#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tbg n SER 2 N 0.00 -3.64 0.22 3.17 7.64 -1.26 -4.09 113.62 115.67 1tbg n SER 2 Ca 0.00 0.75 0.10 0.00 1.01 0.00 0.00 58.87 60.73 1tbg n SER 2 Cb 0.00 -1.96 0.50 0.00 -1.01 0.00 0.00 64.21 61.74 1tbg n SER 2 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 1tbg h GLU 3 N -0.27 0.00 -0.36 1.43 4.81 -2.06 -3.20 114.58 114.93 1tbg h GLU 3 Ca -0.04 0.00 0.07 0.00 -0.13 0.00 0.00 59.36 59.26 1tbg h GLU 3 Cb 0.52 0.00 -0.07 0.00 0.63 0.00 0.00 28.75 29.83 1tbg h GLU 3 CO 0.02 0.23 -0.11 1.25 -0.73 0.00 0.00 179.01 179.66 1tbg h LEU 4 N 0.00 -0.41 -1.23 1.64 5.85 -2.00 -0.81 115.31 118.35 1tbg h LEU 4 Ca -0.00 0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.83 1tbg h LEU 4 Cb 0.68 0.25 0.00 0.00 0.37 0.00 0.00 40.66 41.96 1tbg h LEU 4 CO 0.03 -0.15 0.00 -2.24 -0.34 0.00 0.00 178.44 175.74 1tbg h ASP 5 N -0.03 0.00 0.01 1.25 3.04 -1.70 -0.12 116.42 118.86 1tbg h ASP 5 Ca 0.18 0.00 -0.18 0.00 -3.24 0.00 0.00 57.03 53.79 1tbg h ASP 5 Cb 0.30 0.00 0.01 0.00 -1.04 0.00 0.00 39.33 38.61 1tbg h ASP 5 CO -0.39 0.00 -0.69 1.56 -2.04 0.00 0.00 179.24 177.68 1tbg h GLN 6 N 0.00 0.46 -0.12 4.15 4.20 -1.31 0.81 115.11 123.30 1tbg h GLN 6 Ca 0.00 -0.50 -0.08 0.00 0.06 0.00 0.00 58.65 58.13 1tbg h GLN 6 Cb 0.33 0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.24 1tbg h GLN 6 CO 0.00 1.15 -0.28 -0.07 -0.67 0.00 0.00 178.83 178.96 1tbg h LEU 7 N -0.03 0.21 -0.55 1.46 -0.00 -0.87 -0.42 115.31 115.12 1tbg h LEU 7 Ca -0.09 -0.07 -0.10 0.00 -0.00 0.00 0.00 57.88 57.63 1tbg h LEU 7 Cb 1.40 -0.06 -0.02 0.00 -0.00 0.00 0.00 40.66 41.98 1tbg h LEU 7 CO 0.14 0.49 -0.04 -0.09 -0.00 0.00 0.00 178.44 178.94 1tbg h ARG 8 N 0.19 0.99 0.04 1.13 9.65 -0.90 -1.46 114.38 124.02 1tbg h ARG 8 Ca 0.03 -0.34 -0.00 0.00 -1.10 0.00 0.00 59.98 58.57 1tbg h ARG 8 Cb 0.60 -0.08 0.00 0.00 -1.39 0.00 0.00 29.97 29.10 1tbg h ARG 8 CO 0.04 1.01 -0.02 0.37 2.80 0.00 0.00 179.97 184.17 1tbg h GLN 9 N 0.87 -0.05 -0.39 0.20 4.15 0.05 -2.53 115.11 117.42 1tbg h GLN 9 Ca 0.15 0.00 0.05 0.00 0.77 0.00 0.00 58.65 59.62 1tbg h GLN 9 Cb 0.59 0.01 -0.04 0.00 0.21 0.00 0.00 27.48 28.25 1tbg h GLN 9 CO 0.04 0.12 0.13 1.49 -1.93 0.00 0.00 178.83 178.68 1tbg h GLU 10 N -0.22 0.28 -0.47 1.69 4.81 -1.00 -2.11 114.58 117.55 1tbg h GLU 10 Ca -0.01 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 1tbg h GLU 10 Cb 0.20 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.49 1tbg h GLU 10 CO 0.01 0.19 0.30 0.00 -0.73 0.00 0.00 179.01 178.78 1tbg h ALA 11 N 1.25 0.60 -0.29 2.92 0.00 -1.21 -1.50 119.26 121.04 1tbg h ALA 11 Ca 0.18 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1tbg h ALA 11 Cb 0.16 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1tbg h ALA 11 CO -0.18 0.06 0.19 0.93 0.00 0.00 0.00 179.25 180.25 1tbg h GLU 12 N 0.64 0.38 -0.83 0.00 4.39 -1.22 -0.56 114.58 117.38 1tbg h GLU 12 Ca 0.17 -0.03 -0.01 0.00 0.34 0.00 0.00 59.36 59.84 1tbg h GLU 12 Cb -0.05 -0.08 -0.04 0.00 -0.10 0.00 0.00 28.75 28.47 1tbg h GLU 12 CO -0.04 0.26 0.47 1.96 -1.16 0.00 0.00 179.01 180.51 1tbg h GLN 13 N 0.39 1.14 -0.50 2.33 4.20 -1.10 -0.26 115.11 121.31 1tbg h GLN 13 Ca 0.11 -0.12 -0.11 0.00 0.06 0.00 0.00 58.65 58.59 1tbg h GLN 13 Cb -0.03 -0.23 -0.02 0.00 0.30 0.00 0.00 27.48 27.50 1tbg h GLN 13 CO -0.02 0.82 -0.10 -0.07 -0.67 0.00 0.00 178.83 178.78 1tbg h LEU 14 N 1.15 0.95 -0.62 1.46 3.38 -1.03 -1.00 115.31 119.60 1tbg h LEU 14 Ca 0.29 -0.35 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 1tbg h LEU 14 Cb -0.01 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.45 1tbg h LEU 14 CO -0.05 1.08 0.36 0.11 0.09 0.00 0.00 178.44 180.03 1tbg h LYS 15 N 0.81 0.85 -0.34 1.13 1.57 -0.16 -0.50 116.57 119.92 1tbg h LYS 15 Ca 0.13 -0.09 -0.14 0.00 -1.87 0.00 0.00 60.65 58.68 1tbg h LYS 15 Cb 0.66 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.79 1tbg h LYS 15 CO 0.05 0.62 -0.36 -0.91 -0.57 0.00 0.00 179.45 178.28 1tbg h ASN 16 N 0.84 0.84 -0.63 0.86 2.35 -0.98 -2.12 115.58 116.73 1tbg h ASN 16 Ca 0.22 -0.36 0.05 0.00 -0.55 0.00 0.00 56.30 55.66 1tbg h ASN 16 Cb 0.00 -0.23 -0.05 0.00 0.05 0.00 0.00 38.32 38.09 1tbg h ASN 16 CO -0.04 1.11 0.36 -0.61 -1.65 0.00 0.00 177.43 176.60 1tbg h GLN 17 N 0.66 0.66 -0.22 0.81 4.15 -0.66 0.08 115.11 120.58 1tbg h GLN 17 Ca 0.06 -0.04 -0.13 0.00 0.77 0.00 0.00 58.65 59.32 1tbg h GLN 17 Cb 0.91 -0.15 -0.01 0.00 0.21 0.00 0.00 27.48 28.44 1tbg h GLN 17 CO 0.08 0.43 -0.39 0.82 -1.93 0.00 0.00 178.83 177.84 1tbg h ILE 18 N 0.68 1.30 -0.43 2.39 2.04 -0.96 -0.57 117.51 121.95 1tbg h ILE 18 Ca 0.28 -1.54 -0.05 0.00 1.00 0.00 0.00 64.86 64.54 1tbg h ILE 18 Cb 0.14 1.56 -0.02 0.00 -0.74 0.00 0.00 36.82 37.76 1tbg h ILE 18 CO -0.16 0.48 0.06 -0.09 0.00 0.00 0.00 178.15 178.45 1tbg h ARG 19 N 0.43 0.71 -0.42 2.37 2.43 -0.58 -1.18 114.38 118.14 1tbg h ARG 19 Ca 0.04 -0.20 -0.10 0.00 -0.81 0.00 0.00 59.98 58.91 1tbg h ARG 19 Cb 0.88 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 30.33 1tbg h ARG 19 CO 0.07 0.75 -0.15 -0.44 -1.51 0.00 0.00 179.97 178.69 1tbg h ASP 20 N 0.57 0.77 -0.37 -3.80 3.32 -0.84 -0.95 116.42 115.12 1tbg h ASP 20 Ca 0.13 -0.25 -0.02 0.00 0.02 0.00 0.00 57.03 56.91 1tbg h ASP 20 Cb 0.39 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.71 1tbg h ASP 20 CO 0.01 0.93 0.16 0.00 -1.72 0.00 0.00 179.24 178.62 1tbg h ALA 21 N 1.14 0.48 -0.44 3.45 0.00 -0.75 -2.30 119.26 120.84 1tbg h ALA 21 Ca 0.11 -0.12 -0.13 0.00 0.00 0.00 0.00 54.91 54.77 1tbg h ALA 21 Cb 0.64 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1tbg h ALA 21 CO 0.05 0.07 -0.22 0.00 0.00 0.00 0.00 179.25 179.14 1tbg h ARG 22 N 0.46 0.90 -0.98 0.00 3.08 -1.08 -2.97 114.38 113.79 1tbg h ARG 22 Ca 0.13 -0.38 0.09 0.00 0.07 0.00 0.00 59.98 59.89 1tbg h ARG 22 Cb 0.16 -0.03 -0.08 0.00 0.08 0.00 0.00 29.97 30.10 1tbg h ARG 22 CO -0.01 1.03 0.62 0.87 -1.07 0.00 0.00 179.97 181.41 1tbg h LYS 23 N 0.78 1.02 0.00 0.04 1.57 -0.98 -0.08 116.57 118.92 1tbg h LYS 23 Ca 0.10 -0.06 -0.04 0.00 -1.87 0.00 0.00 60.65 58.78 1tbg h LYS 23 Cb 0.78 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.85 1tbg h LYS 23 CO 0.06 0.68 -0.19 0.00 -0.57 0.00 0.00 179.45 179.43 1tbg h ALA 24 N 1.49 1.67 0.00 3.86 0.00 -1.25 -3.09 119.26 121.94 1tbg h ALA 24 Ca 0.46 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.20 1tbg h ALA 24 Cb 0.34 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1tbg h ALA 24 CO -0.22 0.24 -0.95 0.00 0.00 0.00 0.00 179.25 178.31 1tbg n ALA 26 N -2.13 3.02 1.05 0.00 0.00 -0.59 -4.65 120.51 117.21 1tbg n ALA 26 Ca 0.00 -3.58 0.12 0.00 0.00 0.00 0.00 53.44 49.99 1tbg n ALA 26 Cb 0.53 -3.57 0.20 0.00 0.00 0.00 0.00 19.45 16.62 1tbg n ALA 26 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1tbg n ASP 27 N 10.31 0.78 -3.62 0.00 5.75 -1.26 -5.01 116.55 123.50 1tbg n ASP 27 Ca 0.48 -0.58 -0.01 0.00 -0.01 0.00 0.00 54.79 54.66 1tbg n ASP 27 Cb 0.46 0.36 -0.01 0.00 -1.03 0.00 0.00 41.12 40.90 1tbg n ASP 27 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1tbg s ALA 28 N -2.86 -2.11 0.33 2.12 0.00 -1.26 -5.18 121.76 112.80 1tbg s ALA 28 Ca 0.14 0.97 0.07 0.00 0.00 0.00 0.00 51.96 53.14 1tbg s ALA 28 Cb 0.18 0.23 -0.02 0.00 0.00 0.00 0.00 23.12 23.50 1tbg s ALA 28 CO 0.68 -0.88 0.34 0.95 0.00 0.00 0.00 175.76 176.85 1tbg s THR 29 N -2.54 3.70 0.13 0.00 -4.23 -1.26 -5.02 115.64 106.42 1tbg s THR 29 Ca 0.12 -1.27 -0.16 0.00 -1.18 0.00 0.00 61.69 59.20 1tbg s THR 29 Cb 0.02 -3.25 -0.01 0.00 1.34 0.00 0.00 72.50 70.59 1tbg s THR 29 CO -0.04 -0.17 1.64 0.25 -0.54 0.00 0.00 174.62 175.76 1tbg h LEU 30 N 1.16 0.58 -1.19 4.79 5.85 -1.82 -2.88 115.31 121.80 1tbg h LEU 30 Ca -0.45 -0.22 0.07 0.00 0.84 0.00 0.00 57.88 58.12 1tbg h LEU 30 Cb 1.25 -0.15 -0.06 0.00 0.37 0.00 0.00 40.66 42.07 1tbg h LEU 30 CO 0.57 0.64 0.57 0.77 -0.34 0.00 0.00 178.44 180.65 1tbg h SER 31 N 0.49 0.85 0.40 1.25 4.64 -1.86 -0.09 113.55 119.22 1tbg h SER 31 Ca 0.13 0.01 -0.09 0.00 -0.47 0.00 0.00 61.79 61.37 1tbg h SER 31 Cb 0.28 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 62.19 1tbg h SER 31 CO -0.00 0.53 -0.41 1.56 -0.87 0.00 0.00 176.83 177.64 1tbg h GLN 32 N 0.95 0.01 0.00 4.77 4.20 -1.86 -2.57 115.11 120.61 1tbg h GLN 32 Ca 0.38 -0.01 -0.08 0.00 0.06 0.00 0.00 58.65 59.01 1tbg h GLN 32 Cb 0.25 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.02 1tbg h GLN 32 CO -0.15 0.42 -0.36 0.82 -0.67 0.00 0.00 178.83 178.90 1tbg h ILE 33 N 0.01 0.62 -0.61 2.54 1.08 -0.88 -3.28 117.51 116.99 1tbg h ILE 33 Ca -0.00 -1.86 0.00 0.00 -0.39 0.00 0.00 64.86 62.61 1tbg h ILE 33 Cb 0.73 2.30 0.00 0.00 -3.07 0.00 0.00 36.82 36.78 1tbg h ILE 33 CO 0.05 0.35 0.00 0.35 -0.69 0.00 0.00 178.15 178.21 1tbg n THR 34 N -3.19 2.16 -0.35 -0.27 -2.24 -0.33 -4.60 114.28 105.45 1tbg n THR 34 Ca 0.03 -1.30 0.13 0.00 -2.27 0.00 0.00 64.05 60.64 1tbg n THR 34 Cb 0.67 -0.01 0.33 0.00 -2.10 0.00 0.00 70.33 69.22 1tbg n THR 34 CO 0.00 0.00 0.00 -1.13 -0.57 0.00 0.00 175.07 173.37 1tbg h ASN 35 N 3.96 0.78 1.15 3.42 -1.24 -1.57 0.24 115.58 122.32 1tbg h ASN 35 Ca 0.00 0.09 -0.08 0.00 0.71 0.00 0.00 56.30 57.03 1tbg h ASN 35 Cb 1.62 -0.05 -0.01 0.00 0.73 0.00 0.00 38.32 40.62 1tbg h ASN 35 CO 0.32 0.28 -0.37 0.78 -1.29 0.00 0.00 177.43 177.15 1tbg h ASN 36 N 0.76 0.00 -3.47 1.15 2.35 -1.89 -3.45 115.58 111.03 1tbg h ASN 36 Ca 0.57 0.00 -0.52 0.00 -0.55 0.00 0.00 56.30 55.80 1tbg h ASN 36 Cb 0.90 0.00 0.03 0.00 0.05 0.00 0.00 38.32 39.31 1tbg h ASN 36 CO -0.37 0.37 0.62 -0.63 -1.65 0.00 0.00 177.43 175.77 1tbg s ILE 37 N -3.36 3.25 0.31 2.81 -1.09 0.07 -5.00 121.20 118.19 1tbg s ILE 37 Ca 0.02 1.06 -0.26 0.00 -2.23 0.00 0.00 60.65 59.24 1tbg s ILE 37 Cb 0.09 -3.68 -0.10 0.00 -1.58 0.00 0.00 42.46 37.20 1tbg s ILE 37 CO 0.69 0.17 0.92 -1.81 -1.23 0.00 0.00 174.94 173.69 1tbg s ASP 38 N 0.16 7.34 0.68 3.58 1.01 -1.26 -5.03 116.67 123.15 1tbg s ASP 38 Ca 0.55 1.81 -0.13 0.00 0.71 0.00 0.00 52.55 55.48 1tbg s ASP 38 Cb -0.36 -2.57 0.01 0.00 1.01 0.00 0.00 42.92 41.02 1tbg s ASP 38 CO 0.39 -0.04 1.09 -2.16 0.21 0.00 0.00 175.17 174.66 1tbg s PRO 39 N -1.98 2.75 0.10 8.23 0.04 -1.26 -4.90 135.00 137.99 1tbg s PRO 39 Ca 0.49 1.26 0.19 0.00 0.04 0.00 0.00 61.00 62.97 1tbg s PRO 39 Cb -0.19 -1.95 0.79 0.00 0.04 0.00 0.00 34.50 33.19 1tbg s PRO 39 CO 0.24 -1.27 1.59 1.33 0.04 0.00 0.00 177.00 178.93 1tbg n VAL 40 N -2.72 0.87 0.00 -0.36 0.24 -1.26 -4.97 118.33 110.13 1tbg n VAL 40 Ca 0.09 0.21 0.00 0.00 -2.04 0.00 0.00 64.34 62.60 1tbg n VAL 40 Cb 0.53 -1.02 0.00 0.00 -1.47 0.00 0.00 33.84 31.87 1tbg n VAL 40 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1tbg n GLY 41 N 0.12 1.25 2.86 7.63 0.00 -1.26 -4.78 105.19 111.02 1tbg n GLY 41 Ca 0.03 -0.95 -0.28 0.00 0.00 0.00 0.00 46.02 44.82 1tbg n GLY 41 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1tbg s ARG 42 N 0.00 1.27 0.06 1.61 3.52 -1.26 -4.71 118.95 119.43 1tbg s ARG 42 Ca 0.00 -0.50 -0.30 0.00 -0.13 0.00 0.00 55.73 54.80 1tbg s ARG 42 Cb 0.00 -2.00 -0.05 0.00 -1.56 0.00 0.00 34.95 31.34 1tbg s ARG 42 CO 0.00 -0.47 1.09 0.42 -0.81 0.00 0.00 175.30 175.53 1tbg s ILE 43 N 1.67 4.34 -0.40 4.11 -1.09 0.58 -5.00 121.20 125.42 1tbg s ILE 43 Ca 0.00 1.73 0.01 0.00 -2.23 0.00 0.00 60.65 60.17 1tbg s ILE 43 Cb -0.16 -4.11 0.13 0.00 -1.58 0.00 0.00 42.46 36.75 1tbg s ILE 43 CO -0.07 0.17 0.22 -1.10 -1.23 0.00 0.00 174.94 172.92 1tbg s GLN 44 N 0.77 0.97 0.03 2.79 -0.21 -1.26 -4.40 119.66 118.35 1tbg s GLN 44 Ca 0.54 -1.68 -0.07 0.00 0.02 0.00 0.00 55.36 54.17 1tbg s GLN 44 Cb -0.26 -1.94 -0.05 0.00 1.00 0.00 0.00 33.01 31.76 1tbg s GLN 44 CO 0.30 -1.16 0.30 -1.64 -2.12 0.00 0.00 175.29 170.97 1tbg s MET 45 N 0.73 3.63 0.06 2.91 -1.94 -1.26 -5.07 119.30 118.35 1tbg s MET 45 Ca 0.17 -0.01 0.09 0.00 -1.71 0.00 0.00 55.69 54.23 1tbg s MET 45 Cb -0.23 -3.06 -0.03 0.00 2.01 0.00 0.00 34.83 33.52 1tbg s MET 45 CO -0.02 0.62 -0.24 1.03 -0.01 0.00 0.00 175.02 176.40 1tbg s ARG 46 N -1.81 1.58 -0.00 2.03 1.81 -1.23 -4.95 118.95 116.38 1tbg s ARG 46 Ca 0.29 -1.07 -0.30 0.00 -1.72 0.00 0.00 55.73 52.92 1tbg s ARG 46 Cb -0.13 -1.77 -0.06 0.00 -0.45 0.00 0.00 34.95 32.54 1tbg s ARG 46 CO 0.17 0.45 1.51 -0.08 -0.68 0.00 0.00 175.30 176.67 1tbg s THR 47 N -0.84 3.54 -0.11 0.02 -1.32 -1.26 -2.48 115.64 113.20 1tbg s THR 47 Ca 0.10 0.88 -0.11 0.00 -1.21 0.00 0.00 61.69 61.35 1tbg s THR 47 Cb -0.10 -3.56 -0.27 0.00 -1.51 0.00 0.00 72.50 67.06 1tbg s THR 47 CO 0.02 -0.02 0.46 0.03 -2.21 0.00 0.00 174.62 172.90 1tbg h ARG 48 N 8.36 0.27 -4.34 7.08 2.47 -0.85 -3.48 114.38 123.89 1tbg h ARG 48 Ca -0.39 -0.46 -0.15 0.00 -1.26 0.00 0.00 59.98 57.73 1tbg h ARG 48 Cb 1.18 0.17 -0.15 0.00 -1.65 0.00 0.00 29.97 29.52 1tbg h ARG 48 CO 0.93 1.22 -0.68 1.03 0.56 0.00 0.00 179.97 183.02 1tbg s ARG 49 N -2.53 0.68 -0.27 0.04 1.81 -1.22 -4.98 118.95 112.49 1tbg s ARG 49 Ca -0.21 -1.26 -0.03 0.00 -1.72 0.00 0.00 55.73 52.51 1tbg s ARG 49 Cb 0.06 0.13 0.09 0.00 -0.45 0.00 0.00 34.95 34.78 1tbg s ARG 49 CO 0.77 -0.11 0.10 0.99 -0.68 0.00 0.00 175.30 176.38 1tbg s THR 50 N -3.88 0.34 -0.57 0.02 2.01 -1.26 -0.72 115.64 111.59 1tbg s THR 50 Ca 0.10 -0.90 -0.27 0.00 0.31 0.00 0.00 61.69 60.92 1tbg s THR 50 Cb 0.07 -1.19 0.00 0.00 0.01 0.00 0.00 72.50 71.40 1tbg s THR 50 CO -0.08 -0.60 1.55 -0.76 -0.69 0.00 0.00 174.62 174.04 1tbg s LEU 51 N 1.90 3.36 0.05 4.42 1.02 0.54 -4.89 118.68 125.09 1tbg s LEU 51 Ca 0.07 0.33 -0.00 0.00 0.02 0.00 0.00 54.13 54.55 1tbg s LEU 51 Cb -0.17 -2.93 -0.04 0.00 0.02 0.00 0.00 46.19 43.08 1tbg s LEU 51 CO -0.27 -1.88 0.20 -0.13 0.02 0.00 0.00 176.35 174.30 1tbg s ARG 52 N 5.91 3.43 0.00 1.70 0.52 -1.26 -2.43 118.95 126.83 1tbg s ARG 52 Ca 0.57 -0.42 0.00 0.00 -0.52 0.00 0.00 55.73 55.36 1tbg s ARG 52 Cb -0.12 -3.05 0.00 0.00 0.52 0.00 0.00 34.95 32.30 1tbg s ARG 52 CO 0.24 0.62 0.00 0.41 0.02 0.00 0.00 175.30 176.59 1tbg n GLY 53 N 0.40 0.54 3.65 -3.53 0.00 -1.26 -4.98 105.19 100.00 1tbg n GLY 53 Ca -0.06 0.13 -0.47 0.00 0.00 0.00 0.00 46.02 45.61 1tbg n GLY 53 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1tbg n HIS 54 N 0.00 2.07 0.31 1.61 8.25 -1.26 -4.86 115.22 121.34 1tbg n HIS 54 Ca 0.00 0.37 0.08 0.00 -0.26 0.00 0.00 57.72 57.92 1tbg n HIS 54 Cb 0.00 -2.48 0.23 0.00 1.12 0.00 0.00 29.99 28.86 1tbg n HIS 54 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1tbg n LEU 55 N 3.09 2.84 -3.83 2.41 4.77 -1.26 -4.84 117.00 120.18 1tbg n LEU 55 Ca 0.17 -1.42 -0.07 0.00 -0.03 0.00 0.00 56.01 54.65 1tbg n LEU 55 Cb 0.27 -0.36 -0.02 0.00 -2.33 0.00 0.00 43.42 40.98 1tbg n LEU 55 CO 0.63 0.71 0.48 0.00 -1.33 0.00 0.00 177.39 177.87 1tbg s ALA 56 N -1.30 -1.26 -0.45 -1.18 0.00 -1.26 -4.95 121.76 111.36 1tbg s ALA 56 Ca 0.35 -0.25 -0.45 0.00 0.00 0.00 0.00 51.96 51.62 1tbg s ALA 56 Cb 0.18 0.84 -0.19 0.00 0.00 0.00 0.00 23.12 23.96 1tbg s ALA 56 CO 0.24 -1.02 1.70 1.63 0.00 0.00 0.00 175.76 178.30 1tbg n LYS 57 N -0.46 0.28 -2.74 0.00 5.02 -1.26 -4.36 118.16 114.64 1tbg n LYS 57 Ca -0.05 0.10 -0.42 0.00 -2.02 0.00 0.00 58.31 55.92 1tbg n LYS 57 Cb 0.59 -1.65 -0.03 0.00 -0.02 0.00 0.00 35.03 33.92 1tbg n LYS 57 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1tbg s ILE 58 N 3.52 4.79 -0.44 -0.18 1.01 -1.04 -0.06 121.20 128.80 1tbg s ILE 58 Ca 1.05 2.02 0.12 0.00 0.00 0.00 0.00 60.65 63.84 1tbg s ILE 58 Cb -1.39 -4.30 -0.14 0.00 0.01 0.00 0.00 42.46 36.64 1tbg s ILE 58 CO 0.76 0.21 0.45 -1.22 0.00 0.00 0.00 174.94 175.14 1tbg n TYR 59 N 3.60 0.00 -3.79 3.97 4.02 -1.03 -4.13 117.16 119.81 1tbg n TYR 59 Ca 0.04 0.00 -0.04 0.00 -0.01 0.00 0.00 57.90 57.89 1tbg n TYR 59 Cb 0.51 -0.06 -0.01 0.00 -0.02 0.00 0.00 39.34 39.75 1tbg n TYR 59 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1tbg s ALA 60 N -2.28 -1.54 -0.01 -0.72 0.00 -1.26 -4.69 121.76 111.27 1tbg s ALA 60 Ca 0.03 -0.02 -0.29 0.00 0.00 0.00 0.00 51.96 51.67 1tbg s ALA 60 Cb 0.09 0.69 0.10 0.00 0.00 0.00 0.00 23.12 24.00 1tbg s ALA 60 CO 0.49 -1.04 0.91 0.00 0.00 0.00 0.00 175.76 176.12 1tbg s MET 61 N -3.29 0.80 -0.29 0.00 0.23 -1.26 -3.04 119.30 112.45 1tbg s MET 61 Ca 0.13 -0.30 -0.15 0.00 -1.03 0.00 0.00 55.69 54.33 1tbg s MET 61 Cb -0.02 0.36 0.12 0.00 -1.53 0.00 0.00 34.83 33.76 1tbg s MET 61 CO 0.04 -0.35 0.83 -1.58 -2.03 0.00 0.00 175.02 171.93 1tbg s HIS 62 N -3.08 -0.86 0.63 3.16 2.46 -0.58 -4.89 115.29 112.13 1tbg s HIS 62 Ca 0.06 1.66 -0.14 0.00 0.47 0.00 0.00 55.06 57.11 1tbg s HIS 62 Cb -0.01 0.52 -0.02 0.00 -0.13 0.00 0.00 32.58 32.94 1tbg s HIS 62 CO -0.08 -0.43 1.05 -1.58 -2.47 0.00 0.00 174.74 171.23 1tbg s TRP 63 N 1.77 3.07 0.39 3.88 0.52 -1.26 -0.86 118.94 126.44 1tbg s TRP 63 Ca -0.08 1.47 -0.05 0.00 0.02 0.00 0.00 56.10 57.46 1tbg s TRP 63 Cb -0.05 -2.94 -0.04 0.00 -1.15 0.00 0.00 33.47 29.28 1tbg s TRP 63 CO -0.18 -1.12 0.67 0.20 0.02 0.00 0.00 176.95 176.55 1tbg s GLY 64 N -3.23 1.61 0.22 0.98 0.00 0.16 -4.77 107.32 102.29 1tbg s GLY 64 Ca 0.61 -0.57 0.14 0.00 0.00 0.00 0.00 44.72 44.90 1tbg s GLY 64 CO 0.44 -0.44 1.40 -1.30 0.00 0.00 0.00 173.10 173.21 1tbg n THR 65 N -1.71 1.27 1.31 0.90 -2.24 -1.26 -0.54 114.28 112.01 1tbg n THR 65 Ca -0.01 0.66 0.15 0.00 -2.27 0.00 0.00 64.05 62.58 1tbg n THR 65 Cb 0.55 -1.66 0.70 0.00 -2.10 0.00 0.00 70.33 67.82 1tbg n THR 65 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1tbg n ASP 66 N -1.98 0.04 -2.45 3.42 5.75 -1.26 -4.79 116.55 115.28 1tbg n ASP 66 Ca -0.01 -0.01 -0.19 0.00 -0.01 0.00 0.00 54.79 54.57 1tbg n ASP 66 Cb 0.06 -0.31 0.02 0.00 -1.03 0.00 0.00 41.12 39.85 1tbg n ASP 66 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 1tbg n SER 67 N -1.32 -5.48 0.00 -1.12 7.64 0.30 -4.79 113.62 108.85 1tbg n SER 67 Ca 0.12 -0.17 0.00 0.00 1.01 0.00 0.00 58.87 59.84 1tbg n SER 67 Cb 0.27 -4.39 0.00 0.00 -1.01 0.00 0.00 64.21 59.08 1tbg n SER 67 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 1tbg n ARG 68 N -3.31 0.00 -3.04 1.43 0.63 -1.26 -4.93 116.66 106.18 1tbg n ARG 68 Ca -0.14 0.00 -0.42 0.00 -0.92 0.00 0.00 57.85 56.37 1tbg n ARG 68 Cb 0.63 -0.10 -0.06 0.00 0.45 0.00 0.00 32.46 33.38 1tbg n ARG 68 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 1tbg s LEU 69 N -4.41 4.19 0.07 6.15 1.43 -1.26 -1.51 118.68 123.34 1tbg s LEU 69 Ca 0.00 0.27 0.09 0.00 -1.03 0.00 0.00 54.13 53.46 1tbg s LEU 69 Cb 0.00 -2.89 -0.03 0.00 0.03 0.00 0.00 46.19 43.29 1tbg s LEU 69 CO 0.00 -0.64 -0.24 -1.48 0.23 0.00 0.00 176.35 174.22 1tbg s LEU 70 N 2.86 2.33 0.18 1.79 0.05 -1.12 0.38 118.68 125.15 1tbg s LEU 70 Ca 0.27 -0.59 0.05 0.00 0.05 0.00 0.00 54.13 53.91 1tbg s LEU 70 Cb -0.14 -1.33 -0.04 0.00 -2.05 0.00 0.00 46.19 42.63 1tbg s LEU 70 CO 0.15 0.24 0.19 0.54 -0.55 0.00 0.00 176.35 176.92 1tbg s VAL 71 N -0.91 4.71 -0.05 1.48 0.11 -0.04 -0.77 120.40 124.93 1tbg s VAL 71 Ca 0.13 -1.05 -0.30 0.00 -2.93 0.00 0.00 61.98 57.83 1tbg s VAL 71 Cb -0.10 -3.44 0.08 0.00 -1.53 0.00 0.00 36.38 31.38 1tbg s VAL 71 CO 0.04 -0.16 0.71 -0.94 -3.33 0.00 0.00 175.10 171.42 1tbg s SER 72 N -3.32 -0.62 0.29 3.54 1.04 0.13 -1.52 113.70 113.24 1tbg s SER 72 Ca 0.32 0.64 0.02 0.00 0.48 0.00 0.00 55.95 57.42 1tbg s SER 72 Cb -0.10 0.52 -0.06 0.00 0.10 0.00 0.00 66.02 66.48 1tbg s SER 72 CO 0.25 -0.60 0.08 0.00 0.98 0.00 0.00 173.24 173.94 1tbg s ALA 73 N -1.35 2.04 0.23 5.32 0.00 -1.17 0.36 121.76 127.18 1tbg s ALA 73 Ca -0.09 -1.96 -0.18 0.00 0.00 0.00 0.00 51.96 49.73 1tbg s ALA 73 Cb -0.00 0.86 0.02 0.00 0.00 0.00 0.00 23.12 24.00 1tbg s ALA 73 CO 0.08 -0.39 0.58 -1.54 0.00 0.00 0.00 175.76 174.49 1tbg s SER 74 N -3.40 -0.25 0.00 0.00 1.04 -1.25 -2.45 113.70 107.40 1tbg s SER 74 Ca 0.37 -0.58 0.00 0.00 0.48 0.00 0.00 55.95 56.22 1tbg s SER 74 Cb 0.08 0.63 0.00 0.00 0.10 0.00 0.00 66.02 66.83 1tbg s SER 74 CO 0.15 -1.15 0.80 0.00 0.98 0.00 0.00 173.24 174.01 1tbg n GLN 75 N -0.39 0.00 -1.01 4.02 1.13 0.92 -1.01 117.38 121.04 1tbg n GLN 75 Ca -0.07 0.31 -0.12 0.00 -1.94 0.00 0.00 57.00 55.18 1tbg n GLN 75 Cb 0.61 -1.52 0.24 0.00 0.11 0.00 0.00 30.24 29.68 1tbg n GLN 75 CO 0.00 0.00 0.00 -0.40 -1.44 0.00 0.00 177.06 175.22 1tbg n ASP 76 N -1.30 4.27 -3.99 1.08 5.68 -1.26 -4.51 116.55 116.52 1tbg n ASP 76 Ca 0.00 -3.24 -0.28 0.00 -0.50 0.00 0.00 54.79 50.77 1tbg n ASP 76 Cb 0.02 -0.76 -0.02 0.00 -1.14 0.00 0.00 41.12 39.22 1tbg n ASP 76 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1tbg n GLY 77 N -0.44 -0.33 2.79 6.12 0.00 -0.18 -4.90 105.19 108.25 1tbg n GLY 77 Ca 0.44 0.20 -0.30 0.00 0.00 0.00 0.00 46.02 46.36 1tbg n GLY 77 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1tbg s LYS 78 N -6.69 0.91 -1.03 1.61 2.47 -1.24 -1.08 119.74 114.69 1tbg s LYS 78 Ca 0.08 -1.31 -0.23 0.00 -1.56 0.00 0.00 55.97 52.96 1tbg s LYS 78 Cb -0.04 -2.25 0.05 0.00 -1.46 0.00 0.00 37.83 34.14 1tbg s LYS 78 CO 0.91 -0.99 1.45 -1.17 0.16 0.00 0.00 175.35 175.71 1tbg s LEU 79 N 1.37 3.58 -0.06 5.43 2.96 0.21 -3.76 118.68 128.40 1tbg s LEU 79 Ca 0.11 -1.52 -0.15 0.00 -0.22 0.00 0.00 54.13 52.35 1tbg s LEU 79 Cb -0.18 -2.56 -0.05 0.00 0.50 0.00 0.00 46.19 43.89 1tbg s LEU 79 CO -0.20 -1.48 0.38 -0.63 -1.32 0.00 0.00 176.35 173.11 1tbg s ILE 80 N 4.85 5.14 -0.10 6.68 1.01 0.16 -0.66 121.20 138.28 1tbg s ILE 80 Ca 0.46 0.77 0.02 0.00 0.00 0.00 0.00 60.65 61.89 1tbg s ILE 80 Cb -0.00 -3.70 -0.02 0.00 0.01 0.00 0.00 42.46 38.75 1tbg s ILE 80 CO -0.09 0.50 -0.15 -0.63 0.00 0.00 0.00 174.94 174.56 1tbg s ILE 81 N -0.45 2.90 0.41 2.92 1.09 0.34 0.17 121.20 128.58 1tbg s ILE 81 Ca 0.22 -0.74 0.04 0.00 -1.10 0.00 0.00 60.65 59.08 1tbg s ILE 81 Cb -0.15 -2.18 -0.05 0.00 -1.06 0.00 0.00 42.46 39.02 1tbg s ILE 81 CO 0.10 0.55 0.04 0.26 -0.10 0.00 0.00 174.94 175.79 1tbg s TRP 82 N 0.02 2.08 -0.40 3.97 0.52 0.05 0.07 118.94 125.25 1tbg s TRP 82 Ca -0.05 -0.92 -0.03 0.00 0.02 0.00 0.00 56.10 55.12 1tbg s TRP 82 Cb -0.15 -1.50 0.11 0.00 -1.15 0.00 0.00 33.47 30.78 1tbg s TRP 82 CO 0.04 0.15 0.20 0.34 0.02 0.00 0.00 176.95 177.70 1tbg s ASP 83 N -3.68 5.24 0.24 2.95 -1.08 -0.46 -2.80 116.67 117.08 1tbg s ASP 83 Ca 0.26 -2.01 -0.04 0.00 -0.52 0.00 0.00 52.55 50.24 1tbg s ASP 83 Cb 0.06 -1.82 0.40 0.00 -1.46 0.00 0.00 42.92 40.10 1tbg s ASP 83 CO 0.13 -0.53 1.80 0.77 0.52 0.00 0.00 175.17 177.85 1tbg h SER 84 N 8.04 0.61 -1.00 -0.34 4.64 -1.59 0.54 113.55 124.45 1tbg h SER 84 Ca -0.13 0.06 0.05 0.00 -0.47 0.00 0.00 61.79 61.30 1tbg h SER 84 Cb 1.05 -0.06 -0.06 0.00 -0.31 0.00 0.00 62.40 63.02 1tbg h SER 84 CO 0.69 0.34 0.65 1.88 -0.87 0.00 0.00 176.83 179.52 1tbg h TYR 85 N 0.73 1.21 0.00 4.77 -1.99 -1.94 -3.20 116.97 116.55 1tbg h TYR 85 Ca 0.40 0.03 0.00 0.00 2.00 0.00 0.00 58.73 61.16 1tbg h TYR 85 Cb 0.40 -0.40 0.00 0.00 2.00 0.00 0.00 36.73 38.73 1tbg h TYR 85 CO -0.07 0.67 -1.55 0.25 -0.00 0.00 0.00 178.16 177.45 1tbg n THR 86 N -4.47 0.00 -2.23 -2.88 -2.24 -1.04 -5.05 114.28 96.38 1tbg n THR 86 Ca 0.14 -0.33 -0.03 0.00 -2.27 0.00 0.00 64.05 61.56 1tbg n THR 86 Cb 0.14 0.31 0.02 0.00 -2.10 0.00 0.00 70.33 68.69 1tbg n THR 86 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1tbg n THR 87 N -1.93 -4.83 -3.63 4.28 -1.04 0.19 -5.05 114.28 102.27 1tbg n THR 87 Ca -0.02 -0.35 -0.15 0.00 -2.04 0.00 0.00 64.05 61.49 1tbg n THR 87 Cb 0.40 -4.78 -0.07 0.00 -1.82 0.00 0.00 70.33 64.05 1tbg n THR 87 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1tbg s ASN 88 N -2.81 -0.55 -0.36 8.00 4.22 -1.18 -4.96 114.94 117.30 1tbg s ASN 88 Ca 0.10 0.78 -0.28 0.00 -2.14 0.00 0.00 52.86 51.33 1tbg s ASN 88 Cb -0.01 0.76 -0.04 0.00 1.28 0.00 0.00 41.25 43.25 1tbg s ASN 88 CO 0.33 -0.41 2.03 -0.54 -2.04 0.00 0.00 177.10 176.46 1tbg s LYS 89 N -0.61 2.98 0.29 3.55 -0.14 -1.26 -1.36 119.74 123.20 1tbg s LYS 89 Ca -0.07 1.49 0.17 0.00 -1.36 0.00 0.00 55.97 56.20 1tbg s LYS 89 Cb -0.03 -4.34 0.10 0.00 -1.68 0.00 0.00 37.83 31.88 1tbg s LYS 89 CO 0.05 -2.28 1.41 0.28 -0.76 0.00 0.00 175.35 174.05 1tbg h VAL 90 N 7.06 0.63 -2.33 3.17 2.07 -0.65 -3.46 116.25 122.74 1tbg h VAL 90 Ca -0.33 -1.91 -0.08 0.00 0.82 0.00 0.00 66.70 65.20 1tbg h VAL 90 Cb 1.20 2.27 -0.21 0.00 -1.52 0.00 0.00 31.29 33.04 1tbg h VAL 90 CO 1.06 0.36 0.01 -1.00 0.02 0.00 0.00 177.57 178.02 1tbg s HIS 91 N -3.02 -0.57 -0.37 1.57 3.76 -0.62 -4.96 115.29 111.09 1tbg s HIS 91 Ca 0.04 1.17 0.01 0.00 -0.15 0.00 0.00 55.06 56.12 1tbg s HIS 91 Cb 0.07 0.27 0.14 0.00 1.11 0.00 0.00 32.58 34.18 1tbg s HIS 91 CO 0.74 -0.44 0.23 0.00 -0.85 0.00 0.00 174.74 174.42 1tbg s ALA 92 N -0.56 1.06 -0.40 -1.40 0.00 -1.26 -0.50 121.76 118.69 1tbg s ALA 92 Ca -0.07 -1.99 -0.20 0.00 0.00 0.00 0.00 51.96 49.71 1tbg s ALA 92 Cb -0.03 -1.61 0.01 0.00 0.00 0.00 0.00 23.12 21.49 1tbg s ALA 92 CO 0.05 -2.08 0.59 0.42 0.00 0.00 0.00 175.76 174.73 1tbg s ILE 93 N 0.87 4.91 0.05 0.00 1.01 0.16 -4.92 121.20 123.28 1tbg s ILE 93 Ca 0.20 0.20 -0.30 0.00 0.00 0.00 0.00 60.65 60.76 1tbg s ILE 93 Cb -0.19 -4.11 -0.04 0.00 0.01 0.00 0.00 42.46 38.13 1tbg s ILE 93 CO -0.03 -0.44 1.00 -2.84 0.00 0.00 0.00 174.94 172.63 1tbg s PRO 94 N 2.63 4.59 0.01 2.79 0.02 -1.26 0.64 135.00 144.42 1tbg s PRO 94 Ca 0.21 1.48 0.01 0.00 0.02 0.00 0.00 61.00 62.71 1tbg s PRO 94 Cb -0.15 -3.41 -0.04 0.00 0.02 0.00 0.00 34.50 30.92 1tbg s PRO 94 CO 0.16 0.02 0.06 -0.51 -0.33 0.00 0.00 177.00 176.40 1tbg s LEU 95 N 0.63 3.78 0.40 -5.54 1.02 -0.24 -4.94 118.68 113.79 1tbg s LEU 95 Ca 0.51 0.08 0.25 0.00 0.02 0.00 0.00 54.13 54.98 1tbg s LEU 95 Cb -0.23 -2.24 1.34 0.00 0.02 0.00 0.00 46.19 45.09 1tbg s LEU 95 CO 0.29 0.26 1.74 0.03 0.02 0.00 0.00 176.35 178.69 1tbg h ARG 96 N 4.03 0.00 -5.56 1.70 -0.00 -1.96 -3.39 114.38 109.19 1tbg h ARG 96 Ca -0.49 0.00 -0.59 0.00 -0.50 0.00 0.00 59.98 58.40 1tbg h ARG 96 Cb 1.18 0.00 -0.31 0.00 0.00 0.00 0.00 29.97 30.84 1tbg h ARG 96 CO 0.61 0.00 -0.85 -1.54 0.00 0.00 0.00 179.97 178.20 1tbg s SER 97 N -4.15 2.36 0.05 7.04 1.04 -1.26 -5.03 113.70 113.76 1tbg s SER 97 Ca -0.03 -0.38 0.13 0.00 0.48 0.00 0.00 55.95 56.15 1tbg s SER 97 Cb 0.07 -0.58 -0.16 0.00 0.10 0.00 0.00 66.02 65.45 1tbg s SER 97 CO 0.22 0.19 0.89 0.28 0.98 0.00 0.00 173.24 175.81 1tbg h SER 98 N 6.09 0.00 -0.30 7.02 0.02 -1.84 -3.40 113.55 121.15 1tbg h SER 98 Ca -0.34 0.00 -0.65 0.00 -0.84 0.00 0.00 61.79 59.96 1tbg h SER 98 Cb 1.17 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.67 1tbg h SER 98 CO 0.48 0.80 2.52 0.79 -1.14 0.00 0.00 176.83 180.28 1tbg n TRP 99 N -3.05 3.52 -3.29 3.45 8.01 -1.26 -3.47 117.44 121.35 1tbg n TRP 99 Ca -0.10 -2.60 -0.41 0.00 -1.31 0.00 0.00 57.50 53.08 1tbg n TRP 99 Cb 0.93 -2.45 -0.08 0.00 -2.01 0.00 0.00 31.31 27.69 1tbg n TRP 99 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.69 176.76 1tbg s VAL 100 N 4.58 5.07 -0.13 -0.99 1.01 -1.26 -3.12 120.40 125.56 1tbg s VAL 100 Ca 0.53 0.19 0.17 0.00 0.00 0.00 0.00 61.98 62.87 1tbg s VAL 100 Cb 0.10 -3.93 -0.13 0.00 0.00 0.00 0.00 36.38 32.42 1tbg s VAL 100 CO 0.02 -0.20 0.83 0.23 0.00 0.00 0.00 175.10 175.98 1tbg n MET 101 N 5.63 0.62 -4.13 2.72 2.81 0.88 -4.65 117.12 120.99 1tbg n MET 101 Ca -0.06 0.22 -0.12 0.00 -1.81 0.00 0.00 57.70 55.93 1tbg n MET 101 Cb 0.49 -1.81 -0.08 0.00 -0.71 0.00 0.00 33.22 31.11 1tbg n MET 101 CO 0.00 0.00 0.00 -0.08 1.51 0.00 0.00 175.97 177.40 1tbg s THR 102 N -2.93 0.00 -0.28 2.03 -1.32 -1.08 -4.66 115.64 107.39 1tbg s THR 102 Ca -0.03 -1.76 -0.25 0.00 -1.21 0.00 0.00 61.69 58.44 1tbg s THR 102 Cb 0.09 -2.42 0.10 0.00 -1.51 0.00 0.00 72.50 68.76 1tbg s THR 102 CO 0.81 0.00 0.93 0.00 -2.21 0.00 0.00 174.62 174.15 1tbg s ALA 104 N 0.27 2.30 -0.10 0.00 0.00 -0.66 -4.71 121.76 118.87 1tbg s ALA 104 Ca 0.02 -1.78 0.02 0.00 0.00 0.00 0.00 51.96 50.23 1tbg s ALA 104 Cb -0.05 -0.09 0.01 0.00 0.00 0.00 0.00 23.12 22.99 1tbg s ALA 104 CO -0.04 0.10 -0.16 -0.47 0.00 0.00 0.00 175.76 175.19 1tbg s TYR 105 N -2.84 1.99 0.26 0.00 6.14 -1.26 -1.88 117.35 119.75 1tbg s TYR 105 Ca 0.26 -0.87 -0.30 0.00 0.64 0.00 0.00 57.07 56.80 1tbg s TYR 105 Cb -0.01 -1.41 -0.10 0.00 0.42 0.00 0.00 41.96 40.86 1tbg s TYR 105 CO 0.10 -0.42 1.39 0.00 0.64 0.00 0.00 175.55 177.26 1tbg s ALA 106 N 0.78 3.59 0.60 3.97 0.00 -0.33 -4.65 121.76 125.72 1tbg s ALA 106 Ca -0.11 1.29 0.31 0.00 0.00 0.00 0.00 51.96 53.44 1tbg s ALA 106 Cb -0.16 -3.53 1.78 0.00 0.00 0.00 0.00 23.12 21.21 1tbg s ALA 106 CO 0.02 -0.70 2.15 -1.00 0.00 0.00 0.00 175.76 176.23 1tbg h PRO 107 N 4.74 0.00 0.00 0.00 0.13 -1.89 0.53 132.00 135.50 1tbg h PRO 107 Ca -0.46 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.66 1tbg h PRO 107 Cb 1.22 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.35 1tbg h PRO 107 CO 0.75 0.00 -0.57 0.66 -0.23 0.00 0.00 178.00 178.61 1tbg h SER 108 N 0.00 0.00 -0.03 1.44 4.64 -1.93 -3.42 113.55 114.25 1tbg h SER 108 Ca 0.05 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.36 1tbg h SER 108 Cb 0.34 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.43 1tbg h SER 108 CO -0.00 0.04 -0.01 0.61 -0.87 0.00 0.00 176.83 176.60 1tbg n GLY 109 N 1.16 0.47 0.15 -0.77 0.00 0.18 -4.89 105.19 101.49 1tbg n GLY 109 Ca 0.01 -0.20 0.12 0.00 0.00 0.00 0.00 46.02 45.95 1tbg n GLY 109 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1tbg h ASN 110 N 0.00 0.00 -5.56 1.61 -0.26 -1.92 -3.44 115.58 106.00 1tbg h ASN 110 Ca -0.01 0.00 -0.26 0.00 -0.56 0.00 0.00 56.30 55.47 1tbg h ASN 110 Cb 0.16 0.00 -0.11 0.00 -1.06 0.00 0.00 38.32 37.30 1tbg h ASN 110 CO 0.02 0.00 -0.37 -0.31 -1.06 0.00 0.00 177.43 175.71 1tbg s TYR 111 N -3.32 1.09 0.32 1.19 1.51 -1.26 -0.03 117.35 116.86 1tbg s TYR 111 Ca 0.02 -1.28 -0.00 0.00 -1.01 0.00 0.00 57.07 54.79 1tbg s TYR 111 Cb 0.08 -0.31 0.00 0.00 -0.11 0.00 0.00 41.96 41.63 1tbg s TYR 111 CO 0.75 -0.90 0.42 1.33 -1.11 0.00 0.00 175.55 176.05 1tbg n VAL 112 N -0.45 0.00 -3.89 0.71 0.24 -0.03 -1.19 118.33 113.73 1tbg n VAL 112 Ca 0.02 -1.75 -0.08 0.00 -2.04 0.00 0.00 64.34 60.49 1tbg n VAL 112 Cb 0.63 1.04 -0.03 0.00 -1.47 0.00 0.00 33.84 34.00 1tbg n VAL 112 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1tbg s ALA 113 N -2.78 -0.88 -0.16 2.33 0.00 -0.79 -0.36 121.76 119.12 1tbg s ALA 113 Ca 0.29 -0.48 -0.34 0.00 0.00 0.00 0.00 51.96 51.42 1tbg s ALA 113 Cb -0.00 0.92 0.14 0.00 0.00 0.00 0.00 23.12 24.18 1tbg s ALA 113 CO 0.20 -0.96 1.25 0.00 0.00 0.00 0.00 175.76 176.26 1tbg n GLY 115 N -0.19 0.18 0.00 0.00 0.00 -1.18 -1.00 105.19 102.99 1tbg n GLY 115 Ca -0.01 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 45.01 1tbg n GLY 115 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tbg n GLY 116 N -0.85 0.38 0.20 -0.02 0.00 -1.25 -0.09 105.19 103.57 1tbg n GLY 116 Ca 0.05 0.41 0.14 0.00 0.00 0.00 0.00 46.02 46.62 1tbg n GLY 116 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1tbg h LEU 117 N 0.00 0.00 0.00 0.99 3.38 -1.84 0.13 115.31 117.97 1tbg h LEU 117 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1tbg h LEU 117 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1tbg h LEU 117 CO 0.00 0.00 0.00 -0.90 0.09 0.00 0.00 178.44 177.63 1tbg n ASP 118 N -2.54 0.00 -1.55 -0.43 5.68 -1.26 -4.69 116.55 111.75 1tbg n ASP 118 Ca -0.00 0.17 -0.18 0.00 -0.50 0.00 0.00 54.79 54.28 1tbg n ASP 118 Cb 0.15 -0.34 -0.07 0.00 -1.14 0.00 0.00 41.12 39.72 1tbg n ASP 118 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1tbg n ASN 119 N -1.34 -4.67 -4.37 -1.12 4.13 -0.48 -4.94 115.26 102.47 1tbg n ASN 119 Ca 0.07 0.42 -0.22 0.00 1.68 0.00 0.00 54.58 56.53 1tbg n ASN 119 Cb 0.14 -4.18 -0.11 0.00 -1.54 0.00 0.00 39.78 34.09 1tbg n ASN 119 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1tbg s ILE 120 N -2.51 1.96 -0.30 2.41 1.01 -1.26 -4.23 121.20 118.27 1tbg s ILE 120 Ca 0.00 -2.07 0.03 0.00 0.00 0.00 0.00 60.65 58.61 1tbg s ILE 120 Cb 0.00 -1.99 0.08 0.00 0.01 0.00 0.00 42.46 40.56 1tbg s ILE 120 CO 0.00 -0.37 -0.02 0.00 0.00 0.00 0.00 174.94 174.55 1tbg s SER 122 N 1.03 6.36 0.20 0.00 0.01 -0.17 -0.38 113.70 120.74 1tbg s SER 122 Ca 0.02 0.42 -0.11 0.00 1.31 0.00 0.00 55.95 57.59 1tbg s SER 122 Cb -0.19 -2.22 -0.07 0.00 0.21 0.00 0.00 66.02 63.75 1tbg s SER 122 CO -0.07 -0.11 0.54 -0.63 0.41 0.00 0.00 173.24 173.38 1tbg s ILE 123 N 1.57 4.91 -0.14 1.44 -1.09 0.92 -1.77 121.20 127.04 1tbg s ILE 123 Ca 0.17 0.58 -0.02 0.00 -2.23 0.00 0.00 60.65 59.15 1tbg s ILE 123 Cb -0.15 -3.65 0.05 0.00 -1.58 0.00 0.00 42.46 37.12 1tbg s ILE 123 CO 0.08 0.04 0.02 -0.31 -1.23 0.00 0.00 174.94 173.53 1tbg s TYR 124 N -1.70 0.91 -0.36 3.97 1.51 0.51 -1.90 117.35 120.29 1tbg s TYR 124 Ca 0.44 -0.58 -0.29 0.00 -1.01 0.00 0.00 57.07 55.63 1tbg s TYR 124 Cb -0.12 -0.95 0.01 0.00 -0.11 0.00 0.00 41.96 40.79 1tbg s TYR 124 CO 0.20 -0.50 1.26 1.21 -1.11 0.00 0.00 175.55 176.62 1tbg s ASN 125 N 1.90 6.63 0.00 2.29 2.47 -1.26 -0.85 114.94 126.12 1tbg s ASN 125 Ca 0.02 0.97 0.25 0.00 0.42 0.00 0.00 52.86 54.51 1tbg s ASN 125 Cb -0.15 -2.54 0.45 0.00 -1.45 0.00 0.00 41.25 37.56 1tbg s ASN 125 CO -0.07 -1.16 1.38 0.18 -3.72 0.00 0.00 177.10 173.71 1tbg n LEU 126 N 7.82 1.46 0.06 3.21 4.77 0.96 -4.56 117.00 130.72 1tbg n LEU 126 Ca 0.14 -0.47 0.00 0.00 -0.03 0.00 0.00 56.01 55.65 1tbg n LEU 126 Cb 0.47 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.50 1tbg n LEU 126 CO 0.66 0.27 0.00 1.17 -1.33 0.00 0.00 177.39 178.16 1tbg n LYS 127 N -0.36 0.00 0.00 3.23 3.00 -1.18 -4.78 118.16 118.07 1tbg n LYS 127 Ca 0.11 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.42 1tbg n LYS 127 Cb 0.40 -0.40 0.00 0.00 0.00 0.00 0.00 35.03 35.03 1tbg n LYS 127 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.40 179.81 1tbg n THR 128 N -3.44 0.00 -3.64 3.15 -1.04 -1.26 -3.99 114.28 104.05 1tbg n THR 128 Ca 0.00 0.00 -0.26 0.00 -2.04 0.00 0.00 64.05 61.75 1tbg n THR 128 Cb 0.00 -0.69 -0.17 0.00 -1.82 0.00 0.00 70.33 67.65 1tbg n THR 128 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 1tbg s ARG 129 N -1.88 0.20 0.05 -2.82 0.52 -1.26 -5.14 118.95 108.62 1tbg s ARG 129 Ca 0.00 -0.17 -0.30 0.00 -0.52 0.00 0.00 55.73 54.74 1tbg s ARG 129 Cb 0.00 -1.88 -0.04 0.00 0.52 0.00 0.00 34.95 33.55 1tbg s ARG 129 CO 0.00 -0.67 1.03 -2.00 0.02 0.00 0.00 175.30 173.68 1tbg s GLU 130 N 2.08 4.56 1.57 3.54 -6.30 -1.26 -4.70 118.70 118.19 1tbg s GLU 130 Ca 0.02 1.53 0.00 0.00 -2.50 0.00 0.00 54.97 54.01 1tbg s GLU 130 Cb -0.16 -3.41 0.00 0.00 0.00 0.00 0.00 34.13 30.56 1tbg s GLU 130 CO -0.09 -0.04 0.00 0.41 0.02 0.00 0.00 175.26 175.56 1tbg n GLY 131 N 2.79 1.98 3.57 -1.50 0.00 -1.26 -4.81 105.19 105.97 1tbg n GLY 131 Ca 0.06 0.08 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 1tbg n GLY 131 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1tbg s ASN 132 N -4.00 5.50 -0.33 1.61 2.47 -1.26 -4.94 114.94 113.98 1tbg s ASN 132 Ca 0.00 0.88 -0.11 0.00 0.42 0.00 0.00 52.86 54.06 1tbg s ASN 132 Cb 0.00 -2.52 -0.00 0.00 -1.45 0.00 0.00 41.25 37.27 1tbg s ASN 132 CO 0.00 -2.10 0.18 0.54 -3.72 0.00 0.00 177.10 172.01 1tbg s VAL 133 N 8.30 4.76 0.20 -5.21 0.11 -1.26 -4.92 120.40 122.37 1tbg s VAL 133 Ca 0.76 -0.46 -0.08 0.00 -2.93 0.00 0.00 61.98 59.27 1tbg s VAL 133 Cb -0.18 -3.47 -0.02 0.00 -1.53 0.00 0.00 36.38 31.18 1tbg s VAL 133 CO 0.28 -0.01 0.31 0.00 -3.33 0.00 0.00 175.10 172.34 1tbg s ARG 134 N 1.63 1.31 -0.30 1.54 1.04 -1.26 -4.98 118.95 117.93 1tbg s ARG 134 Ca 0.04 -1.33 -0.34 0.00 -1.04 0.00 0.00 55.73 53.06 1tbg s ARG 134 Cb -0.18 0.38 -0.10 0.00 -2.04 0.00 0.00 34.95 33.01 1tbg s ARG 134 CO 0.07 -0.49 2.16 1.55 -0.04 0.00 0.00 175.30 178.55 1tbg n VAL 135 N -0.29 0.25 0.79 4.99 3.14 -1.26 -4.06 118.33 121.88 1tbg n VAL 135 Ca -0.03 -0.28 0.11 0.00 -2.96 0.00 0.00 64.34 61.19 1tbg n VAL 135 Cb 0.63 -1.82 0.28 0.00 -1.06 0.00 0.00 33.84 31.88 1tbg n VAL 135 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 1tbg n SER 136 N 9.82 2.57 -3.65 6.55 7.64 -0.80 -4.89 113.62 130.86 1tbg n SER 136 Ca 0.37 -1.86 -0.02 0.00 1.01 0.00 0.00 58.87 58.37 1tbg n SER 136 Cb 0.27 -0.17 -0.07 0.00 -1.01 0.00 0.00 64.21 63.24 1tbg n SER 136 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 1tbg s ARG 137 N -1.66 0.20 -0.15 1.43 6.06 -1.23 -4.99 118.95 118.60 1tbg s ARG 137 Ca 0.35 0.29 0.01 0.00 -2.50 0.00 0.00 55.73 53.88 1tbg s ARG 137 Cb 0.20 0.06 0.02 0.00 0.06 0.00 0.00 34.95 35.30 1tbg s ARG 137 CO 0.29 -0.03 -0.15 -1.21 -2.50 0.00 0.00 175.30 171.69 1tbg s GLU 138 N 0.71 2.38 -0.43 5.12 2.02 -1.26 -0.06 118.70 127.18 1tbg s GLU 138 Ca -0.02 -0.59 -0.19 0.00 0.02 0.00 0.00 54.97 54.18 1tbg s GLU 138 Cb -0.04 -2.14 0.02 0.00 0.10 0.00 0.00 34.13 32.08 1tbg s GLU 138 CO -0.12 -0.21 0.55 -0.51 0.02 0.00 0.00 175.26 174.99 1tbg s LEU 139 N 1.40 4.67 -0.06 1.80 1.43 0.49 -4.94 118.68 123.46 1tbg s LEU 139 Ca 0.03 -0.49 0.00 0.00 -1.03 0.00 0.00 54.13 52.65 1tbg s LEU 139 Cb -0.13 -2.58 -0.03 0.00 0.03 0.00 0.00 46.19 43.48 1tbg s LEU 139 CO -0.10 -0.70 -0.05 0.00 0.23 0.00 0.00 176.35 175.74 1tbg s ALA 140 N 2.52 3.07 0.00 4.21 0.00 -1.26 -2.14 121.76 128.16 1tbg s ALA 140 Ca 0.18 -0.88 0.00 0.00 0.00 0.00 0.00 51.96 51.26 1tbg s ALA 140 Cb -0.15 -1.28 0.00 0.00 0.00 0.00 0.00 23.12 21.68 1tbg s ALA 140 CO 0.17 0.58 0.00 0.41 0.00 0.00 0.00 175.76 176.92 1tbg n GLY 141 N 2.13 0.37 3.76 0.00 0.00 -1.26 -4.86 105.19 105.33 1tbg n GLY 141 Ca -0.18 0.04 -0.41 0.00 0.00 0.00 0.00 46.02 45.47 1tbg n GLY 141 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1tbg n HIS 142 N 0.00 2.88 -1.12 1.61 8.25 -1.26 -4.90 115.22 120.68 1tbg n HIS 142 Ca 0.00 0.39 -0.13 0.00 -0.26 0.00 0.00 57.72 57.72 1tbg n HIS 142 Cb 0.00 -2.54 0.26 0.00 1.12 0.00 0.00 29.99 28.82 1tbg n HIS 142 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1tbg n THR 143 N 1.01 3.07 -3.45 1.59 -2.24 -1.26 -4.87 114.28 108.13 1tbg n THR 143 Ca 0.04 -1.75 -0.12 0.00 -2.27 0.00 0.00 64.05 59.95 1tbg n THR 143 Cb 0.38 -0.40 -0.03 0.00 -2.10 0.00 0.00 70.33 68.18 1tbg n THR 143 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1tbg s GLY 144 N -1.12 -0.59 0.53 3.38 0.00 -1.26 -4.67 107.32 103.59 1tbg s GLY 144 Ca 0.56 0.52 -0.19 0.00 0.00 0.00 0.00 44.72 45.60 1tbg s GLY 144 CO 0.13 0.19 0.61 1.58 0.00 0.00 0.00 173.10 175.61 1tbg n TYR 145 N -0.26 -0.35 -2.96 1.90 0.18 -1.26 -4.35 117.16 110.06 1tbg n TYR 145 Ca -0.17 0.48 -0.42 0.00 1.88 0.00 0.00 57.90 59.67 1tbg n TYR 145 Cb 0.64 -2.00 -0.05 0.00 -0.38 0.00 0.00 39.34 37.55 1tbg n TYR 145 CO 0.00 0.00 0.00 -1.17 -2.08 0.00 0.00 176.86 173.61 1tbg s LEU 146 N 0.59 4.12 -0.10 -3.48 2.96 0.33 -0.70 118.68 122.40 1tbg s LEU 146 Ca 0.68 0.44 0.02 0.00 -0.22 0.00 0.00 54.13 55.05 1tbg s LEU 146 Cb -0.48 -3.02 -0.25 0.00 0.50 0.00 0.00 46.19 42.94 1tbg s LEU 146 CO 0.55 -0.68 0.46 -1.54 -1.32 0.00 0.00 176.35 173.81 1tbg n SER 147 N 6.33 1.55 -3.54 3.68 3.41 -1.00 -3.88 113.62 120.17 1tbg n SER 147 Ca 0.03 0.27 -0.17 0.00 -0.26 0.00 0.00 58.87 58.75 1tbg n SER 147 Cb 0.48 -0.47 -0.06 0.00 -0.26 0.00 0.00 64.21 63.90 1tbg n SER 147 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1tbg s ARG 150 N -0.07 0.11 -0.00 0.00 1.81 -0.06 -4.45 118.95 116.30 1tbg s ARG 150 Ca -0.02 0.18 -0.30 0.00 -1.72 0.00 0.00 55.73 53.87 1tbg s ARG 150 Cb -0.02 -0.42 -0.06 0.00 -0.45 0.00 0.00 34.95 34.00 1tbg s ARG 150 CO 0.01 -0.19 1.53 -0.06 -0.68 0.00 0.00 175.30 175.91 1tbg s PHE 151 N 1.29 2.51 -0.10 -0.53 0.08 -1.26 -2.02 117.98 117.95 1tbg s PHE 151 Ca -0.06 0.52 -0.18 0.00 0.12 0.00 0.00 56.93 57.33 1tbg s PHE 151 Cb -0.13 -3.81 -0.28 0.00 -0.57 0.00 0.00 43.02 38.23 1tbg s PHE 151 CO -0.03 -3.18 0.63 -0.07 -0.10 0.00 0.00 175.22 172.47 1tbg h LEU 152 N 8.94 0.37 0.00 -0.37 4.07 -1.03 -3.45 115.31 123.84 1tbg h LEU 152 Ca -0.39 -0.86 0.03 0.00 0.08 0.00 0.00 57.88 56.73 1tbg h LEU 152 Cb 1.18 -0.12 -0.00 0.00 1.08 0.00 0.00 40.66 42.80 1tbg h LEU 152 CO 0.93 1.54 0.13 -0.90 -1.08 0.00 0.00 178.44 179.06 1tbg n ASP 153 N -4.02 -0.48 -0.32 -0.43 5.75 -0.35 -4.92 116.55 111.77 1tbg n ASP 153 Ca -0.22 -1.28 0.09 0.00 -0.01 0.00 0.00 54.79 53.37 1tbg n ASP 153 Cb 0.86 0.79 0.30 0.00 -1.03 0.00 0.00 41.12 42.04 1tbg n ASP 153 CO 0.00 0.00 0.00 0.44 -0.11 0.00 0.00 177.20 177.53 1tbg h ASP 154 N 0.51 0.81 -0.48 -1.12 3.32 -2.00 -2.52 116.42 114.94 1tbg h ASP 154 Ca -0.07 0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.02 1tbg h ASP 154 Cb 0.31 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.74 1tbg h ASP 154 CO 0.10 0.42 0.00 -3.20 -1.72 0.00 0.00 179.24 174.84 1tbg n ASN 155 N -4.60 3.31 -3.77 6.45 5.15 -1.26 -4.84 115.26 115.70 1tbg n ASN 155 Ca 0.18 -2.02 -0.14 0.00 -0.60 0.00 0.00 54.58 52.00 1tbg n ASN 155 Cb 0.40 -0.33 -0.15 0.00 -0.53 0.00 0.00 39.78 39.17 1tbg n ASN 155 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1tbg s GLN 156 N -1.04 0.02 -0.08 1.20 -0.21 -0.95 -1.77 119.66 116.82 1tbg s GLN 156 Ca 0.32 0.24 -0.08 0.00 0.02 0.00 0.00 55.36 55.87 1tbg s GLN 156 Cb 0.17 -0.19 0.02 0.00 1.00 0.00 0.00 33.01 34.01 1tbg s GLN 156 CO 0.21 -0.15 0.22 -1.50 -2.12 0.00 0.00 175.29 171.96 1tbg s ILE 157 N 1.00 0.00 -0.03 1.08 2.07 -1.20 -0.33 121.20 123.79 1tbg s ILE 157 Ca -0.08 -0.03 0.02 0.00 -1.41 0.00 0.00 60.65 59.16 1tbg s ILE 157 Cb -0.11 -0.32 -0.03 0.00 0.13 0.00 0.00 42.46 42.12 1tbg s ILE 157 CO -0.04 -0.01 -0.08 0.54 -1.91 0.00 0.00 174.94 173.43 1tbg s VAL 158 N 0.05 3.56 0.12 4.00 0.11 -0.86 -0.69 120.40 126.69 1tbg s VAL 158 Ca -0.01 -0.65 0.04 0.00 -2.93 0.00 0.00 61.98 58.43 1tbg s VAL 158 Cb -0.02 -2.48 -0.04 0.00 -1.53 0.00 0.00 36.38 32.31 1tbg s VAL 158 CO 0.00 0.51 -0.10 0.42 -3.33 0.00 0.00 175.10 172.61 1tbg s THR 159 N -0.88 0.98 0.20 5.04 -4.23 -0.10 -0.88 115.64 115.78 1tbg s THR 159 Ca 0.14 -1.84 0.11 0.00 -1.18 0.00 0.00 61.69 58.92 1tbg s THR 159 Cb -0.11 -1.59 -0.04 0.00 1.34 0.00 0.00 72.50 72.10 1tbg s THR 159 CO 0.04 -0.68 -0.21 -0.94 -0.54 0.00 0.00 174.62 172.29 1tbg s SER 160 N -2.80 3.61 0.05 3.99 1.04 0.44 -0.36 113.70 119.67 1tbg s SER 160 Ca 0.11 -0.82 -0.16 0.00 0.48 0.00 0.00 55.95 55.55 1tbg s SER 160 Cb 0.00 -0.35 0.03 0.00 0.10 0.00 0.00 66.02 65.80 1tbg s SER 160 CO -0.01 0.11 0.37 -0.55 0.98 0.00 0.00 173.24 174.15 1tbg s SER 161 N -2.76 -0.22 0.20 7.02 0.15 -0.76 -2.36 113.70 114.96 1tbg s SER 161 Ca 0.22 -0.09 0.17 0.00 0.70 0.00 0.00 55.95 56.95 1tbg s SER 161 Cb -0.08 0.40 0.82 0.00 -1.71 0.00 0.00 66.02 65.45 1tbg s SER 161 CO 0.11 -0.66 1.51 0.61 1.20 0.00 0.00 173.24 176.02 1tbg n GLY 162 N 0.49 -0.90 0.00 9.45 0.00 0.12 -1.31 105.19 113.04 1tbg n GLY 162 Ca -0.18 0.10 0.05 0.00 0.00 0.00 0.00 46.02 45.99 1tbg n GLY 162 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1tbg n ASP 163 N -2.01 0.00 -0.22 1.61 5.75 -1.26 -4.33 116.55 116.09 1tbg n ASP 163 Ca 0.00 -0.80 -0.03 0.00 -0.01 0.00 0.00 54.79 53.95 1tbg n ASP 163 Cb 0.09 0.00 -0.01 0.00 -1.03 0.00 0.00 41.12 40.17 1tbg n ASP 163 CO 0.00 0.00 0.00 0.41 -0.11 0.00 0.00 177.20 177.50 1tbg n THR 164 N -0.78 0.00 -3.95 2.12 -1.04 -0.43 -4.94 114.28 105.26 1tbg n THR 164 Ca 0.07 0.00 -0.09 0.00 -2.04 0.00 0.00 64.05 61.99 1tbg n THR 164 Cb 0.03 -0.70 -0.10 0.00 -1.82 0.00 0.00 70.33 67.75 1tbg n THR 164 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 1tbg s THR 165 N -2.10 0.12 0.19 12.58 -4.23 -1.21 -4.45 115.64 116.54 1tbg s THR 165 Ca 0.00 -1.02 0.07 0.00 -1.18 0.00 0.00 61.69 59.56 1tbg s THR 165 Cb 0.00 -0.62 -0.04 0.00 1.34 0.00 0.00 72.50 73.18 1tbg s THR 165 CO 0.00 -0.56 0.04 0.00 -0.54 0.00 0.00 174.62 173.56 1tbg s ALA 167 N -1.86 -0.75 -0.21 0.00 0.00 0.52 -0.61 121.76 118.85 1tbg s ALA 167 Ca 0.29 0.65 -0.09 0.00 0.00 0.00 0.00 51.96 52.81 1tbg s ALA 167 Cb -0.09 -0.30 -0.05 0.00 0.00 0.00 0.00 23.12 22.69 1tbg s ALA 167 CO 0.20 -0.19 0.12 -1.17 0.00 0.00 0.00 175.76 174.73 1tbg s LEU 168 N -0.38 4.05 0.20 0.00 0.20 0.31 -0.92 118.68 122.15 1tbg s LEU 168 Ca -0.05 0.13 0.10 0.00 0.69 0.00 0.00 54.13 55.00 1tbg s LEU 168 Cb -0.03 -2.06 -0.04 0.00 -0.43 0.00 0.00 46.19 43.62 1tbg s LEU 168 CO 0.02 0.13 -0.11 0.26 -0.29 0.00 0.00 176.35 176.35 1tbg s TRP 169 N 0.66 2.56 -0.37 5.38 0.52 0.13 0.10 118.94 127.92 1tbg s TRP 169 Ca 0.07 -0.25 -0.06 0.00 0.02 0.00 0.00 56.10 55.87 1tbg s TRP 169 Cb -0.12 -1.22 0.06 0.00 -1.15 0.00 0.00 33.47 31.04 1tbg s TRP 169 CO 0.01 0.55 0.16 0.34 0.02 0.00 0.00 176.95 178.02 1tbg s ASP 170 N -2.99 5.37 0.36 2.95 -1.08 -0.69 -3.28 116.67 117.31 1tbg s ASP 170 Ca 0.26 -1.40 0.06 0.00 -0.52 0.00 0.00 52.55 50.95 1tbg s ASP 170 Cb -0.08 -1.88 0.75 0.00 -1.46 0.00 0.00 42.92 40.25 1tbg s ASP 170 CO 0.15 -0.42 1.95 0.16 0.52 0.00 0.00 175.17 177.53 1tbg h ILE 171 N 6.20 1.01 -0.12 4.11 3.07 -1.66 0.74 117.51 130.86 1tbg h ILE 171 Ca -0.21 -0.26 0.02 0.00 1.55 0.00 0.00 64.86 65.96 1tbg h ILE 171 Cb 1.07 0.20 -0.02 0.00 -0.27 0.00 0.00 36.82 37.80 1tbg h ILE 171 CO 0.66 0.14 0.00 -0.33 -1.05 0.00 0.00 178.15 177.57 1tbg h GLU 172 N 0.75 0.04 0.00 0.16 5.08 -1.94 -2.92 114.58 115.75 1tbg h GLU 172 Ca 0.32 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.68 1tbg h GLU 172 Cb 0.30 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.54 1tbg h GLU 172 CO -0.11 0.03 -0.67 1.79 -1.00 0.00 0.00 179.01 179.05 1tbg h THR 173 N 0.05 0.00 0.00 1.13 1.35 -1.91 -3.47 112.91 110.05 1tbg h THR 173 Ca 0.05 -0.52 0.00 0.00 -0.55 0.00 0.00 66.41 65.40 1tbg h THR 173 Cb 0.06 1.07 0.00 0.00 -1.73 0.00 0.00 68.15 67.55 1tbg h THR 173 CO -0.09 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.79 1tbg n GLY 174 N 1.33 0.34 3.82 5.82 0.00 0.23 -4.98 105.19 111.75 1tbg n GLY 174 Ca 0.03 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.67 1tbg n GLY 174 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1tbg s GLN 175 N -0.79 4.09 -0.87 1.61 1.11 -1.22 -4.52 119.66 119.08 1tbg s GLN 175 Ca 0.00 0.58 -0.25 0.00 0.01 0.00 0.00 55.36 55.71 1tbg s GLN 175 Cb 0.00 -3.24 -0.01 0.00 -1.01 0.00 0.00 33.01 28.75 1tbg s GLN 175 CO 0.00 0.63 1.73 -1.14 0.01 0.00 0.00 175.29 176.52 1tbg s GLN 176 N -0.98 2.91 0.15 2.91 0.74 -1.26 -1.71 119.66 122.41 1tbg s GLN 176 Ca 0.27 -0.35 -0.18 0.00 0.05 0.00 0.00 55.36 55.14 1tbg s GLN 176 Cb -0.18 -4.94 0.04 0.00 1.10 0.00 0.00 33.01 29.04 1tbg s GLN 176 CO 0.16 -2.83 1.69 1.15 -0.55 0.00 0.00 175.29 174.91 1tbg h THR 177 N 6.95 0.72 -3.96 -0.34 2.02 -0.66 -3.44 112.91 114.19 1tbg h THR 177 Ca 0.03 -0.01 -0.34 0.00 0.77 0.00 0.00 66.41 66.86 1tbg h THR 177 Cb 1.04 0.68 -0.22 0.00 -1.74 0.00 0.00 68.15 67.91 1tbg h THR 177 CO 1.28 0.01 -0.75 -0.89 0.37 0.00 0.00 175.52 175.53 1tbg s THR 178 N -6.20 0.74 -0.00 3.16 2.01 -0.81 -4.98 115.64 109.56 1tbg s THR 178 Ca -0.14 -1.05 0.08 0.00 0.31 0.00 0.00 61.69 60.90 1tbg s THR 178 Cb 0.12 -0.75 -0.02 0.00 0.01 0.00 0.00 72.50 71.86 1tbg s THR 178 CO 0.70 -0.25 -0.25 -0.89 -0.69 0.00 0.00 174.62 173.24 1tbg s THR 179 N -1.17 2.19 -0.27 -0.82 2.01 -1.26 -0.53 115.64 115.80 1tbg s THR 179 Ca -0.05 -1.16 0.02 0.00 0.31 0.00 0.00 61.69 60.81 1tbg s THR 179 Cb -0.09 -1.80 0.06 0.00 0.01 0.00 0.00 72.50 70.68 1tbg s THR 179 CO 0.01 0.51 -0.09 -0.36 -0.69 0.00 0.00 174.62 174.00 1tbg s PHE 180 N -0.69 3.27 -0.05 4.92 0.08 0.21 -4.77 117.98 120.96 1tbg s PHE 180 Ca 0.11 -2.26 0.06 0.00 0.12 0.00 0.00 56.93 54.96 1tbg s PHE 180 Cb -0.10 -1.96 -0.01 0.00 -0.57 0.00 0.00 43.02 40.37 1tbg s PHE 180 CO 0.00 -0.87 -0.24 0.95 -0.10 0.00 0.00 175.22 174.96 1tbg s THR 181 N 1.12 1.96 0.00 0.64 -4.23 -1.26 -2.21 115.64 111.66 1tbg s THR 181 Ca -0.08 -1.02 0.00 0.00 -1.18 0.00 0.00 61.69 59.40 1tbg s THR 181 Cb -0.20 -1.65 0.00 0.00 1.34 0.00 0.00 72.50 71.99 1tbg s THR 181 CO -0.04 0.55 0.00 0.61 -0.54 0.00 0.00 174.62 175.19 1tbg n GLY 182 N 2.87 0.43 3.77 3.99 0.00 -1.26 -4.82 105.19 110.17 1tbg n GLY 182 Ca -0.17 -0.03 -0.39 0.00 0.00 0.00 0.00 46.02 45.43 1tbg n GLY 182 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1tbg s HIS 183 N 0.00 3.05 -0.33 1.61 3.76 -1.26 -4.92 115.29 117.20 1tbg s HIS 183 Ca 0.00 1.52 0.16 0.00 -0.15 0.00 0.00 55.06 56.58 1tbg s HIS 183 Cb 0.00 -3.48 0.66 0.00 1.11 0.00 0.00 32.58 30.87 1tbg s HIS 183 CO 0.00 -1.49 1.57 0.25 -0.85 0.00 0.00 174.74 174.21 1tbg n THR 184 N 0.25 2.38 -3.86 1.30 -2.24 -1.26 -4.90 114.28 105.95 1tbg n THR 184 Ca 0.03 -1.59 -0.10 0.00 -2.27 0.00 0.00 64.05 60.13 1tbg n THR 184 Cb 0.45 -0.19 -0.08 0.00 -2.10 0.00 0.00 70.33 68.41 1tbg n THR 184 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1tbg s GLY 185 N -1.34 0.08 -0.14 3.38 0.00 -1.26 -4.83 107.32 103.20 1tbg s GLY 185 Ca 0.47 -0.45 -0.37 0.00 0.00 0.00 0.00 44.72 44.38 1tbg s GLY 185 CO 0.13 -0.62 1.79 1.22 0.00 0.00 0.00 173.10 175.62 1tbg n ASP 186 N 0.41 2.94 -4.77 1.64 9.92 -1.26 -4.26 116.55 121.17 1tbg n ASP 186 Ca -0.17 1.02 -0.38 0.00 -0.53 0.00 0.00 54.79 54.73 1tbg n ASP 186 Cb 0.60 -1.28 -0.02 0.00 -0.64 0.00 0.00 41.12 39.78 1tbg n ASP 186 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1tbg s VAL 187 N 3.55 3.19 -0.06 2.53 1.01 -0.97 -0.53 120.40 129.13 1tbg s VAL 187 Ca 0.94 1.02 0.05 0.00 0.00 0.00 0.00 61.98 63.99 1tbg s VAL 187 Cb -0.85 -3.58 -0.07 0.00 0.00 0.00 0.00 36.38 31.88 1tbg s VAL 187 CO 0.56 0.11 0.03 0.23 0.00 0.00 0.00 175.10 176.03 1tbg n MET 188 N 0.18 2.86 -3.77 2.72 2.81 -0.12 -3.95 117.12 117.85 1tbg n MET 188 Ca 0.04 -0.01 -0.06 0.00 -1.81 0.00 0.00 57.70 55.86 1tbg n MET 188 Cb 0.46 -1.15 -0.02 0.00 -0.71 0.00 0.00 33.22 31.80 1tbg n MET 188 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 1tbg s SER 189 N -3.67 -0.24 0.15 7.83 1.04 -1.10 -4.01 113.70 113.70 1tbg s SER 189 Ca -0.03 -0.46 -0.09 0.00 0.48 0.00 0.00 55.95 55.85 1tbg s SER 189 Cb 0.02 0.60 -0.00 0.00 0.10 0.00 0.00 66.02 66.74 1tbg s SER 189 CO 0.24 -1.10 0.28 -1.48 0.98 0.00 0.00 173.24 172.16 1tbg s LEU 190 N -2.90 1.01 -0.22 2.42 0.05 -1.26 -0.90 118.68 116.88 1tbg s LEU 190 Ca 0.11 -0.80 -0.10 0.00 0.05 0.00 0.00 54.13 53.39 1tbg s LEU 190 Cb -0.03 1.21 0.08 0.00 -2.05 0.00 0.00 46.19 45.39 1tbg s LEU 190 CO 0.03 -0.86 0.50 -0.55 -0.55 0.00 0.00 176.35 174.92 1tbg s SER 191 N -2.94 -0.61 0.55 1.48 0.15 -0.14 -4.84 113.70 107.35 1tbg s SER 191 Ca 0.14 1.13 -0.15 0.00 0.70 0.00 0.00 55.95 57.78 1tbg s SER 191 Cb 0.03 1.23 -0.06 0.00 -1.71 0.00 0.00 66.02 65.51 1tbg s SER 191 CO -0.03 -0.22 1.00 -0.76 1.20 0.00 0.00 173.24 174.44 1tbg s LEU 192 N 1.94 3.49 0.60 3.45 1.43 -1.26 -1.32 118.68 127.01 1tbg s LEU 192 Ca -0.07 1.53 -0.08 0.00 -1.03 0.00 0.00 54.13 54.47 1tbg s LEU 192 Cb -0.09 -4.50 -0.02 0.00 0.03 0.00 0.00 46.19 41.62 1tbg s LEU 192 CO -0.15 -0.70 0.95 0.00 0.23 0.00 0.00 176.35 176.68 1tbg s ALA 193 N -2.80 3.18 0.48 4.21 0.00 -0.58 -4.64 121.76 121.60 1tbg s ALA 193 Ca 0.58 -0.39 0.23 0.00 0.00 0.00 0.00 51.96 52.38 1tbg s ALA 193 Cb -0.10 -2.83 1.27 0.00 0.00 0.00 0.00 23.12 21.45 1tbg s ALA 193 CO 0.39 -0.73 1.89 -1.35 0.00 0.00 0.00 175.76 175.96 1tbg h PRO 194 N -0.23 0.20 0.00 0.00 0.11 -1.88 0.33 132.00 130.54 1tbg h PRO 194 Ca -0.45 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.63 1tbg h PRO 194 Cb 1.22 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.28 1tbg h PRO 194 CO 0.62 0.13 -0.81 0.38 -0.21 0.00 0.00 178.00 178.11 1tbg h ASP 195 N 0.21 0.00 0.00 -2.05 3.04 -1.92 -3.48 116.42 112.22 1tbg h ASP 195 Ca 0.41 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 54.20 1tbg h ASP 195 Cb 1.30 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.59 1tbg h ASP 195 CO -0.09 0.08 0.00 0.41 -2.04 0.00 0.00 179.24 177.60 1tbg n THR 196 N -2.81 0.00 0.37 1.15 -1.04 0.12 -4.80 114.28 107.27 1tbg n THR 196 Ca -0.00 0.00 0.13 0.00 -2.04 0.00 0.00 64.05 62.13 1tbg n THR 196 Cb 0.58 -0.04 0.53 0.00 -1.82 0.00 0.00 70.33 69.57 1tbg n THR 196 CO 0.00 0.00 0.00 -0.09 -0.64 0.00 0.00 175.07 174.34 1tbg h ARG 197 N 1.57 0.00 -4.26 -2.82 2.43 -1.92 -3.44 114.38 105.93 1tbg h ARG 197 Ca 0.00 0.00 -0.13 0.00 -0.81 0.00 0.00 59.98 59.04 1tbg h ARG 197 Cb 0.00 0.00 -0.15 0.00 -0.42 0.00 0.00 29.97 29.40 1tbg h ARG 197 CO 0.00 0.00 -0.66 -0.51 -1.51 0.00 0.00 179.97 177.29 1tbg s LEU 198 N -4.68 2.31 0.19 3.80 1.43 -1.26 -1.31 118.68 119.15 1tbg s LEU 198 Ca 0.03 -1.03 -0.15 0.00 -1.03 0.00 0.00 54.13 51.96 1tbg s LEU 198 Cb 0.09 0.25 0.02 0.00 0.03 0.00 0.00 46.19 46.58 1tbg s LEU 198 CO 0.40 -0.63 0.46 0.72 0.23 0.00 0.00 176.35 177.52 1tbg s PHE 199 N -3.94 0.05 -0.01 0.29 -0.71 -0.63 -1.53 117.98 111.50 1tbg s PHE 199 Ca 0.10 -0.41 0.03 0.00 -1.04 0.00 0.00 56.93 55.62 1tbg s PHE 199 Cb 0.08 0.26 -0.01 0.00 -1.21 0.00 0.00 43.02 42.14 1tbg s PHE 199 CO -0.08 -0.87 -0.09 0.54 -1.34 0.00 0.00 175.22 173.38 1tbg s VAL 200 N -3.91 0.74 0.13 -2.49 0.11 -0.44 -0.38 120.40 114.16 1tbg s VAL 200 Ca 0.12 -0.39 0.09 0.00 -2.93 0.00 0.00 61.98 58.87 1tbg s VAL 200 Cb 0.00 -0.62 -0.04 0.00 -1.53 0.00 0.00 36.38 34.19 1tbg s VAL 200 CO -0.01 0.21 -0.21 -0.94 -3.33 0.00 0.00 175.10 170.82 1tbg s SER 201 N -0.18 2.72 -0.17 3.54 1.04 -0.35 -0.97 113.70 119.34 1tbg s SER 201 Ca 0.03 -0.77 -0.01 0.00 0.48 0.00 0.00 55.95 55.68 1tbg s SER 201 Cb -0.04 -0.16 -0.00 0.00 0.10 0.00 0.00 66.02 65.92 1tbg s SER 201 CO -0.00 0.04 -0.14 -0.83 0.98 0.00 0.00 173.24 173.29 1tbg s GLY 202 N -2.26 1.49 0.33 7.32 0.00 -0.08 -1.13 107.32 113.00 1tbg s GLY 202 Ca 0.12 -1.09 0.09 0.00 0.00 0.00 0.00 44.72 43.84 1tbg s GLY 202 CO 0.06 0.14 -0.03 0.00 0.00 0.00 0.00 173.10 173.27 1tbg s ALA 203 N 1.01 3.10 -0.34 3.20 0.00 -0.77 -0.95 121.76 127.01 1tbg s ALA 203 Ca -0.01 -1.97 0.20 0.00 0.00 0.00 0.00 51.96 50.18 1tbg s ALA 203 Cb -0.15 -0.30 1.03 0.00 0.00 0.00 0.00 23.12 23.70 1tbg s ALA 203 CO -0.03 0.10 1.62 0.00 0.00 0.00 0.00 175.76 177.45 1tbg n ASP 205 N -2.18 0.78 -3.63 0.00 5.75 -1.26 -4.25 116.55 111.76 1tbg n ASP 205 Ca -0.00 -1.88 -0.24 0.00 -0.01 0.00 0.00 54.79 52.65 1tbg n ASP 205 Cb 0.08 -0.39 0.07 0.00 -1.03 0.00 0.00 41.12 39.85 1tbg n ASP 205 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1tbg n ALA 206 N -0.06 -1.38 -3.23 2.12 0.00 -0.85 -5.00 120.51 112.10 1tbg n ALA 206 Ca 0.00 0.33 -0.13 0.00 0.00 0.00 0.00 53.44 53.63 1tbg n ALA 206 Cb 0.20 -5.05 -0.09 0.00 0.00 0.00 0.00 19.45 14.51 1tbg n ALA 206 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1tbg s SER 207 N -3.43 -0.24 -0.01 0.00 1.04 -1.23 -4.47 113.70 105.36 1tbg s SER 207 Ca 0.54 0.27 0.02 0.00 0.48 0.00 0.00 55.95 57.26 1tbg s SER 207 Cb -0.24 0.43 -0.03 0.00 0.10 0.00 0.00 66.02 66.27 1tbg s SER 207 CO 0.75 -0.34 -0.04 0.00 0.98 0.00 0.00 173.24 174.58 1tbg s ALA 208 N -0.85 3.12 -0.01 5.32 0.00 -0.96 -1.85 121.76 126.52 1tbg s ALA 208 Ca -0.09 -0.97 0.05 0.00 0.00 0.00 0.00 51.96 50.94 1tbg s ALA 208 Cb -0.04 -1.23 -0.01 0.00 0.00 0.00 0.00 23.12 21.84 1tbg s ALA 208 CO 0.03 0.62 -0.16 0.15 0.00 0.00 0.00 175.76 176.40 1tbg s LYS 209 N -1.38 1.28 -0.20 0.00 1.02 -0.28 0.17 119.74 120.35 1tbg s LYS 209 Ca 0.17 -0.56 -0.11 0.00 0.02 0.00 0.00 55.97 55.50 1tbg s LYS 209 Cb -0.11 -1.23 -0.05 0.00 -0.52 0.00 0.00 37.83 35.91 1tbg s LYS 209 CO 0.08 0.33 0.16 -1.17 -0.92 0.00 0.00 175.35 173.83 1tbg s LEU 210 N -0.35 4.21 0.02 3.17 2.96 -0.21 -1.21 118.68 127.27 1tbg s LEU 210 Ca 0.06 0.27 0.08 0.00 -0.22 0.00 0.00 54.13 54.31 1tbg s LEU 210 Cb -0.06 -2.14 -0.02 0.00 0.50 0.00 0.00 46.19 44.46 1tbg s LEU 210 CO -0.01 0.15 -0.24 0.26 -1.32 0.00 0.00 176.35 175.20 1tbg s TRP 211 N 0.45 2.10 -0.37 5.38 0.52 0.48 0.44 118.94 127.94 1tbg s TRP 211 Ca 0.09 -0.40 -0.24 0.00 0.02 0.00 0.00 56.10 55.58 1tbg s TRP 211 Cb -0.12 -1.30 0.01 0.00 -1.15 0.00 0.00 33.47 30.92 1tbg s TRP 211 CO -0.00 0.05 0.80 0.34 0.02 0.00 0.00 176.95 178.16 1tbg s ASP 212 N -0.92 6.55 0.24 2.95 -1.08 -0.81 -1.61 116.67 121.98 1tbg s ASP 212 Ca 0.10 0.34 -0.05 0.00 -0.52 0.00 0.00 52.55 52.41 1tbg s ASP 212 Cb -0.09 -2.40 0.37 0.00 -1.46 0.00 0.00 42.92 39.34 1tbg s ASP 212 CO 0.01 -0.77 1.79 0.58 0.52 0.00 0.00 175.17 177.30 1tbg h VAL 213 N 5.79 0.87 -0.20 1.11 2.07 -1.51 0.45 116.25 124.83 1tbg h VAL 213 Ca -0.25 -0.24 -0.10 0.00 0.82 0.00 0.00 66.70 66.94 1tbg h VAL 213 Cb 1.09 0.12 -0.00 0.00 -1.52 0.00 0.00 31.29 30.98 1tbg h VAL 213 CO 0.93 0.13 -0.26 -0.09 0.02 0.00 0.00 177.57 178.29 1tbg h ARG 214 N 0.69 0.54 0.00 1.57 1.12 -1.93 -3.26 114.38 113.11 1tbg h ARG 214 Ca 0.38 -0.31 -0.05 0.00 -1.11 0.00 0.00 59.98 58.89 1tbg h ARG 214 Cb 0.38 0.02 -0.01 0.00 -0.01 0.00 0.00 29.97 30.35 1tbg h ARG 214 CO -0.26 0.90 -0.24 1.49 -3.11 0.00 0.00 179.97 178.75 1tbg h GLU 215 N 0.21 0.00 -5.11 0.20 4.81 -1.86 -3.48 114.58 109.35 1tbg h GLU 215 Ca 0.02 0.00 -0.35 0.00 -0.13 0.00 0.00 59.36 58.91 1tbg h GLU 215 Cb 0.83 0.00 0.12 0.00 0.63 0.00 0.00 28.75 30.33 1tbg h GLU 215 CO 0.06 0.24 -0.58 0.41 -0.73 0.00 0.00 179.01 178.41 1tbg n GLY 216 N 1.09 -0.35 3.38 1.92 0.00 0.15 -5.01 105.19 106.37 1tbg n GLY 216 Ca 0.03 0.13 -0.19 0.00 0.00 0.00 0.00 46.02 45.98 1tbg n GLY 216 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1tbg s MET 217 N -6.10 1.58 -0.24 1.61 1.00 -1.23 -4.68 119.30 111.24 1tbg s MET 217 Ca 0.49 -1.89 -0.15 0.00 0.00 0.00 0.00 55.69 54.14 1tbg s MET 217 Cb -0.22 -0.40 -0.04 0.00 0.00 0.00 0.00 34.83 34.18 1tbg s MET 217 CO 0.61 -0.34 0.38 0.00 0.00 0.00 0.00 175.02 175.68 1tbg h ARG 219 N 7.86 0.15 -2.14 0.00 2.47 -0.38 -3.49 114.38 118.86 1tbg h ARG 219 Ca -0.33 -0.26 0.04 0.00 -1.26 0.00 0.00 59.98 58.16 1tbg h ARG 219 Cb 1.16 0.10 -0.18 0.00 -1.65 0.00 0.00 29.97 29.40 1tbg h ARG 219 CO 0.67 1.13 0.38 1.14 0.56 0.00 0.00 179.97 183.85 1tbg s GLN 220 N -2.33 0.90 -0.05 0.04 -2.07 -1.22 -5.00 119.66 109.93 1tbg s GLN 220 Ca -0.17 -0.07 0.04 0.00 -1.82 0.00 0.00 55.36 53.35 1tbg s GLN 220 Cb -0.01 0.42 -0.02 0.00 -1.09 0.00 0.00 33.01 32.31 1tbg s GLN 220 CO 0.76 -0.34 -0.17 -0.08 -1.32 0.00 0.00 175.29 174.14 1tbg s THR 221 N -2.19 2.79 -0.09 3.63 -1.32 -1.26 -1.04 115.64 116.15 1tbg s THR 221 Ca -0.02 -0.82 0.00 0.00 -1.21 0.00 0.00 61.69 59.65 1tbg s THR 221 Cb -0.01 -2.07 -0.03 0.00 -1.51 0.00 0.00 72.50 68.89 1tbg s THR 221 CO -0.02 0.58 -0.09 -0.36 -2.21 0.00 0.00 174.62 172.53 1tbg s PHE 222 N -0.61 2.89 0.33 9.09 0.40 0.13 -4.96 117.98 125.24 1tbg s PHE 222 Ca 0.09 -0.17 0.08 0.00 -0.60 0.00 0.00 56.93 56.33 1tbg s PHE 222 Cb -0.11 -1.76 -0.06 0.00 0.51 0.00 0.00 43.02 41.60 1tbg s PHE 222 CO 0.01 0.15 -0.06 0.95 0.70 0.00 0.00 175.22 176.97 1tbg s THR 223 N -0.41 1.97 0.00 0.64 -4.23 -1.26 -2.26 115.64 110.09 1tbg s THR 223 Ca 0.06 -2.14 0.00 0.00 -1.18 0.00 0.00 61.69 58.42 1tbg s THR 223 Cb -0.12 -2.65 0.00 0.00 1.34 0.00 0.00 72.50 71.07 1tbg s THR 223 CO 0.02 -0.19 0.00 0.61 -0.54 0.00 0.00 174.62 174.52 1tbg n GLY 224 N -0.75 1.00 3.76 3.99 0.00 -1.26 -4.75 105.19 107.18 1tbg n GLY 224 Ca -0.05 0.01 -0.41 0.00 0.00 0.00 0.00 46.02 45.57 1tbg n GLY 224 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1tbg n HIS 225 N 0.00 2.95 -1.40 1.61 8.25 -1.26 -4.89 115.22 120.48 1tbg n HIS 225 Ca 0.00 0.35 -0.30 0.00 -0.26 0.00 0.00 57.72 57.52 1tbg n HIS 225 Cb 0.00 -2.57 0.10 0.00 1.12 0.00 0.00 29.99 28.64 1tbg n HIS 225 CO 0.00 0.00 0.00 -0.85 0.64 0.00 0.00 176.34 176.13 1tbg n GLU 226 N 1.23 2.66 -3.45 -0.41 0.00 -1.26 -4.87 120.64 114.54 1tbg n GLU 226 Ca 0.04 -3.34 -0.01 0.00 0.00 0.00 0.00 57.16 53.85 1tbg n GLU 226 Cb 0.38 -2.24 0.02 0.00 0.00 0.00 0.00 31.44 29.60 1tbg n GLU 226 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 1tbg n SER 227 N -0.95 -1.32 -4.76 -1.84 2.88 -1.26 -4.88 113.62 101.49 1tbg n SER 227 Ca 0.58 -1.63 -0.40 0.00 -1.33 0.00 0.00 58.87 56.09 1tbg n SER 227 Cb 0.91 2.13 -0.04 0.00 -0.75 0.00 0.00 64.21 66.46 1tbg n SER 227 CO 0.00 0.00 0.00 1.51 -1.23 0.00 0.00 175.04 175.32 1tbg s ASP 228 N -3.05 7.22 -0.60 -3.46 -4.77 -1.26 -4.00 116.67 106.75 1tbg s ASP 228 Ca 0.20 2.28 -0.25 0.00 -3.30 0.00 0.00 52.55 51.48 1tbg s ASP 228 Cb -0.02 -2.62 0.04 0.00 -1.09 0.00 0.00 42.92 39.23 1tbg s ASP 228 CO 0.03 -0.19 1.03 -0.63 0.70 0.00 0.00 175.17 176.12 1tbg s ILE 229 N -0.98 4.22 0.17 2.11 1.01 -1.22 -2.04 121.20 124.48 1tbg s ILE 229 Ca 0.46 0.27 0.06 0.00 0.00 0.00 0.00 60.65 61.44 1tbg s ILE 229 Cb -0.32 -4.65 -0.14 0.00 0.01 0.00 0.00 42.46 37.35 1tbg s ILE 229 CO 0.41 -1.32 1.40 0.78 0.00 0.00 0.00 174.94 176.20 1tbg h ASN 230 N 9.50 0.09 -4.97 3.58 -0.26 -1.32 -3.39 115.58 118.81 1tbg h ASN 230 Ca -0.27 -0.08 -0.17 0.00 -0.56 0.00 0.00 56.30 55.23 1tbg h ASN 230 Cb 1.07 -0.03 -0.15 0.00 -1.06 0.00 0.00 38.32 38.15 1tbg h ASN 230 CO 1.15 0.91 -0.69 0.00 -1.06 0.00 0.00 177.43 177.74 1tbg s ALA 231 N -3.10 0.73 -0.08 -0.83 0.00 -0.93 -4.49 121.76 113.05 1tbg s ALA 231 Ca -0.01 -1.28 -0.18 0.00 0.00 0.00 0.00 51.96 50.49 1tbg s ALA 231 Cb 0.11 0.24 0.04 0.00 0.00 0.00 0.00 23.12 23.51 1tbg s ALA 231 CO 0.81 -0.31 0.44 -1.50 0.00 0.00 0.00 175.76 175.19 1tbg s ILE 232 N -3.80 0.02 -0.20 0.00 2.07 -1.26 -0.87 121.20 117.17 1tbg s ILE 232 Ca 0.10 -0.20 -0.06 0.00 -1.41 0.00 0.00 60.65 59.07 1tbg s ILE 232 Cb 0.07 -0.70 0.09 0.00 0.13 0.00 0.00 42.46 42.05 1tbg s ILE 232 CO -0.07 -0.11 0.41 0.00 -1.91 0.00 0.00 174.94 173.25 1tbg s PHE 234 N 2.60 3.00 0.31 0.00 2.19 -1.26 -0.25 117.98 124.57 1tbg s PHE 234 Ca -0.00 1.50 -0.25 0.00 0.33 0.00 0.00 56.93 58.50 1tbg s PHE 234 Cb -0.12 -3.51 -0.10 0.00 -1.31 0.00 0.00 43.02 37.98 1tbg s PHE 234 CO -0.13 -1.60 0.92 0.12 1.83 0.00 0.00 175.22 176.36 1tbg s PHE 235 N -1.32 3.70 0.47 10.12 5.36 0.45 -4.86 117.98 131.90 1tbg s PHE 235 Ca 0.56 1.74 0.34 0.00 -0.96 0.00 0.00 56.93 58.61 1tbg s PHE 235 Cb -0.34 -2.89 1.49 0.00 -0.34 0.00 0.00 43.02 40.94 1tbg s PHE 235 CO 0.44 0.23 1.62 -1.00 -1.46 0.00 0.00 175.22 175.05 1tbg h PRO 236 N 3.23 0.06 -0.00 10.12 0.13 -1.92 0.17 132.00 143.79 1tbg h PRO 236 Ca -0.47 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1tbg h PRO 236 Cb 1.19 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1tbg h PRO 236 CO 0.65 0.04 -0.19 0.27 -0.23 0.00 0.00 178.00 178.54 1tbg n ASN 237 N -4.52 0.52 0.00 1.44 6.94 -1.26 -4.84 115.26 113.54 1tbg n ASN 237 Ca 0.38 -0.44 0.00 0.00 -0.02 0.00 0.00 54.58 54.50 1tbg n ASN 237 Cb 1.53 -0.03 0.00 0.00 -2.36 0.00 0.00 39.78 38.92 1tbg n ASN 237 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1tbg n GLY 238 N 1.36 0.32 0.03 4.83 0.00 0.60 -4.85 105.19 107.47 1tbg n GLY 238 Ca 0.11 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.21 1tbg n GLY 238 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1tbg n ASN 239 N -0.36 0.84 -4.08 1.61 3.02 -1.26 -4.95 115.26 110.07 1tbg n ASN 239 Ca 0.00 -0.92 -0.10 0.00 -0.03 0.00 0.00 54.58 53.53 1tbg n ASN 239 Cb 0.18 0.96 -0.07 0.00 -0.61 0.00 0.00 39.78 40.24 1tbg n ASN 239 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1tbg s ALA 240 N -2.51 0.41 0.03 5.41 0.00 -1.26 0.28 121.76 124.12 1tbg s ALA 240 Ca 0.07 -1.26 -0.26 0.00 0.00 0.00 0.00 51.96 50.51 1tbg s ALA 240 Cb 0.13 1.22 0.06 0.00 0.00 0.00 0.00 23.12 24.52 1tbg s ALA 240 CO 0.66 -0.74 0.59 -0.59 0.00 0.00 0.00 175.76 175.68 1tbg s PHE 241 N -4.07 -0.53 0.22 0.00 -0.12 -0.08 -0.41 117.98 112.99 1tbg s PHE 241 Ca 0.30 0.70 0.06 0.00 -0.05 0.00 0.00 56.93 57.94 1tbg s PHE 241 Cb 0.03 0.40 -0.03 0.00 -0.63 0.00 0.00 43.02 42.78 1tbg s PHE 241 CO 0.11 -0.66 0.24 0.00 -0.05 0.00 0.00 175.22 174.85 1tbg s ALA 242 N -2.14 3.71 0.01 1.99 0.00 0.66 -0.59 121.76 125.39 1tbg s ALA 242 Ca -0.07 -1.30 0.01 0.00 0.00 0.00 0.00 51.96 50.60 1tbg s ALA 242 Cb -0.01 -1.47 -0.01 0.00 0.00 0.00 0.00 23.12 21.63 1tbg s ALA 242 CO 0.01 0.32 -0.04 0.95 0.00 0.00 0.00 175.76 177.00 1tbg s THR 243 N -1.99 0.25 -0.05 0.00 -4.23 -0.82 -1.29 115.64 107.51 1tbg s THR 243 Ca 0.33 -0.46 0.02 0.00 -1.18 0.00 0.00 61.69 60.40 1tbg s THR 243 Cb -0.09 -0.28 -0.03 0.00 1.34 0.00 0.00 72.50 73.45 1tbg s THR 243 CO 0.26 -0.14 -0.10 -0.83 -0.54 0.00 0.00 174.62 173.27 1tbg s GLY 244 N -0.64 1.65 0.12 3.99 0.00 -0.05 -2.21 107.32 110.17 1tbg s GLY 244 Ca -0.05 -0.95 -0.11 0.00 0.00 0.00 0.00 44.72 43.61 1tbg s GLY 244 CO -0.00 -0.75 0.28 -0.45 0.00 0.00 0.00 173.10 172.18 1tbg s SER 245 N -0.91 -0.01 0.30 1.64 0.15 -1.19 -1.04 113.70 112.65 1tbg s SER 245 Ca 0.13 -0.61 0.23 0.00 0.70 0.00 0.00 55.95 56.40 1tbg s SER 245 Cb -0.11 0.41 1.11 0.00 -1.71 0.00 0.00 66.02 65.72 1tbg s SER 245 CO 0.02 -0.81 1.70 0.47 1.20 0.00 0.00 173.24 175.82 1tbg n ASP 246 N -0.15 0.64 -0.16 5.45 8.00 -0.87 -1.88 116.55 127.58 1tbg n ASP 246 Ca -0.13 0.73 0.01 0.00 0.71 0.00 0.00 54.79 56.10 1tbg n ASP 246 Cb 0.63 -0.84 0.02 0.00 -0.02 0.00 0.00 41.12 40.91 1tbg n ASP 246 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1tbg n ASP 247 N -2.28 0.39 -0.98 -2.24 5.68 -1.26 -4.32 116.55 111.54 1tbg n ASP 247 Ca 0.00 -2.01 -0.13 0.00 -0.50 0.00 0.00 54.79 52.16 1tbg n ASP 247 Cb 0.12 -0.11 -0.05 0.00 -1.14 0.00 0.00 41.12 39.94 1tbg n ASP 247 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1tbg n ALA 248 N -0.31 -0.20 -2.52 2.12 0.00 -0.79 -4.99 120.51 113.82 1tbg n ALA 248 Ca 0.01 0.20 -0.24 0.00 0.00 0.00 0.00 53.44 53.41 1tbg n ALA 248 Cb 0.08 -1.45 -0.14 0.00 0.00 0.00 0.00 19.45 17.94 1tbg n ALA 248 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1tbg s THR 249 N -2.47 1.49 0.03 0.00 -4.23 -1.25 -4.72 115.64 104.48 1tbg s THR 249 Ca 0.00 -1.06 -0.00 0.00 -1.18 0.00 0.00 61.69 59.44 1tbg s THR 249 Cb 0.00 -1.29 -0.04 0.00 1.34 0.00 0.00 72.50 72.51 1tbg s THR 249 CO 0.00 0.20 0.14 0.00 -0.54 0.00 0.00 174.62 174.42 1tbg s ARG 251 N -2.13 0.53 -0.16 0.00 0.52 -0.94 -0.10 118.95 116.67 1tbg s ARG 251 Ca 0.29 -0.82 -0.04 0.00 -0.52 0.00 0.00 55.73 54.64 1tbg s ARG 251 Cb -0.12 -0.20 -0.03 0.00 0.52 0.00 0.00 34.95 35.12 1tbg s ARG 251 CO 0.21 0.02 -0.03 -1.17 0.02 0.00 0.00 175.30 174.35 1tbg s LEU 252 N -1.78 3.26 0.07 2.53 0.20 0.16 -1.94 118.68 121.19 1tbg s LEU 252 Ca -0.08 -0.14 0.10 0.00 0.69 0.00 0.00 54.13 54.70 1tbg s LEU 252 Cb -0.08 -1.79 -0.03 0.00 -0.43 0.00 0.00 46.19 43.86 1tbg s LEU 252 CO -0.01 0.15 -0.26 -0.36 -0.29 0.00 0.00 176.35 175.58 1tbg s PHE 253 N 0.49 2.32 -0.16 5.38 0.08 0.24 0.26 117.98 126.59 1tbg s PHE 253 Ca -0.03 -0.40 0.02 0.00 0.12 0.00 0.00 56.93 56.64 1tbg s PHE 253 Cb -0.14 -1.35 0.01 0.00 -0.57 0.00 0.00 43.02 40.97 1tbg s PHE 253 CO 0.03 0.19 -0.21 0.34 -0.10 0.00 0.00 175.22 175.46 1tbg s ASP 254 N -1.47 3.12 0.31 1.36 -1.08 -0.90 -0.90 116.67 117.11 1tbg s ASP 254 Ca 0.12 -0.62 0.02 0.00 -0.52 0.00 0.00 52.55 51.56 1tbg s ASP 254 Cb -0.10 -1.46 0.59 0.00 -1.46 0.00 0.00 42.92 40.49 1tbg s ASP 254 CO 0.03 0.05 1.90 -0.07 0.52 0.00 0.00 175.17 177.60 1tbg h LEU 255 N 7.56 0.86 -0.41 -1.34 4.07 -0.49 0.53 115.31 126.09 1tbg h LEU 255 Ca -0.38 0.02 -0.16 0.00 0.08 0.00 0.00 57.88 57.44 1tbg h LEU 255 Cb 1.17 -0.16 -0.02 0.00 1.08 0.00 0.00 40.66 42.73 1tbg h LEU 255 CO 0.59 0.52 -0.75 0.03 -1.08 0.00 0.00 178.44 177.75 1tbg h ARG 256 N 0.96 0.00 0.00 1.13 -0.00 -1.96 -3.17 114.38 111.34 1tbg h ARG 256 Ca 0.41 0.00 -0.04 0.00 -0.50 0.00 0.00 59.98 59.85 1tbg h ARG 256 Cb 0.33 0.00 -0.01 0.00 0.00 0.00 0.00 29.97 30.29 1tbg h ARG 256 CO -0.17 0.75 -0.36 0.00 0.00 0.00 0.00 179.97 180.19 1tbg h ALA 257 N 1.25 0.82 -2.35 0.04 0.00 -1.74 -3.47 119.26 113.80 1tbg h ALA 257 Ca -0.01 -0.19 -0.42 0.00 0.00 0.00 0.00 54.91 54.30 1tbg h ALA 257 Cb 1.38 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 19.10 1tbg h ALA 257 CO 0.10 0.24 -0.49 -3.47 0.00 0.00 0.00 179.25 175.63 1tbg n ASP 258 N -3.07 -5.76 -3.77 0.00 2.03 0.12 -4.92 116.55 101.17 1tbg n ASP 258 Ca 0.02 0.14 -0.04 0.00 0.52 0.00 0.00 54.79 55.43 1tbg n ASP 258 Cb 0.61 -4.87 -0.01 0.00 -0.72 0.00 0.00 41.12 36.13 1tbg n ASP 258 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1tbg s GLN 259 N -4.64 1.32 0.62 -0.67 -2.07 -1.23 -4.89 119.66 108.10 1tbg s GLN 259 Ca 0.00 -0.73 -0.16 0.00 -1.82 0.00 0.00 55.36 52.64 1tbg s GLN 259 Cb 0.00 0.45 -0.02 0.00 -1.09 0.00 0.00 33.01 32.35 1tbg s GLN 259 CO 0.00 -0.61 1.10 -1.83 -1.32 0.00 0.00 175.29 172.64 1tbg s GLU 260 N -3.40 3.04 -0.07 9.60 -1.05 -1.26 -2.12 118.70 123.45 1tbg s GLU 260 Ca 0.12 1.40 0.15 0.00 -0.15 0.00 0.00 54.97 56.49 1tbg s GLU 260 Cb -0.02 -1.98 -0.22 0.00 -0.44 0.00 0.00 34.13 31.47 1tbg s GLU 260 CO 0.03 -1.06 0.23 1.28 0.95 0.00 0.00 175.26 176.70 1tbg n LEU 261 N -2.06 0.00 -3.51 1.83 4.32 0.14 -4.87 117.00 112.85 1tbg n LEU 261 Ca 0.10 0.00 -0.11 0.00 -0.02 0.00 0.00 56.01 55.99 1tbg n LEU 261 Cb 0.52 0.13 -0.03 0.00 -1.62 0.00 0.00 43.42 42.42 1tbg n LEU 261 CO 0.46 0.13 0.64 -0.32 -1.22 0.00 0.00 177.39 177.09 1tbg s MET 262 N -2.81 0.85 0.03 3.23 1.75 -1.23 -2.33 119.30 118.78 1tbg s MET 262 Ca -0.06 -0.13 0.08 0.00 -1.25 0.00 0.00 55.69 54.32 1tbg s MET 262 Cb 0.08 0.39 -0.02 0.00 2.84 0.00 0.00 34.83 38.12 1tbg s MET 262 CO 0.63 -0.33 -0.23 0.99 -0.65 0.00 0.00 175.02 175.43 1tbg s THR 263 N -2.43 1.81 -0.18 10.11 2.01 -1.26 -0.66 115.64 125.04 1tbg s THR 263 Ca 0.01 -1.18 0.00 0.00 0.31 0.00 0.00 61.69 60.84 1tbg s THR 263 Cb -0.01 -1.55 0.04 0.00 0.01 0.00 0.00 72.50 70.99 1tbg s THR 263 CO -0.04 0.33 -0.09 -0.31 -0.69 0.00 0.00 174.62 173.82 1tbg s TYR 264 N -0.72 2.17 -0.25 4.92 1.51 0.86 -4.98 117.35 120.86 1tbg s TYR 264 Ca 0.09 -1.40 -0.30 0.00 -1.01 0.00 0.00 57.07 54.45 1tbg s TYR 264 Cb -0.09 -1.54 0.17 0.00 -0.11 0.00 0.00 41.96 40.40 1tbg s TYR 264 CO 0.01 -0.70 1.27 -1.54 -1.11 0.00 0.00 175.55 173.49 1tbg s SER 265 N 1.48 -0.11 -0.03 2.29 1.04 -1.26 -1.50 113.70 115.60 1tbg s SER 265 Ca 0.00 0.11 0.06 0.00 0.48 0.00 0.00 55.95 56.60 1tbg s SER 265 Cb -0.16 0.10 -0.01 0.00 0.10 0.00 0.00 66.02 66.05 1tbg s SER 265 CO -0.08 -0.12 -0.22 -1.00 0.98 0.00 0.00 173.24 172.80 1tbg s HIS 266 N -1.20 2.04 0.35 5.02 3.76 -1.26 -5.01 115.29 118.99 1tbg s HIS 266 Ca 0.07 -0.49 0.18 0.00 -0.15 0.00 0.00 55.06 54.68 1tbg s HIS 266 Cb -0.01 -1.33 1.00 0.00 1.11 0.00 0.00 32.58 33.35 1tbg s HIS 266 CO -0.05 -0.11 1.51 0.38 -0.85 0.00 0.00 174.74 175.61 1tbg h ASP 267 N 5.85 0.00 -0.59 1.40 3.04 -2.01 0.36 116.42 124.46 1tbg h ASP 267 Ca -0.36 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.43 1tbg h ASP 267 Cb 1.15 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.44 1tbg h ASP 267 CO 0.47 0.00 0.00 -0.46 -2.04 0.00 0.00 179.24 177.21 1tbg n ASN 268 N -2.42 3.67 -4.22 4.15 6.94 -1.26 -4.77 115.26 117.35 1tbg n ASN 268 Ca -0.01 -1.99 -0.38 0.00 -0.02 0.00 0.00 54.58 52.18 1tbg n ASN 268 Cb 0.42 -0.39 -0.11 0.00 -2.36 0.00 0.00 39.78 37.33 1tbg n ASN 268 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 1tbg s ILE 269 N -1.11 3.73 -0.14 1.53 1.01 0.13 -4.92 121.20 121.42 1tbg s ILE 269 Ca 0.43 -1.50 0.01 0.00 0.00 0.00 0.00 60.65 59.59 1tbg s ILE 269 Cb 0.23 -3.29 0.00 0.00 0.01 0.00 0.00 42.46 39.41 1tbg s ILE 269 CO 0.30 -0.42 0.42 2.30 0.00 0.00 0.00 174.94 177.54 1tbg n ILE 270 N 4.78 0.00 -2.95 2.92 -5.35 -1.26 -4.65 119.36 112.84 1tbg n ILE 270 Ca -0.09 -0.49 -0.36 0.00 -0.27 0.00 0.00 62.75 61.54 1tbg n ILE 270 Cb 0.43 1.02 -0.06 0.00 -1.74 0.00 0.00 39.64 39.29 1tbg n ILE 270 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1tbg s GLY 272 N -1.74 1.95 -0.17 0.00 0.00 -1.26 -4.25 107.32 101.86 1tbg s GLY 272 Ca 0.49 0.52 -0.13 0.00 0.00 0.00 0.00 44.72 45.59 1tbg s GLY 272 CO 0.21 0.89 0.25 -0.42 0.00 0.00 0.00 173.10 174.02 1tbg s ILE 273 N -2.52 5.34 -0.26 0.90 1.01 -0.88 -1.95 121.20 122.84 1tbg s ILE 273 Ca 0.66 0.45 -0.01 0.00 0.00 0.00 0.00 60.65 61.75 1tbg s ILE 273 Cb -0.21 -3.59 -0.16 0.00 0.01 0.00 0.00 42.46 38.51 1tbg s ILE 273 CO 0.50 0.40 -0.23 0.35 0.00 0.00 0.00 174.94 175.96 1tbg n THR 274 N 3.58 1.51 -4.21 2.92 -2.24 -0.04 -3.91 114.28 111.88 1tbg n THR 274 Ca -0.13 -0.54 -0.15 0.00 -2.27 0.00 0.00 64.05 60.97 1tbg n THR 274 Cb 0.52 -1.52 -0.10 0.00 -2.10 0.00 0.00 70.33 67.13 1tbg n THR 274 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1tbg s SER 275 N -6.71 1.64 -0.18 3.42 1.04 -1.23 -4.24 113.70 107.44 1tbg s SER 275 Ca -0.35 -0.90 -0.14 0.00 0.48 0.00 0.00 55.95 55.04 1tbg s SER 275 Cb 0.10 -0.00 0.05 0.00 0.10 0.00 0.00 66.02 66.27 1tbg s SER 275 CO 0.59 -0.28 0.47 0.54 0.98 0.00 0.00 173.24 175.53 1tbg s VAL 276 N -2.81 -0.01 -0.07 5.02 0.11 -1.26 -0.14 120.40 121.23 1tbg s VAL 276 Ca 0.11 0.03 -0.25 0.00 -2.93 0.00 0.00 61.98 58.93 1tbg s VAL 276 Cb -0.01 -0.67 0.06 0.00 -1.53 0.00 0.00 36.38 34.23 1tbg s VAL 276 CO 0.00 0.01 0.58 -0.55 -3.33 0.00 0.00 175.10 171.82 1tbg s SER 277 N 0.77 -0.55 0.30 3.54 0.15 0.13 -4.65 113.70 113.38 1tbg s SER 277 Ca -0.04 0.67 -0.01 0.00 0.70 0.00 0.00 55.95 57.27 1tbg s SER 277 Cb -0.05 0.62 -0.04 0.00 -1.71 0.00 0.00 66.02 64.84 1tbg s SER 277 CO -0.06 -0.50 0.51 -0.36 1.20 0.00 0.00 173.24 174.03 1tbg s PHE 278 N -0.95 3.49 0.90 3.44 0.08 -1.26 -0.09 117.98 123.59 1tbg s PHE 278 Ca -0.10 0.38 -0.14 0.00 0.12 0.00 0.00 56.93 57.20 1tbg s PHE 278 Cb -0.02 -1.91 0.15 0.00 -0.57 0.00 0.00 43.02 40.67 1tbg s PHE 278 CO 0.07 0.20 1.25 -1.54 -0.10 0.00 0.00 175.22 175.11 1tbg s SER 279 N -3.68 3.66 0.23 1.36 1.04 -0.20 -4.80 113.70 111.32 1tbg s SER 279 Ca 0.40 0.52 -0.06 0.00 0.48 0.00 0.00 55.95 57.29 1tbg s SER 279 Cb -0.10 -0.77 0.34 0.00 0.10 0.00 0.00 66.02 65.59 1tbg s SER 279 CO 0.33 -2.41 1.82 0.50 0.98 0.00 0.00 173.24 174.46 1tbg h LYS 280 N -1.41 0.77 0.00 4.02 1.63 -1.91 -1.58 116.57 118.09 1tbg h LYS 280 Ca -0.45 -0.05 -0.08 0.00 -0.85 0.00 0.00 60.65 59.22 1tbg h LYS 280 Cb 1.28 -0.17 -0.01 0.00 -0.60 0.00 0.00 32.23 32.72 1tbg h LYS 280 CO 0.51 0.51 -0.50 0.66 -3.45 0.00 0.00 179.45 177.18 1tbg h SER 281 N 0.79 0.00 0.00 4.20 4.64 -1.95 -3.47 113.55 117.76 1tbg h SER 281 Ca 0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.69 1tbg h SER 281 Cb 0.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.37 1tbg h SER 281 CO -0.22 0.34 0.00 0.61 -0.87 0.00 0.00 176.83 176.69 1tbg n GLY 282 N 1.21 0.75 0.20 -0.77 0.00 -0.60 -4.94 105.19 101.04 1tbg n GLY 282 Ca 0.01 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.02 1tbg n GLY 282 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1tbg h ARG 283 N 3.76 0.22 -6.26 1.61 9.65 -1.91 -3.43 114.38 118.02 1tbg h ARG 283 Ca 0.00 -0.09 -0.69 0.00 -1.10 0.00 0.00 59.98 58.10 1tbg h ARG 283 Cb 0.00 -0.01 -0.24 0.00 -1.39 0.00 0.00 29.97 28.33 1tbg h ARG 283 CO 0.00 0.56 -0.77 -0.51 2.80 0.00 0.00 179.97 182.05 1tbg s LEU 284 N -8.33 2.71 -0.29 3.80 1.43 -1.26 -0.41 118.68 116.33 1tbg s LEU 284 Ca -0.04 -0.22 0.01 0.00 -1.03 0.00 0.00 54.13 52.85 1tbg s LEU 284 Cb 0.14 -1.55 0.06 0.00 0.03 0.00 0.00 46.19 44.87 1tbg s LEU 284 CO 0.76 0.33 -0.05 -0.22 0.23 0.00 0.00 176.35 177.41 1tbg s LEU 285 N -0.65 3.80 -0.01 1.79 2.96 0.37 -1.03 118.68 125.90 1tbg s LEU 285 Ca 0.10 -1.46 -0.15 0.00 -0.22 0.00 0.00 54.13 52.40 1tbg s LEU 285 Cb -0.11 -1.62 -0.06 0.00 0.50 0.00 0.00 46.19 44.91 1tbg s LEU 285 CO 0.01 -0.25 0.40 -0.76 -1.32 0.00 0.00 176.35 174.43 1tbg s LEU 286 N 1.13 4.46 -0.01 -0.68 1.02 0.87 -0.24 118.68 125.24 1tbg s LEU 286 Ca -0.05 0.93 0.01 0.00 0.02 0.00 0.00 54.13 55.04 1tbg s LEU 286 Cb -0.20 -2.57 0.00 0.00 0.02 0.00 0.00 46.19 43.45 1tbg s LEU 286 CO -0.04 0.31 -0.03 0.00 0.02 0.00 0.00 176.35 176.62 1tbg s ALA 287 N -0.99 0.27 -0.02 4.21 0.00 -0.68 -0.70 121.76 123.86 1tbg s ALA 287 Ca 0.23 -0.08 -0.15 0.00 0.00 0.00 0.00 51.96 51.97 1tbg s ALA 287 Cb -0.16 -0.12 -0.05 0.00 0.00 0.00 0.00 23.12 22.79 1tbg s ALA 287 CO 0.13 0.04 0.39 0.20 0.00 0.00 0.00 175.76 176.52 1tbg s GLY 288 N 0.14 2.45 0.23 0.00 0.00 0.80 -1.65 107.32 109.28 1tbg s GLY 288 Ca -0.01 -0.25 0.12 0.00 0.00 0.00 0.00 44.72 44.58 1tbg s GLY 288 CO -0.00 0.17 -0.22 -0.19 0.00 0.00 0.00 173.10 172.86 1tbg s TYR 289 N -0.90 2.27 0.48 1.90 1.51 0.63 -0.86 117.35 122.38 1tbg s TYR 289 Ca 0.23 -0.35 0.32 0.00 -1.01 0.00 0.00 57.07 56.26 1tbg s TYR 289 Cb -0.16 -1.07 1.74 0.00 -0.11 0.00 0.00 41.96 42.36 1tbg s TYR 289 CO 0.12 0.58 2.17 -0.44 -1.11 0.00 0.00 175.55 176.88 1tbg h ASP 290 N 2.81 0.00 0.00 2.29 3.32 -1.64 -2.68 116.42 120.51 1tbg h ASP 290 Ca -0.43 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.62 1tbg h ASP 290 Cb 1.23 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.78 1tbg h ASP 290 CO 0.53 0.06 0.00 -0.90 -1.72 0.00 0.00 179.24 177.21 1tbg n ASP 291 N -3.52 0.48 0.00 6.45 5.75 -1.26 -4.16 116.55 120.29 1tbg n ASP 291 Ca -0.02 -1.25 0.00 0.00 -0.01 0.00 0.00 54.79 53.51 1tbg n ASP 291 Cb 0.17 -0.24 0.00 0.00 -1.03 0.00 0.00 41.12 40.02 1tbg n ASP 291 CO 0.00 0.00 0.00 0.49 -0.11 0.00 0.00 177.20 177.58 1tbg n PHE 292 N 0.03 0.00 -4.26 2.11 3.72 -1.03 -4.94 117.46 113.09 1tbg n PHE 292 Ca 0.00 0.00 -0.23 0.00 -0.05 0.00 0.00 57.45 57.17 1tbg n PHE 292 Cb 0.12 -0.22 -0.07 0.00 -0.94 0.00 0.00 39.48 38.38 1tbg n PHE 292 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 1tbg s ASN 293 N -3.21 4.69 -0.10 4.37 0.01 -1.24 -3.98 114.94 115.47 1tbg s ASN 293 Ca 0.00 -0.57 0.03 0.00 -0.71 0.00 0.00 52.86 51.61 1tbg s ASN 293 Cb 0.00 -0.93 0.01 0.00 0.41 0.00 0.00 41.25 40.74 1tbg s ASN 293 CO 0.00 0.01 -0.19 0.00 -1.51 0.00 0.00 177.10 175.41 1tbg s ASN 295 N 0.66 5.48 -0.24 0.00 -0.87 -0.66 0.93 114.94 120.24 1tbg s ASN 295 Ca -0.13 0.21 -0.06 0.00 -1.57 0.00 0.00 52.86 51.31 1tbg s ASN 295 Cb -0.16 -1.61 -0.02 0.00 -0.02 0.00 0.00 41.25 39.44 1tbg s ASN 295 CO 0.03 0.38 0.03 0.68 -2.57 0.00 0.00 177.10 175.66 1tbg s VAL 296 N -0.90 3.97 0.01 1.60 -7.23 0.34 -1.68 120.40 116.51 1tbg s VAL 296 Ca 0.13 -0.29 -0.04 0.00 -1.81 0.00 0.00 61.98 59.98 1tbg s VAL 296 Cb -0.11 -2.84 -0.04 0.00 0.56 0.00 0.00 36.38 33.94 1tbg s VAL 296 CO 0.03 0.37 0.22 0.26 -0.31 0.00 0.00 175.10 175.67 1tbg s TRP 297 N 1.56 3.55 -0.58 2.82 0.52 0.67 -0.80 118.94 126.68 1tbg s TRP 297 Ca 0.06 0.43 -0.25 0.00 0.02 0.00 0.00 56.10 56.36 1tbg s TRP 297 Cb -0.15 -1.89 0.04 0.00 -1.15 0.00 0.00 33.47 30.33 1tbg s TRP 297 CO 0.01 0.62 1.01 0.34 0.02 0.00 0.00 176.95 178.95 1tbg s ASP 298 N -1.93 6.33 0.32 2.95 -1.08 0.10 -0.48 116.67 122.88 1tbg s ASP 298 Ca 0.29 -0.34 0.04 0.00 -0.52 0.00 0.00 52.55 52.02 1tbg s ASP 298 Cb -0.13 -2.46 0.66 0.00 -1.46 0.00 0.00 42.92 39.53 1tbg s ASP 298 CO 0.19 -1.34 1.89 0.00 0.52 0.00 0.00 175.17 176.43 1tbg h ALA 299 N 9.43 1.64 0.05 3.66 0.00 -1.01 0.29 119.26 133.33 1tbg h ALA 299 Ca -0.26 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.64 1tbg h ALA 299 Cb 1.07 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1tbg h ALA 299 CO 1.13 0.16 -0.02 -0.07 0.00 0.00 0.00 179.25 180.45 1tbg h LEU 300 N 0.88 -0.06 -1.21 0.00 3.38 -1.88 -3.34 115.31 113.08 1tbg h LEU 300 Ca 0.42 -0.53 0.00 0.00 0.09 0.00 0.00 57.88 57.86 1tbg h LEU 300 Cb 0.44 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.21 1tbg h LEU 300 CO -0.19 0.53 0.00 0.29 0.09 0.00 0.00 178.44 179.17 1tbg n LYS 301 N -4.84 1.83 -1.78 1.13 5.02 -1.18 -3.92 118.16 114.43 1tbg n LYS 301 Ca -0.09 -1.21 -0.19 0.00 -2.02 0.00 0.00 58.31 54.80 1tbg n LYS 301 Cb 0.29 -1.47 -0.06 0.00 -0.02 0.00 0.00 35.03 33.77 1tbg n LYS 301 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1tbg n ALA 302 N 0.47 -0.39 -2.51 7.82 0.00 0.10 -4.90 120.51 121.10 1tbg n ALA 302 Ca 0.18 0.27 -0.28 0.00 0.00 0.00 0.00 53.44 53.61 1tbg n ALA 302 Cb 0.41 -1.96 -0.03 0.00 0.00 0.00 0.00 19.45 17.87 1tbg n ALA 302 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1tbg s ASP 303 N -2.49 6.44 -0.88 0.00 1.01 -1.21 -4.85 116.67 114.68 1tbg s ASP 303 Ca 0.00 0.71 -0.18 0.00 0.71 0.00 0.00 52.55 53.80 1tbg s ASP 303 Cb 0.00 -2.14 0.15 0.00 1.01 0.00 0.00 42.92 41.93 1tbg s ASP 303 CO 0.00 -0.21 1.02 -0.60 0.21 0.00 0.00 175.17 175.59 1tbg s ARG 304 N -3.61 3.56 0.51 8.23 3.52 -1.26 0.00 118.95 129.90 1tbg s ARG 304 Ca 0.44 -1.87 0.23 0.00 -0.13 0.00 0.00 55.73 54.40 1tbg s ARG 304 Cb -0.11 -4.76 1.38 0.00 -1.56 0.00 0.00 34.95 29.90 1tbg s ARG 304 CO 0.30 -1.66 2.10 0.00 -0.81 0.00 0.00 175.30 175.24 1tbg h ALA 305 N 8.64 1.55 -2.07 6.12 0.00 -1.25 -3.48 119.26 128.77 1tbg h ALA 305 Ca 0.11 -0.09 0.09 0.00 0.00 0.00 0.00 54.91 55.02 1tbg h ALA 305 Cb 1.03 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 1tbg h ALA 305 CO 1.03 0.13 0.31 0.41 0.00 0.00 0.00 179.25 181.12 1tbg n GLY 306 N -1.03 0.93 3.53 0.00 0.00 -0.72 -0.31 105.19 107.59 1tbg n GLY 306 Ca -0.02 -1.04 -0.04 0.00 0.00 0.00 0.00 46.02 44.92 1tbg n GLY 306 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tbg s VAL 307 N -2.30 -0.71 -0.77 1.61 0.11 -1.26 -0.50 120.40 116.58 1tbg s VAL 307 Ca 0.12 0.05 -0.22 0.00 -2.93 0.00 0.00 61.98 59.00 1tbg s VAL 307 Cb -0.01 -0.89 0.08 0.00 -1.53 0.00 0.00 36.38 34.03 1tbg s VAL 307 CO 0.03 0.02 1.07 -0.76 -3.33 0.00 0.00 175.10 172.13 1tbg s LEU 308 N 2.57 4.38 -0.06 2.54 1.43 0.26 -4.93 118.68 124.88 1tbg s LEU 308 Ca -0.06 -1.26 -0.10 0.00 -1.03 0.00 0.00 54.13 51.68 1tbg s LEU 308 Cb -0.11 -2.44 -0.05 0.00 0.03 0.00 0.00 46.19 43.63 1tbg s LEU 308 CO -0.17 -1.38 0.26 0.00 0.23 0.00 0.00 176.35 175.29 1tbg s ALA 309 N 3.92 3.80 0.00 4.21 0.00 -1.26 -2.63 121.76 129.80 1tbg s ALA 309 Ca 0.28 -0.46 0.00 0.00 0.00 0.00 0.00 51.96 51.78 1tbg s ALA 309 Cb -0.12 -2.15 0.00 0.00 0.00 0.00 0.00 23.12 20.86 1tbg s ALA 309 CO 0.04 0.57 0.00 0.41 0.00 0.00 0.00 175.76 176.77 1tbg n GLY 310 N 1.82 0.00 3.68 0.00 0.00 -1.26 -5.01 105.19 104.41 1tbg n GLY 310 Ca -0.17 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.49 1tbg n GLY 310 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1tbg s HIS 311 N 0.00 3.35 -0.65 1.61 3.76 -1.26 -4.96 115.29 117.13 1tbg s HIS 311 Ca 0.00 0.27 0.14 0.00 -0.15 0.00 0.00 55.06 55.32 1tbg s HIS 311 Cb 0.00 -2.25 0.66 0.00 1.11 0.00 0.00 32.58 32.10 1tbg s HIS 311 CO 0.00 0.13 1.42 -0.25 -0.85 0.00 0.00 174.74 175.19 1tbg n ASP 312 N 4.07 0.30 -3.71 1.40 8.00 -1.26 -4.77 116.55 120.58 1tbg n ASP 312 Ca -0.15 0.61 -0.12 0.00 0.71 0.00 0.00 54.79 55.84 1tbg n ASP 312 Cb 0.52 -0.66 -0.06 0.00 -0.02 0.00 0.00 41.12 40.90 1tbg n ASP 312 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 1tbg s ASN 313 N -3.55 0.43 0.10 -2.24 3.84 -1.26 -4.91 114.94 107.34 1tbg s ASN 313 Ca 0.01 -1.28 -0.32 0.00 0.21 0.00 0.00 52.86 51.48 1tbg s ASN 313 Cb 0.05 0.57 -0.17 0.00 -0.55 0.00 0.00 41.25 41.15 1tbg s ASN 313 CO 0.18 -1.14 0.75 -1.14 -2.79 0.00 0.00 177.10 172.96 1tbg n ARG 314 N -0.44 0.00 -2.87 0.43 0.63 -1.26 -4.35 116.66 108.79 1tbg n ARG 314 Ca 0.00 0.00 -0.42 0.00 -0.92 0.00 0.00 57.85 56.52 1tbg n ARG 314 Cb 0.63 -1.18 -0.04 0.00 0.45 0.00 0.00 32.46 32.31 1tbg n ARG 314 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 1tbg s VAL 315 N -0.48 4.80 -0.06 5.15 1.01 -1.11 -0.59 120.40 129.12 1tbg s VAL 315 Ca 0.73 1.53 0.20 0.00 0.00 0.00 0.00 61.98 64.44 1tbg s VAL 315 Cb -1.04 -4.15 -0.30 0.00 0.00 0.00 0.00 36.38 30.89 1tbg s VAL 315 CO 0.53 -0.14 0.37 -1.54 0.00 0.00 0.00 175.10 174.33 1tbg n SER 316 N 6.11 0.34 -3.74 3.32 3.41 0.52 -4.35 113.62 119.23 1tbg n SER 316 Ca 0.06 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.57 1tbg n SER 316 Cb 0.47 1.73 -0.05 0.00 -0.26 0.00 0.00 64.21 66.11 1tbg n SER 316 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1tbg s LEU 318 N -2.86 -0.43 0.03 0.00 0.05 -1.26 -0.48 118.68 113.73 1tbg s LEU 318 Ca 0.08 0.79 -0.02 0.00 0.05 0.00 0.00 54.13 55.03 1tbg s LEU 318 Cb 0.01 1.86 -0.02 0.00 -2.05 0.00 0.00 46.19 45.98 1tbg s LEU 318 CO -0.06 -0.17 0.01 -0.83 -0.55 0.00 0.00 176.35 174.75 1tbg s GLY 319 N 0.07 0.26 -0.13 -3.48 0.00 -0.36 -4.75 107.32 98.93 1tbg s GLY 319 Ca 0.03 -0.68 0.01 0.00 0.00 0.00 0.00 44.72 44.08 1tbg s GLY 319 CO -0.06 -0.77 -0.16 0.14 0.00 0.00 0.00 173.10 172.25 1tbg s VAL 320 N -2.24 2.79 0.82 1.40 1.01 -1.26 -0.76 120.40 122.16 1tbg s VAL 320 Ca -0.09 -0.75 -0.14 0.00 0.00 0.00 0.00 61.98 61.00 1tbg s VAL 320 Cb -0.04 -2.15 0.02 0.00 0.00 0.00 0.00 36.38 34.21 1tbg s VAL 320 CO -0.03 0.53 0.68 0.35 0.00 0.00 0.00 175.10 176.62 1tbg n THR 321 N 3.61 1.30 0.28 3.92 -2.24 -0.35 -4.89 114.28 115.92 1tbg n THR 321 Ca -0.18 -0.28 0.16 0.00 -2.27 0.00 0.00 64.05 61.47 1tbg n THR 321 Cb 0.53 -0.83 0.75 0.00 -2.10 0.00 0.00 70.33 68.68 1tbg n THR 321 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1tbg h ASP 322 N -0.89 0.00 -0.67 3.42 5.19 -1.86 -1.81 116.42 119.79 1tbg h ASP 322 Ca -0.45 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.96 1tbg h ASP 322 Cb 1.31 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.82 1tbg h ASP 322 CO 0.41 0.07 0.00 -0.90 -3.12 0.00 0.00 179.24 175.70 1tbg n ASP 323 N -3.29 4.01 -0.33 6.45 5.68 -1.26 -4.93 116.55 122.88 1tbg n ASP 323 Ca -0.01 -2.14 -0.04 0.00 -0.50 0.00 0.00 54.79 52.11 1tbg n ASP 323 Cb 0.27 -0.50 -0.02 0.00 -1.14 0.00 0.00 41.12 39.73 1tbg n ASP 323 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1tbg n GLY 324 N 1.45 0.34 0.22 6.12 0.00 -0.68 -4.81 105.19 107.83 1tbg n GLY 324 Ca 0.24 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.14 1tbg n GLY 324 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1tbg h MET 325 N 0.00 0.74 -4.08 1.61 2.86 -1.92 -3.45 114.93 110.70 1tbg h MET 325 Ca -0.07 -0.33 -0.14 0.00 -2.06 0.00 0.00 59.70 57.10 1tbg h MET 325 Cb 0.83 -0.02 -0.12 0.00 0.06 0.00 0.00 31.60 32.35 1tbg h MET 325 CO 0.11 0.94 -0.36 0.00 1.06 0.00 0.00 176.91 178.66 1tbg s ALA 326 N -4.59 0.38 0.03 6.32 0.00 -1.26 -4.77 121.76 117.86 1tbg s ALA 326 Ca -0.12 -1.22 0.07 0.00 0.00 0.00 0.00 51.96 50.68 1tbg s ALA 326 Cb 0.10 1.16 -0.02 0.00 0.00 0.00 0.00 23.12 24.36 1tbg s ALA 326 CO 0.82 -0.71 -0.19 0.54 0.00 0.00 0.00 175.76 176.22 1tbg s VAL 327 N -4.07 1.55 0.04 0.00 0.11 -0.96 -1.21 120.40 115.86 1tbg s VAL 327 Ca 0.28 -1.06 0.09 0.00 -2.93 0.00 0.00 61.98 58.36 1tbg s VAL 327 Cb 0.03 -1.34 -0.03 0.00 -1.53 0.00 0.00 36.38 33.52 1tbg s VAL 327 CO 0.09 0.24 -0.25 0.00 -3.33 0.00 0.00 175.10 171.86 1tbg s ALA 328 N -0.70 2.09 -0.07 1.54 0.00 0.06 -0.74 121.76 123.94 1tbg s ALA 328 Ca 0.07 -1.19 0.04 0.00 0.00 0.00 0.00 51.96 50.87 1tbg s ALA 328 Cb -0.08 -0.44 0.00 0.00 0.00 0.00 0.00 23.12 22.60 1tbg s ALA 328 CO 0.01 0.49 -0.18 0.95 0.00 0.00 0.00 175.76 177.03 1tbg s THR 329 N -0.79 1.56 -0.08 0.00 -4.23 -0.51 -1.22 115.64 110.36 1tbg s THR 329 Ca 0.10 -0.76 -0.01 0.00 -1.18 0.00 0.00 61.69 59.85 1tbg s THR 329 Cb -0.10 -1.36 -0.03 0.00 1.34 0.00 0.00 72.50 72.35 1tbg s THR 329 CO 0.02 0.45 -0.04 -0.83 -0.54 0.00 0.00 174.62 173.68 1tbg s GLY 330 N 0.29 1.76 0.06 3.99 0.00 0.37 -2.15 107.32 111.65 1tbg s GLY 330 Ca -0.11 -0.85 -0.01 0.00 0.00 0.00 0.00 44.72 43.75 1tbg s GLY 330 CO 0.05 -0.57 -0.02 -0.45 0.00 0.00 0.00 173.10 172.10 1tbg s SER 331 N -0.72 0.54 0.11 1.64 0.15 -1.20 -0.35 113.70 113.87 1tbg s SER 331 Ca 0.11 -1.02 0.11 0.00 0.70 0.00 0.00 55.95 55.84 1tbg s SER 331 Cb -0.11 0.20 0.52 0.00 -1.71 0.00 0.00 66.02 64.92 1tbg s SER 331 CO 0.02 -0.60 1.33 0.79 1.20 0.00 0.00 173.24 175.98 1tbg n TRP 332 N 0.07 0.28 1.84 3.44 7.02 0.24 -1.39 117.44 128.94 1tbg n TRP 332 Ca -0.13 0.13 0.08 0.00 -1.02 0.00 0.00 57.50 56.56 1tbg n TRP 332 Cb 0.61 -0.71 0.48 0.00 -2.42 0.00 0.00 31.31 29.27 1tbg n TRP 332 CO 0.00 0.00 0.00 -0.40 -2.02 0.00 0.00 177.69 175.27 1tbg n ASP 333 N -1.77 0.00 0.00 -0.99 5.75 -1.26 -4.03 116.55 114.24 1tbg n ASP 333 Ca 0.01 -1.34 0.00 0.00 -0.01 0.00 0.00 54.79 53.44 1tbg n ASP 333 Cb 0.07 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.16 1tbg n ASP 333 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 1tbg n SER 334 N -0.77 0.00 -4.77 -1.12 7.64 -0.49 -4.94 113.62 109.17 1tbg n SER 334 Ca 0.12 0.00 -0.26 0.00 1.01 0.00 0.00 58.87 59.74 1tbg n SER 334 Cb 0.06 -0.72 -0.06 0.00 -1.01 0.00 0.00 64.21 62.48 1tbg n SER 334 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 1tbg s PHE 335 N -2.72 3.07 0.05 1.43 0.08 -1.26 -4.29 117.98 114.34 1tbg s PHE 335 Ca 0.00 -0.06 0.08 0.00 0.12 0.00 0.00 56.93 57.07 1tbg s PHE 335 Cb 0.00 -1.46 -0.03 0.00 -0.57 0.00 0.00 43.02 40.96 1tbg s PHE 335 CO 0.00 0.52 -0.22 -0.51 -0.10 0.00 0.00 175.22 174.91 1tbg s LEU 336 N -3.17 2.43 -0.03 -0.37 1.43 -1.02 -3.23 118.68 114.72 1tbg s LEU 336 Ca 0.30 -0.52 0.01 0.00 -1.03 0.00 0.00 54.13 52.89 1tbg s LEU 336 Cb -0.10 -1.41 0.02 0.00 0.03 0.00 0.00 46.19 44.74 1tbg s LEU 336 CO 0.22 0.25 -0.01 -0.54 0.23 0.00 0.00 176.35 176.50 1tbg s LYS 337 N -1.45 0.34 -0.04 1.70 1.02 -0.91 -0.34 119.74 120.06 1tbg s LYS 337 Ca 0.14 0.04 -0.09 0.00 0.02 0.00 0.00 55.97 56.08 1tbg s LYS 337 Cb -0.10 -0.48 -0.05 0.00 -0.52 0.00 0.00 37.83 36.68 1tbg s LYS 337 CO 0.04 -0.11 0.27 0.42 -0.92 0.00 0.00 175.35 175.06 1tbg s ILE 338 N 0.89 5.28 -0.06 2.17 -1.09 0.10 -1.43 121.20 127.08 1tbg s ILE 338 Ca -0.09 0.39 0.03 0.00 -2.23 0.00 0.00 60.65 58.75 1tbg s ILE 338 Cb -0.13 -3.55 0.01 0.00 -1.58 0.00 0.00 42.46 37.21 1tbg s ILE 338 CO -0.01 0.51 -0.13 0.26 -1.23 0.00 0.00 174.94 174.34 1tbg s TRP 339 N -1.14 1.47 0.00 3.97 0.52 0.08 -0.08 118.94 123.75 1tbg s TRP 339 Ca 0.22 -0.51 0.00 0.00 0.02 0.00 0.00 56.10 55.83 1tbg s TRP 339 Cb -0.14 -1.06 0.00 0.00 -1.15 0.00 0.00 33.47 31.13 1tbg s TRP 339 CO 0.11 -0.25 0.00 -1.71 0.02 0.00 0.00 176.95 175.13