 36.38 33.09 1tug s VAL 157 CO 0.01 0.28 0.09 0.00 0.00 0.00 0.00 175.10 175.49 1tug s ALA 158 N 1.59 3.29 -0.17 5.51 0.00 -0.34 -0.96 121.76 130.68 1tug s ALA 158 Ca 0.06 -1.03 -0.03 0.00 0.00 0.00 0.00 51.96 50.95 1tug s ALA 158 Cb -0.15 -2.12 -0.02 0.00 0.00 0.00 0.00 23.12 20.82 1tug s ALA 158 CO 0.03 -0.34 -0.05 -1.64 0.00 0.00 0.00 175.76 173.76 1tug s MET 159 N 1.34 3.55 0.01 0.00 1.00 -0.31 -0.84 119.30 124.05 1tug s MET 159 Ca 0.06 -0.57 0.04 0.00 0.00 0.00 0.00 55.69 55.21 1tug s MET 159 Cb -0.15 -2.91 -0.01 0.00 0.00 0.00 0.00 34.83 31.76 1tug s MET 159 CO 0.05 0.11 -0.12 0.08 0.00 0.00 0.00 175.02 175.13 1tug s VAL 160 N 0.70 0.93 0.00 -6.03 1.01 -0.19 -2.13 120.40 114.69 1tug s VAL 160 Ca -0.02 -0.70 0.00 0.00 0.00 0.00 0.00 61.98 61.26 1tug s VAL 160 Cb -0.15 -0.81 0.00 0.00 0.00 0.00 0.00 36.38 35.42 1tug s VAL 160 CO 0.02 0.11 0.00 0.61 0.00 0.00 0.00 175.10 175.84 1tug n GLY 161 N 2.39 0.26 3.50 4.51 0.00 -1.06 -1.62 105.19 113.17 1tug n GLY 161 Ca -0.16 -1.75 -0.42 0.00 0.00 0.00 0.00 46.02 43.69 1tug n GLY 161 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1tug s ASP 162 N -4.00 6.20 0.00 1.61 3.68 -1.26 -4.17 116.67 118.73 1tug s ASP 162 Ca 0.00 -0.70 0.24 0.00 2.13 0.00 0.00 52.55 54.22 1tug s ASP 162 Cb 0.00 -2.47 0.27 0.00 -1.45 0.00 0.00 42.92 39.27 1tug s ASP 162 CO 0.00 -1.55 1.25 0.18 0.13 0.00 0.00 175.17 175.18 1tug n LEU 163 N 8.27 0.81 -0.02 -1.34 4.77 -0.71 -3.10 117.00 125.67 1tug n LEU 163 Ca -0.01 -0.23 -0.17 0.00 -0.03 0.00 0.00 56.01 55.57 1tug n LEU 163 Cb 0.47 -0.14 -0.14 0.00 -2.33 0.00 0.00 43.42 41.28 1tug n LEU 163 CO 0.67 0.19 0.16 0.50 -1.33 0.00 0.00 177.39 177.57 1tug h LYS 164 N 0.28 0.12 -0.01 3.23 3.64 -1.44 -3.38 116.57 119.01 1tug h LYS 164 Ca 0.00 -0.21 0.00 0.00 -1.27 0.00 0.00 60.65 59.17 1tug h LYS 164 Cb 0.52 0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.42 1tug h LYS 164 CO 0.00 1.10 -0.50 0.66 -2.27 0.00 0.00 179.45 178.44 1tug n TYR 165 N -4.38 0.00 -1.94 1.91 4.01 -1.26 -4.81 117.16 110.69 1tug n TYR 165 Ca -0.14 0.00 -0.24 0.00 -0.16 0.00 0.00 57.90 57.37 1tug n TYR 165 Cb 0.64 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.62 1tug n TYR 165 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1tug s GLY 166 N -2.41 -0.04 0.51 2.72 0.00 -1.18 -4.82 107.32 102.09 1tug s GLY 166 Ca 0.16 -1.36 0.23 0.00 0.00 0.00 0.00 44.72 43.76 1tug s GLY 166 CO 0.57 3.65 2.07 -0.09 0.00 0.00 0.00 173.10 179.30 1tug h ARG 167 N 11.58 0.00 0.00 2.90 2.43 -1.90 -2.71 114.38 126.68 1tug h ARG 167 Ca 0.08 0.00 -0.16 0.00 -0.81 0.00 0.00 59.98 59.09 1tug h ARG 167 Cb 1.00 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.53 1tug h ARG 167 CO 1.16 0.12 -1.12 1.79 -1.51 0.00 0.00 179.97 180.42 1tug h THR 168 N 0.00 0.74 -0.57 0.20 1.35 -1.96 -2.39 112.91 110.28 1tug h THR 168 Ca -0.00 -2.24 -0.09 0.00 -0.55 0.00 0.00 66.41 63.53 1tug h THR 168 Cb 0.29 2.25 -0.02 0.00 -1.73 0.00 0.00 68.15 68.94 1tug h THR 168 CO 0.02 0.42 0.01 -0.37 -0.25 0.00 0.00 175.52 175.35 1tug h VAL 169 N 0.00 1.26 -0.64 6.82 -1.51 -1.88 0.17 116.25 120.47 1tug h VAL 169 Ca -0.11 -1.09 -0.01 0.00 -1.23 0.00 0.00 66.70 64.25 1tug h VAL 169 Cb 1.57 0.80 -0.03 0.00 -2.13 0.00 0.00 31.29 31.50 1tug h VAL 169 CO 0.06 0.40 0.35 0.45 -1.23 0.00 0.00 177.57 177.60 1tug h HIS 170 N 0.91 0.88 -0.31 5.19 3.86 -1.52 -1.00 115.15 123.15 1tug h HIS 170 Ca 0.17 -0.02 -0.07 0.00 -1.16 0.00 0.00 60.37 59.29 1tug h HIS 170 Cb 0.51 -0.28 -0.01 0.00 1.06 0.00 0.00 27.41 28.69 1tug h HIS 170 CO 0.03 0.63 -0.07 1.03 0.86 0.00 0.00 177.93 180.41 1tug h SER 171 N 0.87 0.60 -0.71 2.45 0.87 -1.15 -2.54 113.55 113.95 1tug h SER 171 Ca 0.23 -0.36 -0.07 0.00 -1.23 0.00 0.00 61.79 60.36 1tug h SER 171 Cb 0.04 -0.16 -0.03 0.00 -0.44 0.00 0.00 62.40 61.81 1tug h SER 171 CO -0.04 0.82 0.18 0.25 -0.53 0.00 0.00 176.83 177.51 1tug h LEU 172 N 0.37 1.07 -0.93 2.23 5.85 -0.49 -1.81 115.31 121.61 1tug h LEU 172 Ca 0.08 -0.23 -0.09 0.00 0.84 0.00 0.00 57.88 58.48 1tug h LEU 172 Cb 0.55 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.29 1tug h LEU 172 CO 0.03 1.03 -0.23 0.74 -0.34 0.00 0.00 178.44 179.67 1tug h THR 173 N 1.08 1.26 -0.37 1.05 2.02 -1.17 -0.75 112.91 116.03 1tug h THR 173 Ca 0.22 -1.24 -0.11 0.00 0.77 0.00 0.00 66.41 66.06 1tug h THR 173 Cb 0.37 1.30 -0.01 0.00 -1.74 0.00 0.00 68.15 68.07 1tug h THR 173 CO 0.00 0.40 -0.21 1.56 0.37 0.00 0.00 175.52 177.64 1tug h GLN 174 N 0.46 0.71 -0.01 6.66 4.20 -1.05 -0.88 115.11 125.20 1tug h GLN 174 Ca 0.07 -0.27 -0.01 0.00 0.06 0.00 0.00 58.65 58.50 1tug h GLN 174 Cb 0.65 -0.04 -0.00 0.00 0.30 0.00 0.00 27.48 28.39 1tug h GLN 174 CO 0.05 0.86 -0.01 0.00 -0.67 0.00 0.00 178.83 179.06 1tug h ALA 175 N 1.14 0.02 -0.07 3.87 0.00 -0.92 -3.25 119.26 120.05 1tug h ALA 175 Ca 0.09 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 54.70 1tug h ALA 175 Cb 0.69 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1tug h ALA 175 CO 0.05 -0.22 -0.16 -0.07 0.00 0.00 0.00 179.25 178.86 1tug h LEU 176 N -0.47 0.11 -1.25 0.00 3.38 -1.15 -1.36 115.31 114.57 1tug h LEU 176 Ca 0.00 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1tug h LEU 176 Cb 0.53 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.25 1tug h LEU 176 CO 0.00 0.28 0.00 0.00 0.09 0.00 0.00 178.44 178.81 1tug h ALA 177 N 1.73 1.00 0.00 1.53 0.00 -1.18 -1.59 119.26 120.75 1tug h ALA 177 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1tug h ALA 177 Cb 0.35 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1tug h ALA 177 CO 0.02 0.00 0.00 0.87 0.00 0.00 0.00 179.25 180.14 1tug h LYS 178 N 0.00 0.00 0.00 0.00 1.57 -1.33 -3.46 116.57 113.35 1tug h LYS 178 Ca 0.00 0.00 -0.37 0.00 -1.87 0.00 0.00 60.65 58.41 1tug h LYS 178 Cb 0.13 0.00 0.03 0.00 0.08 0.00 0.00 32.23 32.47 1tug h LYS 178 CO 0.00 0.00 -0.03 1.19 -0.57 0.00 0.00 179.45 180.04 1tug n PHE 179 N -2.57 -2.54 -4.14 -1.35 3.72 -0.60 -4.92 117.46 105.06 1tug n PHE 179 Ca 0.05 -1.58 -0.28 0.00 -0.05 0.00 0.00 57.45 55.59 1tug n PHE 179 Cb 0.46 -0.44 -0.07 0.00 -0.94 0.00 0.00 39.48 38.49 1tug n PHE 179 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1tug s ASP 180 N -3.79 5.05 -1.61 4.37 -0.00 -1.26 -4.69 116.67 114.74 1tug s ASP 180 Ca 0.47 -0.23 0.00 0.00 -0.00 0.00 0.00 52.55 52.79 1tug s ASP 180 Cb -0.04 -1.19 0.00 0.00 -0.00 0.00 0.00 42.92 41.69 1tug s ASP 180 CO 0.30 0.13 0.00 0.61 -0.00 0.00 0.00 175.17 176.21 1tug n GLY 181 N 0.21 -0.04 3.88 0.21 0.00 -1.26 0.13 105.19 108.32 1tug n GLY 181 Ca -0.10 -0.13 -0.31 0.00 0.00 0.00 0.00 46.02 45.49 1tug n GLY 181 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1tug s ASN 182 N -2.28 6.58 -0.13 1.61 0.01 -1.26 -3.32 114.94 116.14 1tug s ASN 182 Ca 0.00 0.98 0.01 0.00 -0.71 0.00 0.00 52.86 53.14 1tug s ASN 182 Cb 0.00 -2.25 0.02 0.00 0.41 0.00 0.00 41.25 39.43 1tug s ASN 182 CO 0.00 -0.21 -0.13 -0.60 -1.51 0.00 0.00 177.10 174.65 1tug s ARG 183 N -3.29 2.09 -0.13 -0.60 3.52 0.09 -3.83 118.95 116.80 1tug s ARG 183 Ca 0.49 -0.49 -0.07 0.00 -0.13 0.00 0.00 55.73 55.53 1tug s ARG 183 Cb -0.11 -1.91 -0.04 0.00 -1.56 0.00 0.00 34.95 31.33 1tug s ARG 183 CO 0.25 -0.19 0.10 -0.06 -0.81 0.00 0.00 175.30 174.60 1tug s PHE 184 N 1.38 3.45 -0.19 5.12 0.40 0.14 -1.48 117.98 126.79 1tug s PHE 184 Ca 0.01 0.38 0.01 0.00 -0.60 0.00 0.00 56.93 56.73 1tug s PHE 184 Cb -0.13 -1.97 0.02 0.00 0.51 0.00 0.00 43.02 41.45 1tug s PHE 184 CO -0.07 0.54 -0.19 0.71 0.70 0.00 0.00 175.22 176.91 1tug s TYR 185 N -0.60 2.83 -0.21 0.36 4.12 -0.13 -1.71 117.35 122.02 1tug s TYR 185 Ca 0.12 -1.69 -0.08 0.00 0.02 0.00 0.00 57.07 55.44 1tug s TYR 185 Cb -0.12 -1.93 -0.04 0.00 -1.52 0.00 0.00 41.96 38.35 1tug s TYR 185 CO 0.02 -0.81 0.09 -0.06 0.02 0.00 0.00 175.55 174.81 1tug s PHE 186 N 1.28 3.23 -0.54 2.71 0.08 0.86 -1.17 117.98 124.44 1tug s PHE 186 Ca 0.04 0.02 0.04 0.00 0.12 0.00 0.00 56.93 57.14 1tug s PHE 186 Cb -0.14 -2.15 0.16 0.00 -0.57 0.00 0.00 43.02 40.32 1tug s PHE 186 CO -0.12 0.04 0.38 0.42 -0.10 0.00 0.00 175.22 175.84 1tug s ILE 187 N 0.76 1.66 0.30 0.64 1.01 -0.91 -1.18 121.20 123.48 1tug s ILE 187 Ca 0.04 -3.30 0.09 0.00 0.00 0.00 0.00 60.65 57.48 1tug s ILE 187 Cb -0.13 -2.12 -0.06 0.00 0.01 0.00 0.00 42.46 40.16 1tug s ILE 187 CO 0.02 -1.06 -0.11 0.00 0.00 0.00 0.00 174.94 173.80 1tug s ALA 188 N -0.50 2.66 0.56 9.38 0.00 -1.26 -2.55 121.76 130.05 1tug s ALA 188 Ca 0.26 -1.96 -0.15 0.00 0.00 0.00 0.00 51.96 50.10 1tug s ALA 188 Cb -0.07 -0.02 -0.06 0.00 0.00 0.00 0.00 23.12 22.98 1tug s ALA 188 CO -0.14 0.07 1.02 -1.25 0.00 0.00 0.00 175.76 175.46 1tug s PRO 189 N -3.63 3.66 0.49 0.00 0.04 -1.26 -4.93 135.00 129.37 1tug s PRO 189 Ca 0.30 1.00 0.14 0.00 0.04 0.00 0.00 61.00 62.48 1tug s PRO 189 Cb 0.01 -2.09 1.16 0.00 0.04 0.00 0.00 34.50 33.62 1tug s PRO 189 CO 0.14 -0.52 2.11 -0.44 0.04 0.00 0.00 177.00 178.33 1tug h ASP 190 N 0.51 0.14 1.37 6.66 5.19 -2.00 0.13 116.42 128.43 1tug h ASP 190 Ca -0.46 -0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 55.93 1tug h ASP 190 Cb 1.20 -0.04 -0.00 0.00 0.18 0.00 0.00 39.33 40.67 1tug h ASP 190 CO 0.60 0.10 -0.07 0.00 -3.12 0.00 0.00 179.24 176.75 1tug h ALA 191 N 1.90 0.98 -1.59 3.45 0.00 -2.01 -3.27 119.26 118.71 1tug h ALA 191 Ca 0.07 -0.07 -0.61 0.00 0.00 0.00 0.00 54.91 54.30 1tug h ALA 191 Cb 0.07 -0.01 -0.41 0.00 0.00 0.00 0.00 17.79 17.44 1tug h ALA 191 CO -0.01 0.09 -0.54 1.28 0.00 0.00 0.00 179.25 180.07 1tug n LEU 192 N -3.15 4.96 -4.83 0.00 4.77 0.44 -4.91 117.00 114.27 1tug n LEU 192 Ca 0.02 -5.27 -0.32 0.00 -0.03 0.00 0.00 56.01 50.41 1tug n LEU 192 Cb 0.43 -0.54 -0.03 0.00 -2.33 0.00 0.00 43.42 40.96 1tug n LEU 192 CO 0.31 2.22 0.69 0.00 -1.33 0.00 0.00 177.39 179.28 1tug s ALA 193 N -3.59 3.00 -0.09 -1.18 0.00 -1.14 -1.74 121.76 117.02 1tug s ALA 193 Ca 0.48 0.25 -0.34 0.00 0.00 0.00 0.00 51.96 52.36 1tug s ALA 193 Cb 0.38 -3.15 -0.11 0.00 0.00 0.00 0.00 23.12 20.24 1tug s ALA 193 CO -0.20 -0.31 1.92 -0.12 0.00 0.00 0.00 175.76 177.04 1tug n MET 194 N -1.56 2.21 -1.66 0.00 1.56 -1.26 -3.02 117.12 113.38 1tug n MET 194 Ca 0.07 0.80 -0.42 0.00 -0.27 0.00 0.00 57.70 57.88 1tug n MET 194 Cb 0.54 -2.70 0.00 0.00 2.15 0.00 0.00 33.22 33.21 1tug n MET 194 CO 0.00 0.00 0.00 -2.30 -0.73 0.00 0.00 175.97 172.94 1tug n PRO 195 N 6.88 1.75 -0.37 2.12 -0.02 -1.26 -4.86 135.00 139.24 1tug n PRO 195 Ca 0.23 0.62 -0.03 0.00 -2.02 0.00 0.00 63.50 62.30 1tug n PRO 195 Cb 0.31 -2.19 0.01 0.00 -0.02 0.00 0.00 33.50 31.61 1tug n PRO 195 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 1tug n GLN 196 N 0.33 -0.26 -0.05 -0.52 -0.06 -1.26 -1.42 117.38 114.14 1tug n GLN 196 Ca 0.07 1.43 0.21 0.00 -2.00 0.00 0.00 57.00 56.71 1tug n GLN 196 Cb 0.37 -2.12 0.67 0.00 -4.06 0.00 0.00 30.24 25.10 1tug n GLN 196 CO 0.00 0.00 0.00 0.10 -0.20 0.00 0.00 177.06 176.96 1tug h TYR 197 N 0.00 0.06 -0.09 3.69 -0.00 -2.00 0.10 116.97 118.74 1tug h TYR 197 Ca 0.29 0.00 -0.14 0.00 -0.00 0.00 0.00 58.73 58.88 1tug h TYR 197 Cb 0.52 -0.02 0.01 0.00 -0.00 0.00 0.00 36.73 37.24 1tug h TYR 197 CO -0.85 0.02 -0.50 0.82 -0.00 0.00 0.00 178.16 177.66 1tug h ILE 198 N 0.05 1.37 -0.94 -0.90 1.08 -1.60 -2.61 117.51 113.97 1tug h ILE 198 Ca 0.29 -1.84 0.05 0.00 -0.39 0.00 0.00 64.86 62.97 1tug h ILE 198 Cb 1.10 2.23 -0.06 0.00 -3.07 0.00 0.00 36.82 37.02 1tug h ILE 198 CO -0.02 0.55 0.62 -0.07 -0.69 0.00 0.00 178.15 178.54 1tug h LEU 199 N 0.08 1.00 -0.47 1.44 3.38 -0.80 -1.16 115.31 118.78 1tug h LEU 199 Ca -0.04 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.90 1tug h LEU 199 Cb 1.15 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.65 1tug h LEU 199 CO 0.10 0.67 0.16 0.44 0.09 0.00 0.00 178.44 179.90 1tug h ASP 200 N 1.15 0.67 0.06 -0.43 3.45 -1.18 0.16 116.42 120.30 1tug h ASP 200 Ca 0.39 -0.20 0.02 0.00 0.43 0.00 0.00 57.03 57.67 1tug h ASP 200 Cb 0.08 -0.18 -0.04 0.00 -0.56 0.00 0.00 39.33 38.63 1tug h ASP 200 CO -0.13 0.69 -0.24 -0.03 -1.57 0.00 0.00 179.24 177.96 1tug h MET 201 N 0.62 -0.39 -0.11 3.56 4.05 -0.92 -1.76 114.93 119.98 1tug h MET 201 Ca 0.15 0.03 0.03 0.00 -0.28 0.00 0.00 59.70 59.63 1tug h MET 201 Cb 0.25 0.09 -0.04 0.00 -0.80 0.00 0.00 31.60 31.10 1tug h MET 201 CO -0.01 -0.26 -0.10 -0.07 0.23 0.00 0.00 176.91 176.71 1tug h LEU 202 N -0.41 -0.30 -1.47 3.39 3.38 -1.01 -1.85 115.31 117.04 1tug h LEU 202 Ca 0.04 0.06 0.11 0.00 0.09 0.00 0.00 57.88 58.18 1tug h LEU 202 Cb 0.46 0.15 -0.05 0.00 0.09 0.00 0.00 40.66 41.31 1tug h LEU 202 CO -0.17 -0.13 0.48 0.44 0.09 0.00 0.00 178.44 179.15 1tug h ASP 203 N -0.11 0.52 -0.12 -0.43 3.32 -0.70 -0.92 116.42 117.98 1tug h ASP 203 Ca 0.08 0.02 -0.04 0.00 0.02 0.00 0.00 57.03 57.10 1tug h ASP 203 Cb 0.22 -0.09 -0.00 0.00 0.22 0.00 0.00 39.33 39.68 1tug h ASP 203 CO -0.18 0.30 -0.09 -0.08 -1.72 0.00 0.00 179.24 177.47 1tug h GLU 204 N 0.58 0.28 0.00 3.56 4.81 -0.84 -2.60 114.58 120.35 1tug h GLU 204 Ca 0.34 -0.14 0.00 0.00 -0.13 0.00 0.00 59.36 59.44 1tug h GLU 204 Cb 0.55 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.93 1tug h GLU 204 CO -0.12 0.66 0.00 1.63 -0.73 0.00 0.00 179.01 180.45 1tug n LYS 205 N -4.64 0.86 -3.48 1.92 5.02 -0.74 -4.90 118.16 112.20 1tug n LYS 205 Ca -0.06 0.00 -0.19 0.00 -2.02 0.00 0.00 58.31 56.03 1tug n LYS 205 Cb 0.32 -1.39 0.08 0.00 -0.02 0.00 0.00 35.03 34.02 1tug n LYS 205 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1tug n GLY 206 N 0.64 -0.42 3.78 0.72 0.00 -0.42 -5.01 105.19 104.47 1tug n GLY 206 Ca 0.16 0.15 -0.36 0.00 0.00 0.00 0.00 46.02 45.98 1tug n GLY 206 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1tug s ILE 207 N -3.34 5.43 0.03 -0.61 1.01 -0.77 -5.02 121.20 117.94 1tug s ILE 207 Ca 0.23 0.22 -0.30 0.00 0.00 0.00 0.00 60.65 60.79 1tug s ILE 207 Cb -0.10 -3.46 -0.04 0.00 0.01 0.00 0.00 42.46 38.87 1tug s ILE 207 CO 0.72 0.50 1.03 0.00 0.00 0.00 0.00 174.94 177.19 1tug s ALA 208 N -0.08 3.23 0.16 9.38 0.00 -1.25 -4.56 121.76 128.64 1tug s ALA 208 Ca 0.11 0.62 -0.03 0.00 0.00 0.00 0.00 51.96 52.66 1tug s ALA 208 Cb -0.11 -3.36 -0.03 0.00 0.00 0.00 0.00 23.12 19.62 1tug s ALA 208 CO 0.00 -0.25 0.15 1.67 0.00 0.00 0.00 175.76 177.33 1tug s TRP 209 N 0.86 0.81 -0.15 0.00 1.48 -1.26 0.25 118.94 120.92 1tug s TRP 209 Ca 0.53 -1.14 -0.29 0.00 -1.06 0.00 0.00 56.10 54.14 1tug s TRP 209 Cb -0.23 -0.37 0.09 0.00 -1.16 0.00 0.00 33.47 31.79 1tug s TRP 209 CO 0.29 -0.62 0.79 0.45 -4.06 0.00 0.00 176.95 173.80 1tug s SER 210 N -3.06 -0.60 -0.15 -2.66 0.15 -0.69 -4.92 113.70 101.77 1tug s SER 210 Ca 0.26 0.87 -0.05 0.00 0.70 0.00 0.00 55.95 57.73 1tug s SER 210 Cb 0.06 0.77 -0.03 0.00 -1.71 0.00 0.00 66.02 65.11 1tug s SER 210 CO 0.04 -0.41 0.02 -0.76 1.20 0.00 0.00 173.24 173.33 1tug s LEU 211 N -0.61 3.59 0.07 3.45 1.43 -1.26 -0.10 118.68 125.26 1tug s LEU 211 Ca -0.05 0.03 0.08 0.00 -1.03 0.00 0.00 54.13 53.16 1tug s LEU 211 Cb -0.02 -1.88 -0.03 0.00 0.03 0.00 0.00 46.19 44.29 1tug s LEU 211 CO 0.04 0.22 -0.21 -1.00 0.23 0.00 0.00 176.35 175.63 1tug s HIS 212 N 0.08 1.80 -0.53 0.29 3.76 -0.33 -4.94 115.29 115.43 1tug s HIS 212 Ca 0.03 -0.39 0.24 0.00 -0.15 0.00 0.00 55.06 54.79 1tug s HIS 212 Cb -0.13 -1.04 0.42 0.00 1.11 0.00 0.00 32.58 32.95 1tug s HIS 212 CO 0.02 0.14 1.52 0.77 -0.85 0.00 0.00 174.74 176.34 1tug h SER 213 N 4.51 0.00 -5.01 1.40 0.02 -1.93 -3.39 113.55 109.16 1tug h SER 213 Ca -0.44 -0.03 -0.08 0.00 -0.84 0.00 0.00 61.79 60.39 1tug h SER 213 Cb 1.17 0.00 -0.18 0.00 0.14 0.00 0.00 62.40 63.53 1tug h SER 213 CO 0.42 0.02 -0.03 -0.94 -1.14 0.00 0.00 176.83 175.16 1tug s SER 214 N -5.27 -0.41 0.22 3.07 1.04 -1.26 -4.97 113.70 106.12 1tug s SER 214 Ca 0.07 0.30 -0.14 0.00 0.48 0.00 0.00 55.95 56.66 1tug s SER 214 Cb 0.09 0.44 0.27 0.00 0.10 0.00 0.00 66.02 66.92 1tug s SER 214 CO 0.68 -0.60 1.60 0.40 0.98 0.00 0.00 173.24 176.30 1tug h ILE 215 N 3.20 0.24 -0.07 -1.02 5.03 -1.89 -3.06 117.51 119.94 1tug h ILE 215 Ca -0.29 0.00 0.02 0.00 -0.12 0.00 0.00 64.86 64.47 1tug h ILE 215 Cb 1.18 0.24 -0.00 0.00 -3.03 0.00 0.00 36.82 35.20 1tug h ILE 215 CO 0.40 0.00 0.06 -0.08 -0.68 0.00 0.00 178.15 177.85 1tug h GLU 216 N -0.03 0.00 -0.40 2.37 4.81 -1.97 0.48 114.58 119.85 1tug h GLU 216 Ca 0.33 0.00 0.08 0.00 -0.13 0.00 0.00 59.36 59.64 1tug h GLU 216 Cb 0.54 0.00 -0.08 0.00 0.63 0.00 0.00 28.75 29.85 1tug h GLU 216 CO -0.75 0.00 -0.10 0.93 -0.73 0.00 0.00 179.01 178.35 1tug h GLU 217 N 0.00 -0.00 -0.02 1.92 5.08 -1.98 -3.28 114.58 116.31 1tug h GLU 217 Ca 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1tug h GLU 217 Cb 0.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.40 1tug h GLU 217 CO -0.00 -0.00 -0.00 1.33 -1.00 0.00 0.00 179.01 179.34 1tug n VAL 218 N -5.31 0.00 -0.31 3.13 0.24 0.15 -4.68 118.33 111.55 1tug n VAL 218 Ca 0.02 -0.50 0.11 0.00 -2.04 0.00 0.00 64.34 61.93 1tug n VAL 218 Cb 0.22 1.29 0.28 0.00 -1.47 0.00 0.00 33.84 34.16 1tug n VAL 218 CO 0.00 0.00 0.00 -0.03 -2.14 0.00 0.00 176.83 174.66 1tug h MET 219 N 2.77 0.51 0.00 7.34 -1.53 -0.96 0.14 114.93 123.20 1tug h MET 219 Ca 0.00 -0.03 0.00 0.00 -3.44 0.00 0.00 59.70 56.23 1tug h MET 219 Cb 0.59 -0.11 0.00 0.00 -0.55 0.00 0.00 31.60 31.52 1tug h MET 219 CO 0.00 0.34 0.00 0.00 0.14 0.00 0.00 176.91 177.39 1tug h ALA 220 N 1.64 1.00 0.00 0.39 0.00 -1.83 -3.21 119.26 117.26 1tug h ALA 220 Ca 0.53 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.40 1tug h ALA 220 Cb 0.89 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 1tug h ALA 220 CO -0.45 0.00 -2.01 0.39 0.00 0.00 0.00 179.25 177.19 1tug n GLU 221 N -2.93 0.66 -3.12 0.00 -0.58 0.44 -4.63 120.64 110.48 1tug n GLU 221 Ca 0.01 -0.17 -0.38 0.00 -0.42 0.00 0.00 57.16 56.20 1tug n GLU 221 Cb 0.27 -1.53 -0.06 0.00 -0.57 0.00 0.00 31.44 29.55 1tug n GLU 221 CO 0.00 0.00 0.00 0.14 -0.48 0.00 0.00 177.13 176.79 1tug s VAL 222 N -3.40 4.56 -0.18 2.62 -7.23 -0.99 -4.65 120.40 111.14 1tug s VAL 222 Ca -0.08 1.37 -0.14 0.00 -1.81 0.00 0.00 61.98 61.33 1tug s VAL 222 Cb 0.13 -3.95 -0.21 0.00 0.56 0.00 0.00 36.38 32.91 1tug s VAL 222 CO 0.90 0.39 0.21 0.47 -0.31 0.00 0.00 175.10 176.76 1tug n ASP 223 N 1.24 1.99 -3.98 4.85 8.00 0.27 -4.60 116.55 124.32 1tug n ASP 223 Ca -0.05 0.30 -0.27 0.00 0.71 0.00 0.00 54.79 55.47 1tug n ASP 223 Cb 0.50 -0.88 -0.17 0.00 -0.02 0.00 0.00 41.12 40.55 1tug n ASP 223 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1tug s ILE 224 N -2.46 1.24 -0.38 0.53 -1.09 -0.85 -0.71 121.20 117.47 1tug s ILE 224 Ca -0.27 -0.45 -0.03 0.00 -2.23 0.00 0.00 60.65 57.67 1tug s ILE 224 Cb 0.07 -1.19 0.09 0.00 -1.58 0.00 0.00 42.46 39.85 1tug s ILE 224 CO 0.66 0.40 0.15 -0.22 -1.23 0.00 0.00 174.94 174.69 1tug s LEU 225 N 1.36 4.85 -0.43 2.97 2.96 0.97 -1.20 118.68 130.15 1tug s LEU 225 Ca -0.00 -1.76 -0.17 0.00 -0.22 0.00 0.00 54.13 51.97 1tug s LEU 225 Cb -0.14 -1.81 0.03 0.00 0.50 0.00 0.00 46.19 44.78 1tug s LEU 225 CO -0.06 -0.46 0.45 -0.47 -1.32 0.00 0.00 176.35 174.49 1tug s TYR 226 N 1.20 3.17 0.21 5.38 6.14 -0.02 -0.41 117.35 133.01 1tug s TYR 226 Ca 0.04 -0.45 -0.01 0.00 0.64 0.00 0.00 57.07 57.29 1tug s TYR 226 Cb -0.22 -2.97 -0.04 0.00 0.42 0.00 0.00 41.96 39.15 1tug s TYR 226 CO -0.03 -0.74 0.40 -1.64 0.64 0.00 0.00 175.55 174.19 1tug s MET 227 N 2.12 3.53 0.00 4.97 -1.94 0.67 -1.02 119.30 127.64 1tug s MET 227 Ca 0.11 -0.31 0.02 0.00 -1.71 0.00 0.00 55.69 53.80 1tug s MET 227 Cb -0.18 -2.82 -0.01 0.00 2.01 0.00 0.00 34.83 33.83 1tug s MET 227 CO 0.13 0.38 -0.06 0.95 -0.01 0.00 0.00 175.02 176.41 1tug s THR 228 N -1.89 0.47 0.11 2.05 -4.23 -0.64 -4.12 115.64 107.39 1tug s THR 228 Ca 0.39 -0.38 -0.31 0.00 -1.18 0.00 0.00 61.69 60.20 1tug s THR 228 Cb -0.11 -0.42 -0.11 0.00 1.34 0.00 0.00 72.50 73.20 1tug s THR 228 CO 0.29 0.04 1.84 -1.14 -0.54 0.00 0.00 174.62 175.11 1tug n ARG 229 N 2.69 2.74 -2.66 3.99 0.00 -1.26 -4.32 116.66 117.84 1tug n ARG 229 Ca -0.15 1.00 -0.43 0.00 -0.00 0.00 0.00 57.85 58.27 1tug n ARG 229 Cb 0.57 -2.89 -0.02 0.00 0.00 0.00 0.00 32.46 30.12 1tug n ARG 229 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 1tug s VAL 230 N 2.80 4.48 0.02 5.15 1.01 -1.26 -4.45 120.40 128.16 1tug s VAL 230 Ca 0.83 1.58 -0.30 0.00 0.00 0.00 0.00 61.98 64.08 1tug s VAL 230 Cb -0.50 -4.43 -0.06 0.00 0.00 0.00 0.00 36.38 31.40 1tug s VAL 230 CO 0.38 -0.56 1.34 -1.10 0.00 0.00 0.00 175.10 175.16 1tug s GLN 231 N 3.74 4.33 0.07 2.72 -1.52 -1.26 -4.87 119.66 122.86 1tug s GLN 231 Ca 0.45 1.91 -0.06 0.00 -1.95 0.00 0.00 55.36 55.70 1tug s GLN 231 Cb -0.11 -3.47 -0.29 0.00 -0.22 0.00 0.00 33.01 28.91 1tug s GLN 231 CO 0.18 -0.48 1.12 -0.22 -0.25 0.00 0.00 175.29 175.65 1tug h LYS 232 N 7.41 0.32 -0.59 2.91 3.64 -1.93 -3.06 116.57 125.26 1tug h LYS 232 Ca -0.39 -0.54 0.13 0.00 -1.27 0.00 0.00 60.65 58.59 1tug h LYS 232 Cb 1.19 0.20 -0.03 0.00 -0.41 0.00 0.00 32.23 33.18 1tug h LYS 232 CO 0.88 1.26 0.41 1.05 -2.27 0.00 0.00 179.45 180.77 1tug h GLU 233 N 0.09 0.20 0.00 1.90 9.09 -2.00 0.43 114.58 124.29 1tug h GLU 233 Ca -0.15 -0.01 0.00 0.00 0.05 0.00 0.00 59.36 59.24 1tug h GLU 233 Cb 2.00 -0.04 0.00 0.00 -1.65 0.00 0.00 28.75 29.06 1tug h GLU 233 CO 0.22 0.13 0.00 0.00 0.05 0.00 0.00 179.01 179.41 1tug h ARG 234 N 0.21 0.00 0.00 1.06 3.08 -1.92 -3.44 114.38 113.36 1tug h ARG 234 Ca 0.28 0.00 -0.52 0.00 0.07 0.00 0.00 59.98 59.81 1tug h ARG 234 Cb 0.83 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 30.78 1tug h ARG 234 CO -0.05 0.00 -0.38 1.28 -1.07 0.00 0.00 179.97 179.75 1tug n LEU 235 N -2.53 0.00 -4.63 3.04 4.77 0.15 -5.09 117.00 112.71 1tug n LEU 235 Ca -0.01 -2.51 -0.38 0.00 -0.03 0.00 0.00 56.01 53.07 1tug n LEU 235 Cb 0.10 0.31 -0.09 0.00 -2.33 0.00 0.00 43.42 41.41 1tug n LEU 235 CO 0.15 -0.36 -0.01 -0.62 -1.33 0.00 0.00 177.39 175.22 1tug s ASP 236 N -3.19 6.23 0.62 -1.43 -1.08 -1.26 -4.97 116.67 111.59 1tug s ASP 236 Ca 0.01 0.26 0.29 0.00 -0.52 0.00 0.00 52.55 52.59 1tug s ASP 236 Cb 0.00 -2.18 1.57 0.00 -1.46 0.00 0.00 42.92 40.85 1tug s ASP 236 CO 0.01 -0.08 1.94 1.55 0.52 0.00 0.00 175.17 179.10 1tug h PRO 237 N 7.87 0.00 0.10 4.34 0.13 -1.98 1.16 132.00 143.62 1tug h PRO 237 Ca -0.35 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.78 1tug h PRO 237 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1tug h PRO 237 CO 0.65 0.00 -0.05 0.77 -0.23 0.00 0.00 178.00 179.14 1tug h SER 238 N 0.00 -0.11 -1.02 1.44 0.02 -1.99 -3.09 113.55 108.81 1tug h SER 238 Ca 0.11 0.00 0.25 0.00 -0.84 0.00 0.00 61.79 61.32 1tug h SER 238 Cb 0.87 0.03 -0.09 0.00 0.14 0.00 0.00 62.40 63.35 1tug h SER 238 CO -0.00 0.16 0.66 -0.08 -1.14 0.00 0.00 176.83 176.43 1tug h GLU 239 N -0.61 0.40 0.36 3.45 4.81 -1.34 -1.34 114.58 120.32 1tug h GLU 239 Ca -0.01 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.18 1tug h GLU 239 Cb 0.10 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.40 1tug h GLU 239 CO 0.02 0.26 -0.18 -0.92 -0.73 0.00 0.00 179.01 177.46 1tug h TYR 240 N 0.41 -0.47 0.00 0.92 5.03 0.12 -2.91 116.97 120.07 1tug h TYR 240 Ca 0.57 -0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.87 1tug h TYR 240 Cb 1.43 0.16 0.00 0.00 1.55 0.00 0.00 36.73 39.87 1tug h TYR 240 CO -0.00 -0.29 0.00 0.00 -1.32 0.00 0.00 178.16 176.55 1tug n ALA 241 N -2.26 1.13 0.18 1.82 0.00 -0.91 -0.36 120.51 120.11 1tug n ALA 241 Ca -0.06 0.14 0.06 0.00 0.00 0.00 0.00 53.44 53.58 1tug n ALA 241 Cb 0.20 -1.26 0.21 0.00 0.00 0.00 0.00 19.45 18.60 1tug n ALA 241 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 1tug h ASN 242 N 0.00 0.00 0.00 0.00 -0.73 -1.05 -3.34 115.58 110.46 1tug h ASN 242 Ca 0.00 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.17 1tug h ASN 242 Cb 0.05 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.64 1tug h ASN 242 CO 0.00 0.37 -0.37 0.52 -0.37 0.00 0.00 177.43 177.58 1tug n VAL 243 N -3.31 0.00 -0.41 2.57 0.31 -0.60 -4.79 118.33 112.10 1tug n VAL 243 Ca 0.01 -0.20 -0.11 0.00 -0.01 0.00 0.00 64.34 64.04 1tug n VAL 243 Cb 0.60 0.70 -0.10 0.00 -0.91 0.00 0.00 33.84 34.13 1tug n VAL 243 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 1tug n LYS 244 N -0.95 -0.43 -0.27 5.55 4.81 0.51 -0.03 118.16 127.36 1tug n LYS 244 Ca 0.00 1.48 0.33 0.00 -0.87 0.00 0.00 58.31 59.25 1tug n LYS 244 Cb 0.00 -2.18 0.69 0.00 0.02 0.00 0.00 35.03 33.56 1tug n LYS 244 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1tug h ALA 245 N 0.48 2.99 -0.00 3.14 0.00 -1.85 -0.66 119.26 123.36 1tug h ALA 245 Ca 0.16 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.89 1tug h ALA 245 Cb 0.40 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 1tug h ALA 245 CO -0.92 -1.51 -0.66 0.37 0.00 0.00 0.00 179.25 176.53 1tug h GLN 246 N 0.00 0.02 -0.85 0.00 4.15 -0.79 -3.34 115.11 114.31 1tug h GLN 246 Ca 0.52 -0.01 -0.51 0.00 0.77 0.00 0.00 58.65 59.42 1tug h GLN 246 Cb 2.40 0.00 -0.42 0.00 0.21 0.00 0.00 27.48 29.67 1tug h GLN 246 CO -0.01 0.68 -0.86 1.19 -1.93 0.00 0.00 178.83 177.90 1tug n PHE 247 N -3.76 2.61 -4.69 3.99 3.72 -0.26 -4.86 117.46 114.22 1tug n PHE 247 Ca -0.01 -2.38 -0.33 0.00 -0.05 0.00 0.00 57.45 54.68 1tug n PHE 247 Cb 0.65 -0.28 -0.14 0.00 -0.94 0.00 0.00 39.48 38.77 1tug n PHE 247 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 1tug s VAL 248 N -4.60 3.24 -0.27 -4.37 1.01 -1.21 -4.80 120.40 109.39 1tug s VAL 248 Ca 0.46 -0.59 -0.10 0.00 0.00 0.00 0.00 61.98 61.75 1tug s VAL 248 Cb 0.40 -2.38 -0.05 0.00 0.00 0.00 0.00 36.38 34.36 1tug s VAL 248 CO -0.01 0.52 0.17 -0.22 0.00 0.00 0.00 175.10 175.56 1tug s LEU 249 N 0.35 3.96 0.19 3.92 2.96 0.12 -4.98 118.68 125.20 1tug s LEU 249 Ca -0.09 -0.02 0.09 0.00 -0.22 0.00 0.00 54.13 53.89 1tug s LEU 249 Cb -0.16 -2.09 -0.04 0.00 0.50 0.00 0.00 46.19 44.40 1tug s LEU 249 CO 0.05 -0.03 -0.10 -0.60 -1.32 0.00 0.00 176.35 174.35 1tug s ARG 250 N 1.63 2.04 0.25 1.98 3.52 -1.26 0.47 118.95 127.58 1tug s ARG 250 Ca 0.07 -1.32 -0.04 0.00 -0.13 0.00 0.00 55.73 54.31 1tug s ARG 250 Cb -0.16 -2.13 0.38 0.00 -1.56 0.00 0.00 34.95 31.49 1tug s ARG 250 CO 0.09 0.42 1.86 0.00 -0.81 0.00 0.00 175.30 176.86 1tug h ALA 251 N 2.78 1.28 0.00 6.12 0.00 -1.87 -2.15 119.26 125.42 1tug h ALA 251 Ca -0.46 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1tug h ALA 251 Cb 1.21 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.75 1tug h ALA 251 CO 0.55 0.32 0.00 -1.13 0.00 0.00 0.00 179.25 178.99 1tug n SER 252 N -4.59 0.00 0.00 0.00 3.41 -1.26 -2.22 113.62 108.96 1tug n SER 252 Ca 0.14 -0.07 0.12 0.00 -0.26 0.00 0.00 58.87 58.80 1tug n SER 252 Cb 0.20 -0.11 0.20 0.00 -0.26 0.00 0.00 64.21 64.23 1tug n SER 252 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1tug n ASP 253 N -1.11 0.57 -0.69 4.04 10.43 -0.81 -4.15 116.55 124.84 1tug n ASP 253 Ca 0.05 -0.32 0.12 0.00 2.57 0.00 0.00 54.79 57.20 1tug n ASP 253 Cb 0.04 0.35 0.35 0.00 1.84 0.00 0.00 41.12 43.70 1tug n ASP 253 CO 0.00 0.00 0.00 0.18 -1.07 0.00 0.00 177.20 176.31 1tug n LEU 254 N -1.54 2.09 -0.01 0.64 4.77 -0.94 -4.58 117.00 117.42 1tug n LEU 254 Ca 0.05 -0.82 0.12 0.00 -0.03 0.00 0.00 56.01 55.32 1tug n LEU 254 Cb 0.34 -0.10 0.54 0.00 -2.33 0.00 0.00 43.42 41.88 1tug n LEU 254 CO 0.36 0.41 1.17 1.12 -1.33 0.00 0.00 177.39 179.12 1tug h HIS 255 N 2.91 0.31 -0.17 -1.77 2.07 -1.78 0.38 115.15 117.11 1tug h HIS 255 Ca 0.00 0.01 0.00 0.00 -2.85 0.00 0.00 60.37 57.53 1tug h HIS 255 Cb 0.63 -0.10 0.00 0.00 2.57 0.00 0.00 27.41 30.51 1tug h HIS 255 CO 0.10 0.16 0.00 0.27 -3.07 0.00 0.00 177.93 175.39 1tug n ASN 256 N -4.47 2.80 -4.76 3.10 6.94 -1.26 -4.97 115.26 112.64 1tug n ASN 256 Ca 0.07 -1.90 -0.41 0.00 -0.02 0.00 0.00 54.58 52.32 1tug n ASN 256 Cb 0.33 -0.10 -0.02 0.00 -2.36 0.00 0.00 39.78 37.62 1tug n ASN 256 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1tug s ALA 257 N -1.80 3.54 0.78 -2.53 0.00 0.13 -4.45 121.76 117.43 1tug s ALA 257 Ca 0.34 1.27 -0.14 0.00 0.00 0.00 0.00 51.96 53.43 1tug s ALA 257 Cb 0.21 -3.51 0.06 0.00 0.00 0.00 0.00 23.12 19.88 1tug s ALA 257 CO 0.31 -0.67 1.13 1.63 0.00 0.00 0.00 175.76 178.15 1tug n LYS 258 N 1.46 0.30 -0.35 0.00 5.02 -1.26 -4.91 118.16 118.42 1tug n LYS 258 Ca 0.03 0.17 -0.00 0.00 -2.02 0.00 0.00 58.31 56.49 1tug n LYS 258 Cb 0.41 -2.38 0.15 0.00 -0.02 0.00 0.00 35.03 33.20 1tug n LYS 258 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1tug h ALA 259 N -0.68 1.35 0.00 7.82 0.00 -1.96 -2.33 119.26 123.46 1tug h ALA 259 Ca -0.47 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1tug h ALA 259 Cb 1.31 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 18.74 1tug h ALA 259 CO 0.46 0.57 0.00 0.27 0.00 0.00 0.00 179.25 180.56 1tug n ASN 260 N -4.42 0.00 -4.70 0.00 6.94 -1.26 -4.92 115.26 106.91 1tug n ASN 260 Ca 0.12 0.50 -0.43 0.00 -0.02 0.00 0.00 54.58 54.75 1tug n ASN 260 Cb 0.06 -0.50 -0.03 0.00 -2.36 0.00 0.00 39.78 36.95 1tug n ASN 260 CO 0.00 0.00 0.00 0.80 -1.03 0.00 0.00 177.26 177.03 1tug n MET 261 N -1.50 2.61 -5.16 -3.83 1.56 -0.88 -4.89 117.12 105.03 1tug n MET 261 Ca 0.06 0.95 -0.32 0.00 -0.27 0.00 0.00 57.70 58.12 1tug n MET 261 Cb 0.30 -2.79 -0.15 0.00 2.15 0.00 0.00 33.22 32.72 1tug n MET 261 CO 0.00 0.00 0.00 0.15 -0.73 0.00 0.00 175.97 175.39 1tug s LYS 262 N 1.75 2.42 -0.28 2.12 -0.14 0.11 -4.49 119.74 121.23 1tug s LYS 262 Ca 0.79 -0.85 -0.17 0.00 -1.36 0.00 0.00 55.97 54.38 1tug s LYS 262 Cb -0.55 -2.20 -0.03 0.00 -1.68 0.00 0.00 37.83 33.38 1tug s LYS 262 CO 0.36 0.50 0.48 0.08 -0.76 0.00 0.00 175.35 176.01 1tug s VAL 263 N -0.45 5.09 0.18 3.17 1.01 0.17 -0.02 120.40 129.56 1tug s VAL 263 Ca 0.05 0.70 0.08 0.00 0.00 0.00 0.00 61.98 62.81 1tug s VAL 263 Cb -0.12 -3.82 -0.04 0.00 0.00 0.00 0.00 36.38 32.40 1tug s VAL 263 CO 0.01 0.05 -0.04 -0.76 0.00 0.00 0.00 175.10 174.36 1tug s LEU 264 N 2.26 3.16 -0.29 3.92 1.43 0.45 -1.61 118.68 128.00 1tug s LEU 264 Ca 0.19 -0.49 -0.14 0.00 -1.03 0.00 0.00 54.13 52.67 1tug s LEU 264 Cb -0.16 -1.82 0.11 0.00 0.03 0.00 0.00 46.19 44.36 1tug s LEU 264 CO 0.10 0.09 0.72 -2.28 0.23 0.00 0.00 176.35 175.21 1tug s HIS 265 N -1.75 -1.11 0.11 0.29 2.46 -1.26 -0.24 115.29 113.80 1tug s HIS 265 Ca 0.27 2.06 -0.13 0.00 0.47 0.00 0.00 55.06 57.72 1tug s HIS 265 Cb -0.09 0.66 -0.09 0.00 -0.13 0.00 0.00 32.58 32.94 1tug s HIS 265 CO 0.17 -0.55 1.41 -1.00 -2.47 0.00 0.00 174.74 172.31 1tug h PRO 266 N 7.34 0.81 0.00 2.88 0.13 -1.95 -3.45 132.00 137.76 1tug h PRO 266 Ca -0.24 -0.48 -0.49 0.00 -0.87 0.00 0.00 66.00 63.93 1tug h PRO 266 Cb 1.17 0.04 -0.12 0.00 0.13 0.00 0.00 31.00 32.22 1tug h PRO 266 CO 0.13 1.11 -0.44 1.28 -0.23 0.00 0.00 178.00 179.86 1tug n LEU 267 N -4.12 0.00 -4.74 1.56 4.77 -1.26 -4.98 117.00 108.22 1tug n LEU 267 Ca -0.04 -2.94 -0.41 0.00 -0.03 0.00 0.00 56.01 52.58 1tug n LEU 267 Cb 0.56 1.25 -0.02 0.00 -2.33 0.00 0.00 43.42 42.88 1tug n LEU 267 CO 0.48 -0.47 1.19 -2.16 -1.33 0.00 0.00 177.39 175.10 1tug s PRO 268 N -3.37 4.19 0.40 3.23 0.04 -1.26 -5.00 135.00 133.24 1tug s PRO 268 Ca 0.28 2.44 -0.04 0.00 0.04 0.00 0.00 61.00 63.72 1tug s PRO 268 Cb 0.01 -3.07 -0.04 0.00 0.04 0.00 0.00 34.50 31.44 1tug s PRO 268 CO 0.20 -0.54 0.67 -0.98 0.04 0.00 0.00 177.00 176.39 1tug s ARG 269 N -0.22 3.56 -0.30 4.56 1.70 -1.26 -4.72 118.95 122.27 1tug s ARG 269 Ca 0.63 0.02 -0.07 0.00 -0.47 0.00 0.00 55.73 55.84 1tug s ARG 269 Cb -0.45 -2.51 0.17 0.00 -0.57 0.00 0.00 34.95 31.60 1tug s ARG 269 CO 0.44 -0.02 0.76 0.54 -1.08 0.00 0.00 175.30 175.95 1tug s VAL 270 N -2.48 -0.78 0.00 4.99 0.11 -1.26 -4.99 120.40 116.00 1tug s VAL 270 Ca 0.45 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.50 1tug s VAL 270 Cb -0.10 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.75 1tug s VAL 270 CO 0.39 0.00 0.00 0.47 -3.33 0.00 0.00 175.10 172.63 1tug n ASP 271 N 5.39 0.00 0.22 3.54 8.00 -1.26 -4.60 116.55 127.83 1tug n ASP 271 Ca -0.05 0.00 0.08 0.00 0.71 0.00 0.00 54.79 55.53 1tug n ASP 271 Cb 0.52 -0.39 0.48 0.00 -0.02 0.00 0.00 41.12 41.70 1tug n ASP 271 CO 0.00 0.00 0.00 1.05 -0.39 0.00 0.00 177.20 177.86 1tug h GLU 272 N 0.00 0.00 -3.94 -1.24 9.09 -1.92 -3.39 114.58 113.18 1tug h GLU 272 Ca 0.00 0.00 -0.54 0.00 0.05 0.00 0.00 59.36 58.87 1tug h GLU 272 Cb 0.00 0.00 -0.39 0.00 -1.65 0.00 0.00 28.75 26.71 1tug h GLU 272 CO 0.00 0.27 -0.78 0.42 0.05 0.00 0.00 179.01 178.97 1tug s ILE 273 N -3.92 0.93 0.62 -1.06 1.01 -1.26 0.11 121.20 117.64 1tug s ILE 273 Ca -0.01 -0.68 -0.16 0.00 0.00 0.00 0.00 60.65 59.79 1tug s ILE 273 Cb 0.12 -1.25 -0.02 0.00 0.01 0.00 0.00 42.46 41.32 1tug s ILE 273 CO 0.65 -0.04 1.11 0.00 0.00 0.00 0.00 174.94 176.66 1tug s ALA 274 N 1.69 2.56 0.59 9.38 0.00 0.18 -4.83 121.76 131.32 1tug s ALA 274 Ca -0.01 0.61 0.38 0.00 0.00 0.00 0.00 51.96 52.93 1tug s ALA 274 Cb -0.17 -3.32 2.10 0.00 0.00 0.00 0.00 23.12 21.73 1tug s ALA 274 CO -0.07 -1.09 2.29 1.79 0.00 0.00 0.00 175.76 178.68 1tug h THR 275 N 0.38 0.23 0.00 0.00 1.35 -1.96 -1.43 112.91 111.48 1tug h THR 275 Ca -0.48 -0.07 -0.09 0.00 -0.55 0.00 0.00 66.41 65.23 1tug h THR 275 Cb 1.25 1.05 -0.01 0.00 -1.73 0.00 0.00 68.15 68.71 1tug h THR 275 CO 0.55 0.01 -0.41 -2.24 -0.25 0.00 0.00 175.52 173.18 1tug h ASP 276 N 0.00 0.00 0.33 5.36 -0.00 -1.94 -2.15 116.42 118.01 1tug h ASP 276 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.03 1tug h ASP 276 Cb 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.38 1tug h ASP 276 CO 0.00 0.41 0.00 0.58 -0.00 0.00 0.00 179.24 180.24 1tug h VAL 277 N 0.00 0.00 -0.15 4.15 2.07 -1.59 -2.99 116.25 117.75 1tug h VAL 277 Ca -0.00 -0.16 -0.15 0.00 0.82 0.00 0.00 66.70 67.20 1tug h VAL 277 Cb 0.98 1.08 -0.01 0.00 -1.52 0.00 0.00 31.29 31.82 1tug h VAL 277 CO 0.05 0.00 -0.56 0.44 0.02 0.00 0.00 177.57 177.53 1tug h ASP 278 N 0.00 0.50 0.00 0.57 3.45 -1.53 -3.14 116.42 116.27 1tug h ASP 278 Ca 0.00 -0.27 0.00 0.00 0.43 0.00 0.00 57.03 57.19 1tug h ASP 278 Cb 0.17 -0.14 0.00 0.00 -0.56 0.00 0.00 39.33 38.79 1tug h ASP 278 CO 0.00 0.96 0.00 0.29 -1.57 0.00 0.00 179.24 178.92 1tug n LYS 279 N -3.94 0.78 -3.97 3.56 4.76 -1.13 -4.81 118.16 113.42 1tug n LYS 279 Ca -0.03 0.00 -0.22 0.00 -2.87 0.00 0.00 58.31 55.19 1tug n LYS 279 Cb 0.60 -1.48 -0.02 0.00 -1.84 0.00 0.00 35.03 32.29 1tug n LYS 279 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 1tug s THR 280 N -2.00 5.25 -1.23 -0.18 -4.23 -1.19 -5.02 115.64 107.05 1tug s THR 280 Ca 0.36 -0.94 0.25 0.00 -1.18 0.00 0.00 61.69 60.17 1tug s THR 280 Cb 0.16 -3.83 0.33 0.00 1.34 0.00 0.00 72.50 70.51 1tug s THR 280 CO 0.28 -0.28 1.82 -0.81 -0.54 0.00 0.00 174.62 175.08 1tug n PRO 281 N -1.24 0.20 0.16 3.99 -0.04 -1.26 -3.22 135.00 133.58 1tug n PRO 281 Ca -0.09 0.06 0.12 0.00 -0.04 0.00 0.00 63.50 63.56 1tug n PRO 281 Cb 0.56 -1.50 0.23 0.00 -0.04 0.00 0.00 33.50 32.76 1tug n PRO 281 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1tug h HIS 282 N 0.00 0.00 -2.58 0.54 3.86 -1.88 -3.45 115.15 111.64 1tug h HIS 282 Ca 0.00 0.00 -0.56 0.00 -1.16 0.00 0.00 60.37 58.65 1tug h HIS 282 Cb 0.32 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.78 1tug h HIS 282 CO 0.00 0.00 1.16 0.00 0.86 0.00 0.00 177.93 179.95 1tug s ALA 283 N -3.18 3.39 -0.00 2.45 0.00 -1.20 0.45 121.76 123.67 1tug s ALA 283 Ca 0.07 0.78 0.00 0.00 0.00 0.00 0.00 51.96 52.82 1tug s ALA 283 Cb 0.09 -3.83 0.00 0.00 0.00 0.00 0.00 23.12 19.38 1tug s ALA 283 CO 0.66 -1.77 0.93 1.87 0.00 0.00 0.00 175.76 177.45 1tug n TRP 284 N 8.14 0.00 0.17 0.00 -0.00 -0.64 -4.84 117.44 120.27 1tug n TRP 284 Ca 0.19 -0.02 0.05 0.00 -0.00 0.00 0.00 57.50 57.72 1tug n TRP 284 Cb 0.44 -0.04 0.21 0.00 -0.00 0.00 0.00 31.31 31.91 1tug n TRP 284 CO 0.00 0.00 0.00 0.10 -0.00 0.00 0.00 177.69 177.79 1tug h TYR 285 N 0.00 0.00 0.21 5.87 -0.00 -1.86 0.78 116.97 121.97 1tug h TYR 285 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 58.73 58.41 1tug h TYR 285 Cb 1.33 0.00 0.03 0.00 0.00 0.00 0.00 36.73 38.10 1tug h TYR 285 CO 0.08 0.42 -1.40 0.74 -0.00 0.00 0.00 178.16 178.01 1tug h PHE 286 N 0.00 0.97 -0.48 0.10 0.05 -1.91 -2.86 116.94 112.81 1tug h PHE 286 Ca -0.00 -0.68 0.07 0.00 3.82 0.00 0.00 57.97 61.18 1tug h PHE 286 Cb 1.11 -0.05 -0.06 0.00 2.00 0.00 0.00 35.95 38.95 1tug h PHE 286 CO 0.00 1.52 0.15 1.96 -0.18 0.00 0.00 178.31 181.76 1tug h GLN 287 N 0.19 0.30 -0.67 1.51 7.50 -1.91 -0.10 115.11 121.92 1tug h GLN 287 Ca -0.23 -0.02 0.14 0.00 0.50 0.00 0.00 58.65 59.05 1tug h GLN 287 Cb 2.08 -0.07 -0.04 0.00 0.05 0.00 0.00 27.48 29.51 1tug h GLN 287 CO 0.26 0.20 0.45 0.37 -1.50 0.00 0.00 178.83 178.61 1tug h GLN 288 N 0.31 0.29 -0.10 1.46 4.15 -0.83 -1.23 115.11 119.15 1tug h GLN 288 Ca 0.23 -0.02 -0.20 0.00 0.77 0.00 0.00 58.65 59.43 1tug h GLN 288 Cb 0.26 -0.06 0.01 0.00 0.21 0.00 0.00 27.48 27.90 1tug h GLN 288 CO -0.26 0.19 -0.73 0.00 -1.93 0.00 0.00 178.83 176.10 1tug h ALA 289 N 1.68 0.23 0.00 3.38 0.00 -0.81 -3.07 119.26 120.67 1tug h ALA 289 Ca 0.32 -0.59 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1tug h ALA 289 Cb 0.85 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.64 1tug h ALA 289 CO -0.08 0.58 0.00 0.78 0.00 0.00 0.00 179.25 180.53 1tug h GLY 290 N 0.36 0.00 2.00 0.00 0.00 -0.44 -2.29 103.07 102.69 1tug h GLY 290 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.27 1tug h GLY 290 CO 0.15 0.00 0.00 3.43 0.00 0.00 0.00 176.54 180.12 1tug h ASN 291 N 0.00 0.00 0.85 0.19 -0.26 -1.16 -2.58 115.58 112.62 1tug h ASN 291 Ca 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 1tug h ASN 291 Cb 0.47 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.73 1tug h ASN 291 CO 0.00 0.00 0.00 1.23 -1.06 0.00 0.00 177.43 177.60 1tug h GLY 292 N 3.92 0.00 1.44 2.83 0.00 -1.42 -0.28 103.07 109.56 1tug h GLY 292 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 47.16 1tug h GLY 292 CO 0.00 0.00 -0.61 -2.22 0.00 0.00 0.00 176.54 173.71 1tug h ILE 293 N 0.00 1.32 0.07 2.60 1.08 -1.60 -0.91 117.51 120.07 1tug h ILE 293 Ca 0.00 -1.88 -0.29 0.00 -0.39 0.00 0.00 64.86 62.30 1tug h ILE 293 Cb 0.42 1.86 -0.02 0.00 -3.07 0.00 0.00 36.82 36.01 1tug h ILE 293 CO 0.00 0.58 -1.49 -0.26 -0.69 0.00 0.00 178.15 176.29 1tug h PHE 294 N 0.43 0.26 -0.80 1.37 0.04 -1.59 -1.90 116.94 114.74 1tug h PHE 294 Ca -0.01 -0.19 0.02 0.00 2.80 0.00 0.00 57.97 60.59 1tug h PHE 294 Cb 1.18 -0.01 -0.04 0.00 2.20 0.00 0.00 35.95 39.27 1tug h PHE 294 CO 0.05 1.24 0.52 0.00 -0.60 0.00 0.00 178.31 179.52 1tug h ALA 295 N 0.69 1.03 -0.10 2.45 0.00 -1.07 -2.19 119.26 120.07 1tug h ALA 295 Ca -0.22 -0.05 -0.24 0.00 0.00 0.00 0.00 54.91 54.41 1tug h ALA 295 Cb 1.97 -0.30 0.01 0.00 0.00 0.00 0.00 17.79 19.47 1tug h ALA 295 CO 0.13 0.39 -0.87 0.00 0.00 0.00 0.00 179.25 178.91 1tug h ARG 296 N 1.05 0.75 -0.48 0.00 3.08 -1.25 -2.98 114.38 114.56 1tug h ARG 296 Ca 0.30 -0.67 -0.00 0.00 0.07 0.00 0.00 59.98 59.68 1tug h ARG 296 Cb -0.07 0.16 -0.02 0.00 0.08 0.00 0.00 29.97 30.11 1tug h ARG 296 CO -0.08 1.27 0.29 1.96 -1.07 0.00 0.00 179.97 182.33 1tug h GLN 297 N 0.48 0.65 -0.61 0.04 4.20 -1.25 -2.73 115.11 115.89 1tug h GLN 297 Ca -0.08 -0.05 0.02 0.00 0.06 0.00 0.00 58.65 58.61 1tug h GLN 297 Cb 1.50 -0.14 -0.04 0.00 0.30 0.00 0.00 27.48 29.11 1tug h GLN 297 CO 0.17 0.46 0.38 0.00 -0.67 0.00 0.00 178.83 179.17 1tug h ALA 298 N 1.66 0.79 0.29 3.87 0.00 -1.30 -0.33 119.26 124.24 1tug h ALA 298 Ca 0.17 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 1tug h ALA 298 Cb -0.02 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 1tug h ALA 298 CO -0.03 0.13 -0.17 -0.07 0.00 0.00 0.00 179.25 179.11 1tug h LEU 299 N 0.75 -0.41 -0.24 0.00 4.07 -1.34 -1.05 115.31 117.08 1tug h LEU 299 Ca 0.24 0.02 0.00 0.00 0.08 0.00 0.00 57.88 58.23 1tug h LEU 299 Cb 0.01 0.12 -0.01 0.00 1.08 0.00 0.00 40.66 41.85 1tug h LEU 299 CO -0.09 -0.27 0.15 -0.07 -1.08 0.00 0.00 178.44 177.07 1tug h LEU 300 N -0.43 0.26 0.27 1.67 3.38 -1.25 -0.14 115.31 119.06 1tug h LEU 300 Ca -0.03 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 1tug h LEU 300 Cb 0.35 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 1tug h LEU 300 CO 0.04 0.19 -0.20 0.00 0.09 0.00 0.00 178.44 178.56 1tug h ALA 301 N 1.09 -0.45 -0.76 1.53 0.00 -1.06 -2.31 119.26 117.30 1tug h ALA 301 Ca 0.09 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1tug h ALA 301 Cb -0.03 0.26 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 1tug h ALA 301 CO -0.03 -0.77 0.43 -0.07 0.00 0.00 0.00 179.25 178.81 1tug h LEU 302 N -0.47 0.94 -0.44 0.00 3.38 -0.92 -1.57 115.31 116.24 1tug h LEU 302 Ca -0.02 -0.09 -0.14 0.00 0.09 0.00 0.00 57.88 57.72 1tug h LEU 302 Cb 0.41 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 1tug h LEU 302 CO 0.00 0.76 -0.66 0.58 0.09 0.00 0.00 178.44 179.20 1tug h VAL 303 N 1.05 1.31 0.00 1.22 2.07 -0.94 -3.29 116.25 117.67 1tug h VAL 303 Ca 0.27 -2.41 0.00 0.00 0.82 0.00 0.00 66.70 65.37 1tug h VAL 303 Cb 0.02 2.36 0.00 0.00 -1.52 0.00 0.00 31.29 32.15 1tug h VAL 303 CO -0.04 0.65 -0.75 0.18 0.02 0.00 0.00 177.57 177.63 1tug n LEU 304 N -3.51 0.63 -4.06 2.57 4.77 -0.88 -0.35 117.00 116.17 1tug n LEU 304 Ca -0.00 -0.47 -0.32 0.00 -0.03 0.00 0.00 56.01 55.19 1tug n LEU 304 Cb 0.71 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.66 1tug n LEU 304 CO 0.42 0.16 -0.35 0.21 -1.33 0.00 0.00 177.39 176.50 1tug s ASN 305 N -2.45 4.75 0.18 -1.43 2.47 -0.60 -4.98 114.94 112.88 1tug s ASN 305 Ca 0.05 -1.82 -0.20 0.00 0.42 0.00 0.00 52.86 51.31 1tug s ASN 305 Cb 0.11 -1.64 0.11 0.00 -1.45 0.00 0.00 41.25 38.38 1tug s ASN 305 CO 0.59 -0.33 1.61 -0.09 -3.72 0.00 0.00 177.10 175.16 1tug h ARG 306 N 7.75 -0.15 -4.99 0.43 2.43 -1.85 -3.39 114.38 114.60 1tug h ARG 306 Ca -0.11 0.01 -0.61 0.00 -0.81 0.00 0.00 59.98 58.46 1tug h ARG 306 Cb 1.03 0.04 -0.33 0.00 -0.42 0.00 0.00 29.97 30.29 1tug h ARG 306 CO 0.53 -0.10 -0.85 -0.51 -1.51 0.00 0.00 179.97 177.52 1tug s ASP 307 N -5.13 2.52 -0.17 -3.80 1.01 -1.26 -0.32 116.67 109.52 1tug s ASP 307 Ca -0.14 -0.45 -0.06 0.00 0.71 0.00 0.00 52.55 52.61 1tug s ASP 307 Cb 0.15 -1.16 -0.03 0.00 1.01 0.00 0.00 42.92 42.89 1tug s ASP 307 CO 0.70 0.10 0.02 -0.76 0.21 0.00 0.00 175.17 175.44 1tug s LEU 308 N 0.49 3.53 -0.60 1.23 2.01 -1.26 -5.01 118.68 119.07 1tug s LEU 308 Ca -0.17 -0.03 0.02 0.00 0.01 0.00 0.00 54.13 53.97 1tug s LEU 308 Cb -0.17 -1.88 0.39 0.00 0.01 0.00 0.00 46.19 44.54 1tug s LEU 308 CO 0.07 0.16 1.43 0.52 1.01 0.00 0.00 176.35 179.54 1tug n VAL 309 N 3.59 2.88 0.38 -1.59 0.31 -1.26 -5.09 118.33 117.56 1tug n VAL 309 Ca -0.17 -4.76 0.03 0.00 -0.01 0.00 0.00 64.34 59.43 1tug n VAL 309 Cb 0.52 -1.27 0.18 0.00 -0.91 0.00 0.00 33.84 32.36 1tug n VAL 309 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69