#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3tim s LYS 3 N 0.00 1.65 0.60 4.33 1.02 -1.26 -5.13 119.74 120.95 3tim s LYS 3 Ca 0.00 -1.22 -0.10 0.00 0.02 0.00 0.00 55.97 54.67 3tim s LYS 3 Cb 0.00 -2.00 0.15 0.00 -0.52 0.00 0.00 37.83 35.46 3tim s LYS 3 CO 0.00 0.48 0.65 -0.35 -0.92 0.00 0.00 175.35 175.21 3tim n PRO 4 N 1.13 -1.49 -1.95 -1.68 -0.04 -1.26 -4.94 135.00 124.76 3tim n PRO 4 Ca -0.17 -1.02 -0.42 0.00 -0.04 0.00 0.00 63.50 61.85 3tim n PRO 4 Cb 0.53 -0.82 -0.03 0.00 -0.04 0.00 0.00 33.50 33.14 3tim n PRO 4 CO 0.00 0.00 0.00 -1.14 -0.04 0.00 0.00 175.50 174.32 3tim s GLN 5 N -4.45 4.21 0.91 0.54 0.74 -1.26 -4.97 119.66 115.38 3tim s GLN 5 Ca 0.40 2.31 -0.12 0.00 0.05 0.00 0.00 55.36 57.99 3tim s GLN 5 Cb -0.03 -3.53 0.14 0.00 1.10 0.00 0.00 33.01 30.69 3tim s GLN 5 CO 0.29 -0.70 1.13 -1.25 -0.55 0.00 0.00 175.29 174.21 3tim s PRO 6 N 2.40 1.15 -0.06 1.67 0.04 -1.26 -4.89 135.00 134.06 3tim s PRO 6 Ca 0.73 0.35 -0.01 0.00 0.04 0.00 0.00 61.00 62.10 3tim s PRO 6 Cb -0.40 -1.84 0.03 0.00 0.04 0.00 0.00 34.50 32.33 3tim s PRO 6 CO 0.32 -2.20 0.00 0.42 0.04 0.00 0.00 177.00 175.58 3tim s ILE 7 N -3.23 0.34 -0.32 0.56 1.01 -0.93 -1.73 121.20 116.90 3tim s ILE 7 Ca 0.64 0.11 -0.05 0.00 0.00 0.00 0.00 60.65 61.35 3tim s ILE 7 Cb -0.15 -0.48 0.04 0.00 0.01 0.00 0.00 42.46 41.88 3tim s ILE 7 CO 0.54 0.24 0.06 0.00 0.00 0.00 0.00 174.94 175.78 3tim s ALA 8 N 1.77 2.96 -0.04 9.38 0.00 -1.08 -1.20 121.76 133.55 3tim s ALA 8 Ca 0.02 -1.71 0.06 0.00 0.00 0.00 0.00 51.96 50.33 3tim s ALA 8 Cb -0.13 -2.14 -0.01 0.00 0.00 0.00 0.00 23.12 20.84 3tim s ALA 8 CO -0.04 -1.26 -0.24 0.00 0.00 0.00 0.00 175.76 174.22 3tim s ALA 9 N 1.36 2.02 -0.37 0.00 0.00 0.17 -1.94 121.76 123.01 3tim s ALA 9 Ca -0.02 -1.00 -0.09 0.00 0.00 0.00 0.00 51.96 50.84 3tim s ALA 9 Cb -0.19 -0.58 0.04 0.00 0.00 0.00 0.00 23.12 22.38 3tim s ALA 9 CO 0.01 0.43 0.18 0.00 0.00 0.00 0.00 175.76 176.38 3tim s ALA 10 N -0.31 3.19 -0.54 0.00 0.00 0.77 -1.06 121.76 123.80 3tim s ALA 10 Ca 0.02 -1.81 -0.16 0.00 0.00 0.00 0.00 51.96 50.01 3tim s ALA 10 Cb -0.12 -2.48 0.12 0.00 0.00 0.00 0.00 23.12 20.65 3tim s ALA 10 CO 0.02 -1.42 0.52 1.21 0.00 0.00 0.00 175.76 176.09 3tim s ASN 11 N 1.58 6.19 0.00 0.00 2.47 -0.76 -0.04 114.94 124.39 3tim s ASN 11 Ca 0.01 -1.73 0.28 0.00 0.42 0.00 0.00 52.86 51.84 3tim s ASN 11 Cb -0.20 -2.22 1.56 0.00 -1.45 0.00 0.00 41.25 38.94 3tim s ASN 11 CO 0.04 -0.88 2.01 0.79 -3.72 0.00 0.00 177.10 175.34 3tim n TRP 12 N 5.36 0.00 -2.27 0.43 8.01 -0.58 -4.43 117.44 123.97 3tim n TRP 12 Ca -0.13 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.06 3tim n TRP 12 Cb 0.40 -0.14 0.00 0.00 -2.01 0.00 0.00 31.31 29.56 3tim n TRP 12 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.69 178.31 3tim n LYS 13 N -1.14 0.00 -3.33 -0.99 5.02 -1.26 -3.51 118.16 112.94 3tim n LYS 13 Ca 0.17 0.00 -0.44 0.00 -2.02 0.00 0.00 58.31 56.02 3tim n LYS 13 Cb 0.16 0.00 -0.00 0.00 -0.02 0.00 0.00 35.03 35.17 3tim n LYS 13 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3tim s ASN 15 N 0.92 -0.44 0.00 0.00 0.01 -1.23 -5.15 114.94 109.04 3tim s ASN 15 Ca 0.31 -0.17 0.00 0.00 -0.71 0.00 0.00 52.86 52.29 3tim s ASN 15 Cb -0.08 0.58 0.00 0.00 0.41 0.00 0.00 41.25 42.16 3tim s ASN 15 CO -0.07 -0.98 0.00 0.61 -1.51 0.00 0.00 177.10 175.15 3tim n GLY 16 N -0.35 2.78 3.29 0.66 0.00 -1.26 -4.81 105.19 105.51 3tim n GLY 16 Ca -0.15 -1.93 -0.16 0.00 0.00 0.00 0.00 46.02 43.78 3tim n GLY 16 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3tim s SER 17 N 0.00 1.50 0.21 1.61 1.04 -1.26 -5.02 113.70 111.77 3tim s SER 17 Ca 0.00 -1.23 -0.09 0.00 0.48 0.00 0.00 55.95 55.11 3tim s SER 17 Cb 0.00 0.07 0.27 0.00 0.10 0.00 0.00 66.02 66.47 3tim s SER 17 CO 0.00 -0.57 1.75 1.56 0.98 0.00 0.00 173.24 176.97 3tim h GLN 18 N 2.54 0.44 0.00 4.02 4.20 -1.99 -1.53 115.11 122.79 3tim h GLN 18 Ca -0.38 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.31 3tim h GLN 18 Cb 1.22 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.90 3tim h GLN 18 CO 0.63 0.29 0.00 1.04 -0.67 0.00 0.00 178.83 180.12 3tim n GLN 19 N -4.96 0.00 -0.34 1.46 3.00 -1.26 -1.48 117.38 113.81 3tim n GLN 19 Ca 0.09 0.34 0.19 0.00 -0.01 0.00 0.00 57.00 57.61 3tim n GLN 19 Cb 0.26 -1.22 0.40 0.00 0.00 0.00 0.00 30.24 29.68 3tim n GLN 19 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 3tim h SER 20 N 0.00 0.57 -0.41 1.08 4.64 -1.97 0.50 113.55 117.97 3tim h SER 20 Ca 0.00 0.16 -0.05 0.00 -0.47 0.00 0.00 61.79 61.43 3tim h SER 20 Cb 0.00 0.08 -0.02 0.00 -0.31 0.00 0.00 62.40 62.15 3tim h SER 20 CO 0.00 0.02 0.07 -0.07 -0.87 0.00 0.00 176.83 175.98 3tim h LEU 21 N 0.48 0.64 0.07 5.97 3.38 -1.25 -1.67 115.31 122.93 3tim h LEU 21 Ca 0.66 -0.26 0.01 0.00 0.09 0.00 0.00 57.88 58.39 3tim h LEU 21 Cb 1.33 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 41.87 3tim h LEU 21 CO -0.52 0.73 -0.48 0.28 0.09 0.00 0.00 178.44 178.53 3tim h SER 22 N 0.52 -1.47 -0.03 -0.43 0.02 0.17 0.72 113.55 113.05 3tim h SER 22 Ca 0.12 0.16 0.03 0.00 -0.84 0.00 0.00 61.79 61.26 3tim h SER 22 Cb 0.36 0.55 -0.06 0.00 0.14 0.00 0.00 62.40 63.39 3tim h SER 22 CO 0.01 -0.50 -0.50 -0.33 -1.14 0.00 0.00 176.83 174.37 3tim h GLU 23 N -0.66 -0.60 -0.21 3.45 5.08 -1.06 0.26 114.58 120.85 3tim h GLU 23 Ca -0.00 0.04 0.03 0.00 -1.00 0.00 0.00 59.36 58.43 3tim h GLU 23 Cb 0.68 0.14 -0.05 0.00 0.50 0.00 0.00 28.75 30.01 3tim h GLU 23 CO -0.28 -0.40 -0.38 -0.07 -1.00 0.00 0.00 179.01 176.88 3tim h LEU 24 N -0.62 -1.24 -0.79 1.33 3.38 -1.19 -0.91 115.31 115.28 3tim h LEU 24 Ca 0.03 0.16 0.18 0.00 0.09 0.00 0.00 57.88 58.34 3tim h LEU 24 Cb 0.69 0.50 -0.14 0.00 0.09 0.00 0.00 40.66 41.80 3tim h LEU 24 CO -0.37 -0.30 -0.06 0.40 0.09 0.00 0.00 178.44 178.20 3tim h ILE 25 N -0.32 0.26 -0.35 1.22 2.04 -0.65 0.19 117.51 119.90 3tim h ILE 25 Ca 0.04 -0.02 0.07 0.00 1.00 0.00 0.00 64.86 65.95 3tim h ILE 25 Cb 0.43 0.20 -0.07 0.00 -0.74 0.00 0.00 36.82 36.64 3tim h ILE 25 CO -0.36 0.01 -0.14 0.44 0.00 0.00 0.00 178.15 178.10 3tim h ASP 26 N 0.06 -0.48 -0.24 1.72 3.45 0.34 0.94 116.42 122.20 3tim h ASP 26 Ca 0.42 0.12 0.04 0.00 0.43 0.00 0.00 57.03 58.05 3tim h ASP 26 Cb 0.73 0.28 -0.04 0.00 -0.56 0.00 0.00 39.33 39.74 3tim h ASP 26 CO -0.74 -0.17 -0.00 0.25 -1.57 0.00 0.00 179.24 177.00 3tim h LEU 27 N -0.07 -0.10 -0.44 1.55 5.85 -0.41 -1.69 115.31 120.01 3tim h LEU 27 Ca 0.18 0.05 0.04 0.00 0.84 0.00 0.00 57.88 58.99 3tim h LEU 27 Cb 0.34 0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.43 3tim h LEU 27 CO -0.40 -0.02 0.20 -0.26 -0.34 0.00 0.00 178.44 177.62 3tim h PHE 28 N 0.07 0.37 -0.62 1.25 0.04 0.19 -1.71 116.94 116.53 3tim h PHE 28 Ca 0.11 0.02 0.17 0.00 2.80 0.00 0.00 57.97 61.08 3tim h PHE 28 Cb 0.15 -0.10 -0.03 0.00 2.20 0.00 0.00 35.95 38.17 3tim h PHE 28 CO -0.20 0.17 0.44 -0.91 -0.60 0.00 0.00 178.31 177.22 3tim h ASN 29 N 0.40 0.05 -0.53 2.17 2.35 0.15 -2.27 115.58 117.89 3tim h ASN 29 Ca 0.19 0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 55.82 3tim h ASN 29 Cb 0.13 -0.01 -0.07 0.00 0.05 0.00 0.00 38.32 38.42 3tim h ASN 29 CO -0.15 0.02 0.12 -1.20 -1.65 0.00 0.00 177.43 174.57 3tim n SER 30 N -4.37 4.37 -4.39 5.81 7.64 -0.66 -4.72 113.62 117.30 3tim n SER 30 Ca 0.12 -3.21 -0.36 0.00 1.01 0.00 0.00 58.87 56.43 3tim n SER 30 Cb 0.66 -0.67 -0.13 0.00 -1.01 0.00 0.00 64.21 63.06 3tim n SER 30 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 3tim s THR 31 N -2.96 4.04 -0.79 0.44 2.01 -0.86 -5.02 115.64 112.50 3tim s THR 31 Ca 0.50 -0.40 -0.26 0.00 0.31 0.00 0.00 61.69 61.84 3tim s THR 31 Cb 0.41 -2.94 0.03 0.00 0.01 0.00 0.00 72.50 70.00 3tim s THR 31 CO 0.11 0.27 1.35 -0.94 -0.69 0.00 0.00 174.62 174.71 3tim s SER 32 N 1.56 6.17 -0.37 3.53 1.04 -1.26 -4.95 113.70 119.41 3tim s SER 32 Ca 0.05 -0.60 -0.22 0.00 0.48 0.00 0.00 55.95 55.66 3tim s SER 32 Cb -0.16 -2.56 0.01 0.00 0.10 0.00 0.00 66.02 63.41 3tim s SER 32 CO 0.02 -1.82 0.74 -0.63 0.98 0.00 0.00 173.24 172.53 3tim s ILE 33 N 5.81 4.78 -2.24 -1.02 1.01 -1.26 -4.91 121.20 123.36 3tim s ILE 33 Ca 0.39 0.76 0.23 0.00 0.00 0.00 0.00 60.65 62.03 3tim s ILE 33 Cb -0.07 -4.18 0.08 0.00 0.01 0.00 0.00 42.46 38.30 3tim s ILE 33 CO 0.11 -0.42 1.19 0.59 0.00 0.00 0.00 174.94 176.40 3tim n ASN 34 N 6.32 2.15 -4.86 3.58 4.13 -1.26 -4.97 115.26 120.35 3tim n ASN 34 Ca 0.02 -1.57 -0.21 0.00 1.68 0.00 0.00 54.58 54.50 3tim n ASN 34 Cb 0.48 0.33 -0.03 0.00 -1.54 0.00 0.00 39.78 39.02 3tim n ASN 34 CO 0.00 0.00 0.00 -1.38 0.28 0.00 0.00 177.26 176.16 3tim s HIS 35 N -2.36 2.81 -0.56 3.10 -3.43 -1.26 -5.06 115.29 108.52 3tim s HIS 35 Ca 0.22 -0.39 -0.28 0.00 -0.80 0.00 0.00 55.06 53.81 3tim s HIS 35 Cb 0.19 -1.98 0.03 0.00 -1.43 0.00 0.00 32.58 29.39 3tim s HIS 35 CO 0.50 0.04 1.14 0.34 -2.00 0.00 0.00 174.74 174.76 3tim s ASP 36 N -4.06 6.45 0.01 7.38 -1.08 -1.26 -4.94 116.67 119.17 3tim s ASP 36 Ca 0.44 0.07 -0.16 0.00 -0.52 0.00 0.00 52.55 52.38 3tim s ASP 36 Cb -0.05 -2.53 0.03 0.00 -1.46 0.00 0.00 42.92 38.91 3tim s ASP 36 CO 0.27 -1.41 0.35 0.54 0.52 0.00 0.00 175.17 175.43 3tim s VAL 37 N 4.73 0.06 -0.33 1.11 0.11 -1.26 -4.30 120.40 120.52 3tim s VAL 37 Ca 0.41 -0.51 -0.06 0.00 -2.93 0.00 0.00 61.98 58.89 3tim s VAL 37 Cb -0.08 -0.79 0.03 0.00 -1.53 0.00 0.00 36.38 34.01 3tim s VAL 37 CO 0.25 -0.28 0.09 -1.58 -3.33 0.00 0.00 175.10 170.25 3tim s GLN 38 N -1.88 2.70 -0.07 1.54 2.00 -0.71 -4.93 119.66 118.32 3tim s GLN 38 Ca -0.09 -1.12 -0.14 0.00 -2.00 0.00 0.00 55.36 52.01 3tim s GLN 38 Cb -0.03 -3.43 -0.05 0.00 0.80 0.00 0.00 33.01 30.31 3tim s GLN 38 CO 0.01 -0.62 0.34 0.00 -0.50 0.00 0.00 175.29 174.52 3tim s VAL 40 N -0.51 1.44 -0.30 0.00 1.01 -0.82 0.97 120.40 122.20 3tim s VAL 40 Ca 0.21 -1.07 0.02 0.00 0.00 0.00 0.00 61.98 61.13 3tim s VAL 40 Cb -0.15 -1.26 0.09 0.00 0.00 0.00 0.00 36.38 35.06 3tim s VAL 40 CO 0.09 0.16 0.03 -0.69 0.00 0.00 0.00 175.10 174.69 3tim s VAL 41 N -0.77 1.62 -0.48 2.92 1.01 0.20 -0.16 120.40 124.74 3tim s VAL 41 Ca 0.05 -1.71 -0.17 0.00 0.00 0.00 0.00 61.98 60.16 3tim s VAL 41 Cb -0.08 -2.10 0.06 0.00 0.00 0.00 0.00 36.38 34.26 3tim s VAL 41 CO 0.01 -0.46 0.49 0.00 0.00 0.00 0.00 175.10 175.14 3tim s ALA 42 N 1.27 3.48 0.49 5.51 0.00 0.95 -0.04 121.76 133.42 3tim s ALA 42 Ca 0.05 -1.91 0.07 0.00 0.00 0.00 0.00 51.96 50.18 3tim s ALA 42 Cb -0.18 -3.18 0.02 0.00 0.00 0.00 0.00 23.12 19.77 3tim s ALA 42 CO -0.13 -1.83 0.44 -1.54 0.00 0.00 0.00 175.76 172.71 3tim s SER 43 N 2.56 4.87 0.90 0.00 1.04 -1.10 -1.52 113.70 120.44 3tim s SER 43 Ca 0.09 -0.97 -0.11 0.00 0.48 0.00 0.00 55.95 55.44 3tim s SER 43 Cb -0.21 -0.04 0.13 0.00 0.10 0.00 0.00 66.02 65.99 3tim s SER 43 CO 0.09 -0.93 1.09 0.42 0.98 0.00 0.00 173.24 174.89 3tim s THR 44 N -2.63 2.65 0.18 2.02 -4.23 -1.26 -4.02 115.64 108.34 3tim s THR 44 Ca 0.44 0.21 -0.14 0.00 -1.18 0.00 0.00 61.69 61.03 3tim s THR 44 Cb -0.03 -2.61 0.07 0.00 1.34 0.00 0.00 72.50 71.27 3tim s THR 44 CO 0.27 -0.28 1.81 -0.26 -0.54 0.00 0.00 174.62 175.62 3tim h PHE 45 N -1.61 0.55 0.00 3.99 0.04 -1.96 -2.33 116.94 115.62 3tim h PHE 45 Ca -0.49 0.02 -0.00 0.00 2.80 0.00 0.00 57.97 60.30 3tim h PHE 45 Cb 1.28 -0.18 -0.00 0.00 2.20 0.00 0.00 35.95 39.25 3tim h PHE 45 CO 0.45 0.31 -0.02 0.28 -0.60 0.00 0.00 178.31 178.72 3tim h VAL 46 N 0.59 0.67 -0.01 -0.55 2.07 -2.03 -2.89 116.25 114.11 3tim h VAL 46 Ca 0.21 -0.09 0.00 0.00 0.82 0.00 0.00 66.70 67.63 3tim h VAL 46 Cb 0.04 1.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.86 3tim h VAL 46 CO -0.10 0.02 -0.54 1.41 0.02 0.00 0.00 177.57 178.38 3tim n HIS 47 N -4.01 0.00 -0.32 1.57 8.25 -0.92 -4.45 115.22 115.35 3tim n HIS 47 Ca -0.03 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.50 3tim n HIS 47 Cb 0.11 0.00 0.16 0.00 1.12 0.00 0.00 29.99 31.38 3tim n HIS 47 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 3tim h LEU 48 N 1.84 -0.69 -0.05 2.41 5.85 -1.23 -1.44 115.31 122.00 3tim h LEU 48 Ca 0.00 0.26 0.04 0.00 0.84 0.00 0.00 57.88 59.02 3tim h LEU 48 Cb 0.66 0.51 -0.05 0.00 0.37 0.00 0.00 40.66 42.16 3tim h LEU 48 CO 0.00 -0.29 -0.22 0.00 -0.34 0.00 0.00 178.44 177.58 3tim h ALA 49 N 1.89 -0.26 -0.33 1.25 0.00 -1.78 0.14 119.26 120.18 3tim h ALA 49 Ca 0.47 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.36 3tim h ALA 49 Cb 0.79 0.41 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 3tim h ALA 49 CO -0.89 -0.71 0.07 1.98 0.00 0.00 0.00 179.25 179.70 3tim h MET 50 N -0.33 0.53 -0.64 0.00 1.85 -1.73 -2.69 114.93 111.92 3tim h MET 50 Ca 0.07 -0.13 -0.07 0.00 -0.61 0.00 0.00 59.70 58.97 3tim h MET 50 Cb 0.43 -0.07 -0.03 0.00 0.43 0.00 0.00 31.60 32.37 3tim h MET 50 CO -0.24 0.60 0.14 1.15 -0.40 0.00 0.00 176.91 178.17 3tim h THR 51 N 0.38 1.26 -0.45 -0.77 2.02 -1.14 -2.48 112.91 111.73 3tim h THR 51 Ca 0.10 -0.95 0.06 0.00 0.77 0.00 0.00 66.41 66.38 3tim h THR 51 Cb 0.31 0.65 -0.05 0.00 -1.74 0.00 0.00 68.15 67.32 3tim h THR 51 CO 0.00 0.36 0.17 0.50 0.37 0.00 0.00 175.52 176.92 3tim h LYS 52 N 0.95 0.34 -0.30 6.66 3.64 -0.62 -0.47 116.57 126.77 3tim h LYS 52 Ca 0.20 -0.02 -0.15 0.00 -1.27 0.00 0.00 60.65 59.41 3tim h LYS 52 Cb 0.38 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.12 3tim h LYS 52 CO 0.00 0.22 -0.42 1.49 -2.27 0.00 0.00 179.45 178.47 3tim h GLU 53 N 0.35 0.74 0.11 1.90 4.81 -1.33 -3.37 114.58 117.79 3tim h GLU 53 Ca 0.21 -0.40 -0.33 0.00 -0.13 0.00 0.00 59.36 58.71 3tim h GLU 53 Cb 0.20 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.58 3tim h GLU 53 CO -0.21 1.02 -1.78 0.00 -0.73 0.00 0.00 179.01 177.31 3tim h ARG 54 N 0.60 0.23 -5.66 1.92 2.47 -1.26 -3.45 114.38 109.23 3tim h ARG 54 Ca 0.04 -0.40 -0.29 0.00 -1.26 0.00 0.00 59.98 58.08 3tim h ARG 54 Cb 0.98 0.15 -0.02 0.00 -1.65 0.00 0.00 29.97 29.42 3tim h ARG 54 CO 0.09 1.19 0.81 -0.51 0.56 0.00 0.00 179.97 182.11 3tim s LEU 55 N -7.27 3.15 0.11 3.04 1.43 -0.20 -4.78 118.68 114.16 3tim s LEU 55 Ca -0.22 -0.01 0.13 0.00 -1.03 0.00 0.00 54.13 53.00 3tim s LEU 55 Cb 0.06 -2.54 -0.13 0.00 0.03 0.00 0.00 46.19 43.61 3tim s LEU 55 CO 0.75 -3.00 1.08 0.28 0.23 0.00 0.00 176.35 175.69 3tim h SER 56 N 13.70 0.00 -1.76 2.29 0.02 -1.89 -3.48 113.55 122.43 3tim h SER 56 Ca -0.05 0.00 -0.68 0.00 -0.84 0.00 0.00 61.79 60.22 3tim h SER 56 Cb 1.08 0.00 0.04 0.00 0.14 0.00 0.00 62.40 63.66 3tim h SER 56 CO 1.15 0.77 0.68 1.57 -1.14 0.00 0.00 176.83 179.87 3tim n HIS 57 N -3.14 1.84 0.24 3.45 -0.00 -1.26 -4.87 115.22 111.48 3tim n HIS 57 Ca -0.05 0.50 0.11 0.00 -0.00 0.00 0.00 57.72 58.28 3tim n HIS 57 Cb 0.89 -2.43 0.60 0.00 -0.00 0.00 0.00 29.99 29.05 3tim n HIS 57 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 3tim h PRO 58 N 5.90 0.00 -0.07 1.57 0.11 -1.96 -2.76 132.00 134.78 3tim h PRO 58 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3tim h PRO 58 Cb 1.31 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.42 3tim h PRO 58 CO 0.86 0.18 0.00 1.63 -0.21 0.00 0.00 178.00 180.46 3tim n LYS 59 N -3.55 1.73 -4.47 1.05 5.02 -1.26 -4.92 118.16 111.75 3tim n LYS 59 Ca -0.01 -1.07 -0.31 0.00 -2.02 0.00 0.00 58.31 54.90 3tim n LYS 59 Cb 0.33 -1.45 -0.11 0.00 -0.02 0.00 0.00 35.03 33.77 3tim n LYS 59 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 3tim s PHE 60 N -1.92 2.74 0.01 2.13 0.40 -1.04 0.39 117.98 120.69 3tim s PHE 60 Ca 0.36 -0.14 0.01 0.00 -0.60 0.00 0.00 56.93 56.56 3tim s PHE 60 Cb 0.20 -1.52 -0.01 0.00 0.51 0.00 0.00 43.02 42.20 3tim s PHE 60 CO 0.31 0.34 -0.04 0.14 0.70 0.00 0.00 175.22 176.67 3tim s VAL 61 N -1.02 0.27 0.22 -0.44 -7.23 0.27 -4.90 120.40 107.57 3tim s VAL 61 Ca 0.17 -0.44 -0.20 0.00 -1.81 0.00 0.00 61.98 59.71 3tim s VAL 61 Cb -0.11 -0.29 -0.08 0.00 0.56 0.00 0.00 36.38 36.46 3tim s VAL 61 CO 0.08 -0.11 0.72 -0.63 -0.31 0.00 0.00 175.10 174.85 3tim s ILE 62 N -0.55 4.57 -0.00 -0.62 1.09 -1.26 0.63 121.20 125.05 3tim s ILE 62 Ca -0.04 1.29 -0.11 0.00 -1.10 0.00 0.00 60.65 60.69 3tim s ILE 62 Cb -0.04 -3.87 0.01 0.00 -1.06 0.00 0.00 42.46 37.50 3tim s ILE 62 CO -0.00 0.23 0.23 0.00 -0.10 0.00 0.00 174.94 175.29 3tim s ALA 63 N -1.50 -0.57 0.11 9.38 0.00 0.95 -3.96 121.76 126.17 3tim s ALA 63 Ca 0.42 0.09 0.02 0.00 0.00 0.00 0.00 51.96 52.50 3tim s ALA 63 Cb -0.17 0.11 -0.04 0.00 0.00 0.00 0.00 23.12 23.02 3tim s ALA 63 CO 0.21 -0.25 0.22 0.00 0.00 0.00 0.00 175.76 175.94 3tim s ALA 64 N -1.43 3.89 -0.84 0.00 0.00 -0.76 -2.72 121.76 119.90 3tim s ALA 64 Ca -0.14 -0.99 0.26 0.00 0.00 0.00 0.00 51.96 51.10 3tim s ALA 64 Cb -0.06 -1.71 0.98 0.00 0.00 0.00 0.00 23.12 22.34 3tim s ALA 64 CO 0.03 0.66 1.81 1.04 0.00 0.00 0.00 175.76 179.29 3tim n GLN 65 N -0.12 0.13 -3.91 0.00 6.02 -1.26 -1.89 117.38 116.35 3tim n GLN 65 Ca -0.07 0.15 0.04 0.00 -0.01 0.00 0.00 57.00 57.11 3tim n GLN 65 Cb 0.53 -1.67 0.01 0.00 1.02 0.00 0.00 30.24 30.13 3tim n GLN 65 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 3tim n ASN 66 N -1.90 -1.06 -3.65 1.08 4.05 -1.23 -4.52 115.26 108.04 3tim n ASN 66 Ca 0.06 -1.13 0.01 0.00 0.45 0.00 0.00 54.58 53.96 3tim n ASN 66 Cb 0.36 1.62 0.01 0.00 1.23 0.00 0.00 39.78 42.99 3tim n ASN 66 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 3tim s ALA 67 N -1.95 -2.14 0.31 5.20 0.00 -1.26 -4.97 121.76 116.95 3tim s ALA 67 Ca 0.30 0.13 0.08 0.00 0.00 0.00 0.00 51.96 52.48 3tim s ALA 67 Cb -0.00 0.70 -0.04 0.00 0.00 0.00 0.00 23.12 23.77 3tim s ALA 67 CO -0.02 -1.10 0.12 0.96 0.00 0.00 0.00 175.76 175.73 3tim s ILE 68 N -2.26 3.38 0.03 0.00 -4.36 0.11 -4.93 121.20 113.18 3tim s ILE 68 Ca 0.22 -1.70 -0.29 0.00 -0.26 0.00 0.00 60.65 58.63 3tim s ILE 68 Cb 0.00 -3.01 -0.16 0.00 1.25 0.00 0.00 42.46 40.55 3tim s ILE 68 CO 0.00 -0.26 1.28 0.00 0.24 0.00 0.00 174.94 176.20 3tim h ALA 69 N 1.62 -1.13 -1.78 2.27 0.00 -1.92 -0.56 119.26 117.75 3tim h ALA 69 Ca -0.45 -0.23 -0.51 0.00 0.00 0.00 0.00 54.91 53.73 3tim h ALA 69 Cb 1.25 0.40 -0.05 0.00 0.00 0.00 0.00 17.79 19.39 3tim h ALA 69 CO 0.62 -1.06 -0.46 -1.59 0.00 0.00 0.00 179.25 176.76 3tim s LYS 70 N -5.02 2.58 0.64 0.00 -2.85 -1.26 -3.46 119.74 110.37 3tim s LYS 70 Ca -0.15 -1.42 -0.05 0.00 -1.00 0.00 0.00 55.97 53.34 3tim s LYS 70 Cb 0.02 -2.37 0.04 0.00 -2.06 0.00 0.00 37.83 33.45 3tim s LYS 70 CO 0.45 0.03 0.94 -1.12 0.10 0.00 0.00 175.35 175.75 3tim s SER 71 N -3.98 5.20 0.00 0.03 0.01 -1.26 -4.74 113.70 108.96 3tim s SER 71 Ca 0.42 0.51 0.00 0.00 1.31 0.00 0.00 55.95 58.18 3tim s SER 71 Cb -0.04 -1.34 0.00 0.00 0.21 0.00 0.00 66.02 64.85 3tim s SER 71 CO 0.26 -1.31 0.00 0.61 0.41 0.00 0.00 173.24 173.21 3tim n GLY 72 N -2.70 0.19 2.54 3.44 0.00 -1.26 -4.97 105.19 102.43 3tim n GLY 72 Ca 0.06 -1.13 -0.41 0.00 0.00 0.00 0.00 46.02 44.55 3tim n GLY 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3tim n ALA 73 N -0.63 6.49 -3.61 4.61 0.00 -1.26 -4.74 120.51 121.37 3tim n ALA 73 Ca 0.00 -3.73 -0.27 0.00 0.00 0.00 0.00 53.44 49.43 3tim n ALA 73 Cb 0.00 -3.44 -0.10 0.00 0.00 0.00 0.00 19.45 15.91 3tim n ALA 73 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3tim n PHE 74 N 4.84 2.81 -1.69 0.00 3.01 -1.26 -5.07 117.46 120.11 3tim n PHE 74 Ca 0.64 -4.11 -0.58 0.00 1.01 0.00 0.00 57.45 54.41 3tim n PHE 74 Cb 0.31 -0.51 -0.07 0.00 -0.01 0.00 0.00 39.48 39.20 3tim n PHE 74 CO 0.00 0.00 0.00 2.41 1.01 0.00 0.00 176.76 180.18 3tim n THR 75 N 1.53 0.28 0.00 4.37 -1.04 -1.26 -0.94 114.28 117.22 3tim n THR 75 Ca 0.25 -0.06 0.00 0.00 -2.04 0.00 0.00 64.05 62.19 3tim n THR 75 Cb 0.40 -1.21 0.00 0.00 -1.82 0.00 0.00 70.33 67.70 3tim n THR 75 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3tim n GLY 76 N 4.44 3.39 3.92 3.41 0.00 -1.26 -5.06 105.19 114.03 3tim n GLY 76 Ca 0.28 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.04 3tim n GLY 76 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3tim s GLU 77 N -0.78 3.56 -0.03 1.61 0.41 -0.12 -5.13 118.70 118.21 3tim s GLU 77 Ca 0.00 -0.14 0.05 0.00 -0.41 0.00 0.00 54.97 54.47 3tim s GLU 77 Cb 0.00 -2.64 -0.01 0.00 -1.78 0.00 0.00 34.13 29.70 3tim s GLU 77 CO 0.00 0.16 -0.18 0.08 -0.49 0.00 0.00 175.26 174.83 3tim s VAL 78 N -2.23 1.46 0.24 2.63 1.01 -1.26 -4.94 120.40 117.31 3tim s VAL 78 Ca 0.42 -0.77 0.08 0.00 0.00 0.00 0.00 61.98 61.71 3tim s VAL 78 Cb -0.10 -1.23 -0.04 0.00 0.00 0.00 0.00 36.38 35.01 3tim s VAL 78 CO 0.34 0.42 0.08 -0.94 0.00 0.00 0.00 175.10 175.00 3tim s SER 79 N -0.26 5.03 0.37 3.32 1.04 -1.26 0.05 113.70 121.99 3tim s SER 79 Ca 0.03 -0.41 0.14 0.00 0.48 0.00 0.00 55.95 56.19 3tim s SER 79 Cb -0.09 -1.13 0.97 0.00 0.10 0.00 0.00 66.02 65.87 3tim s SER 79 CO 0.00 0.01 1.80 -0.07 0.98 0.00 0.00 173.24 175.97 3tim h LEU 80 N 1.94 0.55 -0.48 2.42 3.38 -1.12 -0.95 115.31 121.05 3tim h LEU 80 Ca -0.47 0.07 -0.14 0.00 0.09 0.00 0.00 57.88 57.44 3tim h LEU 80 Cb 1.23 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.95 3tim h LEU 80 CO 0.60 0.18 -0.26 -0.65 0.09 0.00 0.00 178.44 178.41 3tim h PRO 81 N 0.53 0.98 -0.54 1.13 0.11 -1.86 -1.55 132.00 130.80 3tim h PRO 81 Ca 0.55 -0.44 -0.08 0.00 0.11 0.00 0.00 66.00 66.14 3tim h PRO 81 Cb 1.17 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 32.24 3tim h PRO 81 CO -0.29 1.11 0.02 0.82 -0.21 0.00 0.00 178.00 179.46 3tim h ILE 82 N 0.84 1.25 0.10 4.15 2.04 -1.62 -1.55 117.51 122.71 3tim h ILE 82 Ca 0.10 -1.05 -0.00 0.00 1.00 0.00 0.00 64.86 64.91 3tim h ILE 82 Cb 0.84 0.81 0.00 0.00 -0.74 0.00 0.00 36.82 37.73 3tim h ILE 82 CO 0.07 0.38 -0.05 -0.07 0.00 0.00 0.00 178.15 178.48 3tim h LEU 83 N 0.85 -0.11 -0.67 1.44 3.38 -1.09 -1.91 115.31 117.19 3tim h LEU 83 Ca 0.16 -0.36 0.11 0.00 0.09 0.00 0.00 57.88 57.88 3tim h LEU 83 Cb 0.47 0.03 -0.12 0.00 0.09 0.00 0.00 40.66 41.13 3tim h LEU 83 CO 0.02 0.33 -0.36 0.50 0.09 0.00 0.00 178.44 179.02 3tim h LYS 84 N -0.57 -0.13 -0.28 1.13 3.64 -1.28 -0.92 116.57 118.16 3tim h LYS 84 Ca -0.01 0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.44 3tim h LYS 84 Cb 0.47 0.03 -0.06 0.00 -0.41 0.00 0.00 32.23 32.25 3tim h LYS 84 CO 0.02 -0.09 -0.14 0.22 -2.27 0.00 0.00 179.45 177.19 3tim h ASP 85 N -0.14 -0.47 0.17 4.20 3.58 -1.25 0.24 116.42 122.75 3tim h ASP 85 Ca 0.25 0.11 0.00 0.00 0.42 0.00 0.00 57.03 57.81 3tim h ASP 85 Cb 0.56 0.26 0.00 0.00 1.72 0.00 0.00 39.33 41.87 3tim h ASP 85 CO -0.74 -0.18 0.00 0.33 -2.88 0.00 0.00 179.24 175.77 3tim n PHE 86 N -5.31 0.00 0.00 0.28 7.35 -0.64 -4.86 117.46 114.28 3tim n PHE 86 Ca -0.00 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 3tim n PHE 86 Cb 0.23 -0.47 0.00 0.00 0.35 0.00 0.00 39.48 39.59 3tim n PHE 86 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3tim n GLY 87 N -0.93 0.66 3.67 7.13 0.00 0.83 -5.08 105.19 111.47 3tim n GLY 87 Ca 0.01 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.63 3tim n GLY 87 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3tim s VAL 88 N -2.00 4.99 0.00 1.61 1.01 -0.65 -4.93 120.40 120.43 3tim s VAL 88 Ca 0.00 1.30 0.00 0.00 0.00 0.00 0.00 61.98 63.28 3tim s VAL 88 Cb 0.00 -3.99 0.00 0.00 0.00 0.00 0.00 36.38 32.39 3tim s VAL 88 CO 0.00 0.10 0.55 0.59 0.00 0.00 0.00 175.10 176.34 3tim n ASN 89 N 4.99 1.09 -4.21 3.32 3.02 -1.26 -3.52 115.26 118.69 3tim n ASN 89 Ca -0.00 -1.17 -0.29 0.00 -0.03 0.00 0.00 54.58 53.09 3tim n ASN 89 Cb 0.50 0.00 -0.16 0.00 -0.61 0.00 0.00 39.78 39.50 3tim n ASN 89 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 3tim s TRP 90 N -0.17 2.06 0.00 3.10 0.52 -1.25 -0.36 118.94 122.84 3tim s TRP 90 Ca 0.00 -0.58 0.01 0.00 0.02 0.00 0.00 56.10 55.55 3tim s TRP 90 Cb 0.00 -1.36 -0.00 0.00 -1.15 0.00 0.00 33.47 30.95 3tim s TRP 90 CO 0.00 -0.17 -0.02 -1.50 0.02 0.00 0.00 176.95 175.27 3tim s ILE 91 N -0.12 0.19 -0.31 2.03 1.10 -0.06 -1.83 121.20 122.20 3tim s ILE 91 Ca -0.02 -0.16 -0.13 0.00 -0.51 0.00 0.00 60.65 59.83 3tim s ILE 91 Cb -0.12 -0.18 -0.03 0.00 0.15 0.00 0.00 42.46 42.28 3tim s ILE 91 CO 0.02 0.01 0.27 -0.69 -2.11 0.00 0.00 174.94 172.44 3tim s VAL 92 N -0.16 5.26 0.12 4.00 1.01 -0.79 -0.71 120.40 129.13 3tim s VAL 92 Ca -0.00 0.11 0.11 0.00 0.00 0.00 0.00 61.98 62.20 3tim s VAL 92 Cb -0.02 -3.66 -0.04 0.00 0.00 0.00 0.00 36.38 32.67 3tim s VAL 92 CO -0.00 0.10 -0.26 -0.76 0.00 0.00 0.00 175.10 174.18 3tim s LEU 93 N 1.85 2.30 0.00 3.92 1.43 0.09 -3.48 118.68 124.79 3tim s LEU 93 Ca 0.09 -0.73 0.00 0.00 -1.03 0.00 0.00 54.13 52.46 3tim s LEU 93 Cb -0.16 -1.19 0.00 0.00 0.03 0.00 0.00 46.19 44.87 3tim s LEU 93 CO 0.11 0.17 0.00 0.61 0.23 0.00 0.00 176.35 177.47 3tim n GLY 94 N 1.02 0.48 3.48 -3.19 0.00 -1.26 -1.31 105.19 104.41 3tim n GLY 94 Ca -0.18 -0.55 -0.42 0.00 0.00 0.00 0.00 46.02 44.87 3tim n GLY 94 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 3tim n HIS 95 N -2.91 -0.20 -0.36 1.61 -0.00 -1.26 -4.24 115.22 107.85 3tim n HIS 95 Ca 0.00 0.60 0.06 0.00 0.46 0.00 0.00 57.72 58.84 3tim n HIS 95 Cb 0.00 -2.03 0.23 0.00 -0.12 0.00 0.00 29.99 28.07 3tim n HIS 95 CO 0.00 0.00 0.00 0.66 0.46 0.00 0.00 176.34 177.46 3tim h SER 96 N 0.91 0.93 0.90 0.26 4.64 -1.94 -0.36 113.55 118.88 3tim h SER 96 Ca -0.41 0.04 0.00 0.00 -0.47 0.00 0.00 61.79 60.95 3tim h SER 96 Cb 1.39 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 3tim h SER 96 CO 0.52 0.51 0.00 -0.62 -0.87 0.00 0.00 176.83 176.38 3tim n GLU 97 N -4.61 0.16 0.09 4.77 1.02 -1.26 -1.67 120.64 119.14 3tim n GLU 97 Ca 0.18 0.31 -0.23 0.00 -0.02 0.00 0.00 57.16 57.40 3tim n GLU 97 Cb 0.33 -1.76 -0.15 0.00 -0.02 0.00 0.00 31.44 29.84 3tim n GLU 97 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3tim h ARG 98 N 0.00 0.42 -0.69 3.49 2.47 -1.41 -2.44 114.38 116.22 3tim h ARG 98 Ca 0.00 -0.72 -0.01 0.00 -1.26 0.00 0.00 59.98 57.99 3tim h ARG 98 Cb 0.45 0.27 -0.03 0.00 -1.65 0.00 0.00 29.97 29.00 3tim h ARG 98 CO 0.00 1.34 0.40 0.00 0.56 0.00 0.00 179.97 182.27 3tim h ARG 99 N -0.03 0.96 0.17 0.04 3.08 -1.01 -1.00 114.38 116.58 3tim h ARG 99 Ca -0.26 -0.10 -0.01 0.00 0.07 0.00 0.00 59.98 59.68 3tim h ARG 99 Cb 1.99 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 31.85 3tim h ARG 99 CO 0.20 0.70 -0.08 0.00 -1.07 0.00 0.00 179.97 179.72 3tim h ALA 100 N 1.20 -0.23 -0.53 0.04 0.00 -1.40 -3.36 119.26 114.98 3tim h ALA 100 Ca 0.25 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.07 3tim h ALA 100 Cb 0.01 0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.89 3tim h ALA 100 CO -0.04 -0.22 0.00 0.66 0.00 0.00 0.00 179.25 179.65 3tim n TYR 101 N -4.92 0.70 -0.79 0.00 4.01 -0.92 -4.51 117.16 110.73 3tim n TYR 101 Ca -0.04 -0.35 0.01 0.00 -0.16 0.00 0.00 57.90 57.36 3tim n TYR 101 Cb 0.12 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.17 3tim n TYR 101 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 3tim n TYR 102 N 1.40 0.00 -1.27 -0.72 4.01 -0.38 -5.02 117.16 115.17 3tim n TYR 102 Ca 0.21 -0.24 -0.09 0.00 -0.16 0.00 0.00 57.90 57.61 3tim n TYR 102 Cb 0.57 -0.03 -0.04 0.00 -0.31 0.00 0.00 39.34 39.52 3tim n TYR 102 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3tim n GLY 103 N -0.28 0.99 3.62 2.72 0.00 -1.21 -4.96 105.19 106.08 3tim n GLY 103 Ca 0.01 -0.16 -0.43 0.00 0.00 0.00 0.00 46.02 45.44 3tim n GLY 103 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3tim s GLU 104 N -2.58 3.69 0.22 1.61 2.12 -1.22 -4.97 118.70 117.57 3tim s GLU 104 Ca 0.00 1.46 0.03 0.00 0.36 0.00 0.00 54.97 56.82 3tim s GLU 104 Cb 0.00 -4.04 0.04 0.00 0.26 0.00 0.00 34.13 30.38 3tim s GLU 104 CO 0.00 -1.41 0.31 0.25 -0.54 0.00 0.00 175.26 173.86 3tim n THR 105 N 6.67 0.00 -0.23 -1.70 -2.24 -1.26 -4.26 114.28 111.26 3tim n THR 105 Ca 0.19 -0.70 -0.05 0.00 -2.27 0.00 0.00 64.05 61.21 3tim n THR 105 Cb 0.46 -0.86 0.10 0.00 -2.10 0.00 0.00 70.33 67.93 3tim n THR 105 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 3tim h ASN 106 N 0.01 1.00 -0.27 3.42 2.35 -1.98 -0.41 115.58 119.69 3tim h ASN 106 Ca -0.10 -0.18 -0.09 0.00 -0.55 0.00 0.00 56.30 55.38 3tim h ASN 106 Cb 0.46 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.57 3tim h ASN 106 CO 0.14 0.93 -0.17 -0.33 -1.65 0.00 0.00 177.43 176.36 3tim h GLU 107 N 1.03 0.59 0.41 0.81 3.07 -1.94 -1.37 114.58 117.17 3tim h GLU 107 Ca 0.22 -0.27 -0.02 0.00 -0.50 0.00 0.00 59.36 58.80 3tim h GLU 107 Cb 0.30 -0.01 -0.00 0.00 -0.84 0.00 0.00 28.75 28.20 3tim h GLU 107 CO -0.01 0.85 -0.26 0.82 -1.40 0.00 0.00 179.01 179.01 3tim h ILE 108 N 0.32 0.00 -0.88 3.13 1.08 -1.85 -1.25 117.51 118.06 3tim h ILE 108 Ca 0.06 0.00 0.19 0.00 -0.39 0.00 0.00 64.86 64.71 3tim h ILE 108 Cb 0.70 0.00 -0.16 0.00 -3.07 0.00 0.00 36.82 34.28 3tim h ILE 108 CO 0.05 0.00 -0.17 0.58 -0.69 0.00 0.00 178.15 177.92 3tim h VAL 109 N -0.63 0.13 -0.45 1.67 2.07 -1.15 0.25 116.25 118.14 3tim h VAL 109 Ca -0.05 -0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.50 3tim h VAL 109 Cb 0.51 0.12 -0.04 0.00 -1.52 0.00 0.00 31.29 30.36 3tim h VAL 109 CO 0.05 0.00 0.21 0.00 0.02 0.00 0.00 177.57 177.85 3tim h ALA 110 N 1.87 0.56 -0.13 1.67 0.00 -1.10 0.51 119.26 122.65 3tim h ALA 110 Ca 0.44 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.36 3tim h ALA 110 Cb 0.71 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 3tim h ALA 110 CO -0.88 -0.15 0.03 -0.44 0.00 0.00 0.00 179.25 177.81 3tim h ASP 111 N 0.43 0.20 -0.47 0.00 3.32 -0.02 0.21 116.42 120.08 3tim h ASP 111 Ca 0.20 -0.24 0.01 0.00 0.02 0.00 0.00 57.03 57.02 3tim h ASP 111 Cb 0.12 -0.05 -0.03 0.00 0.22 0.00 0.00 39.33 39.60 3tim h ASP 111 CO -0.15 0.38 0.31 0.11 -1.72 0.00 0.00 179.24 178.17 3tim h LYS 112 N 0.00 0.60 0.41 3.56 1.57 -0.83 -0.05 116.57 121.83 3tim h LYS 112 Ca 0.04 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 3tim h LYS 112 Cb 0.26 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.43 3tim h LYS 112 CO 0.00 0.40 -0.25 0.28 -0.57 0.00 0.00 179.45 179.31 3tim h VAL 113 N 0.62 0.48 -0.87 0.50 2.07 -0.77 -1.51 116.25 116.78 3tim h VAL 113 Ca 0.18 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.86 3tim h VAL 113 Cb -0.05 0.48 -0.10 0.00 -1.52 0.00 0.00 31.29 30.10 3tim h VAL 113 CO -0.05 0.00 0.45 0.00 0.02 0.00 0.00 177.57 177.99 3tim h ALA 114 N -0.07 1.33 0.18 1.67 0.00 -0.29 -1.74 119.26 120.35 3tim h ALA 114 Ca -0.04 0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3tim h ALA 114 Cb 0.52 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 3tim h ALA 114 CO 0.05 -0.12 -0.18 0.00 0.00 0.00 0.00 179.25 179.00 3tim h ALA 115 N 1.58 -0.36 -0.13 0.00 0.00 -0.60 -2.00 119.26 117.74 3tim h ALA 115 Ca 0.49 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 55.24 3tim h ALA 115 Cb 0.73 0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 3tim h ALA 115 CO -0.39 -0.73 -0.39 0.00 0.00 0.00 0.00 179.25 177.75 3tim h ALA 116 N 0.38 1.09 -0.27 0.00 0.00 -0.99 -2.27 119.26 117.20 3tim h ALA 116 Ca 0.00 -0.40 -0.12 0.00 0.00 0.00 0.00 54.91 54.39 3tim h ALA 116 Cb 0.37 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 3tim h ALA 116 CO -0.04 0.58 -0.34 0.28 0.00 0.00 0.00 179.25 179.73 3tim h VAL 117 N 0.25 1.29 -0.52 0.00 2.07 -1.01 0.16 116.25 118.49 3tim h VAL 117 Ca 0.02 -1.46 -0.06 0.00 0.82 0.00 0.00 66.70 66.02 3tim h VAL 117 Cb 0.80 1.45 -0.02 0.00 -1.52 0.00 0.00 31.29 32.00 3tim h VAL 117 CO 0.06 0.47 0.11 0.00 0.02 0.00 0.00 177.57 178.23 3tim h ALA 118 N 1.13 0.68 0.00 1.67 0.00 -0.87 -1.47 119.26 120.41 3tim h ALA 118 Ca 0.05 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.74 3tim h ALA 118 Cb 0.82 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.42 3tim h ALA 118 CO 0.07 0.40 0.00 0.43 0.00 0.00 0.00 179.25 180.15 3tim n SER 119 N -4.42 0.00 -2.28 0.00 7.64 -0.90 -4.84 113.62 108.82 3tim n SER 119 Ca 0.02 -0.48 -0.17 0.00 1.01 0.00 0.00 58.87 59.25 3tim n SER 119 Cb 0.24 0.00 0.02 0.00 -1.01 0.00 0.00 64.21 63.46 3tim n SER 119 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3tim n GLY 120 N -0.28 -0.25 3.92 0.23 0.00 -0.55 -5.02 105.19 103.24 3tim n GLY 120 Ca 0.02 -0.10 -0.26 0.00 0.00 0.00 0.00 46.02 45.68 3tim n GLY 120 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3tim s PHE 121 N -2.99 3.47 -0.44 1.61 0.40 0.55 -4.99 117.98 115.60 3tim s PHE 121 Ca 0.19 0.58 -0.10 0.00 -0.60 0.00 0.00 56.93 57.00 3tim s PHE 121 Cb -0.09 -2.22 0.08 0.00 0.51 0.00 0.00 43.02 41.31 3tim s PHE 121 CO 0.24 -0.21 0.30 1.41 0.70 0.00 0.00 175.22 177.66 3tim s MET 122 N -4.61 2.66 -0.11 0.44 1.75 0.52 -4.53 119.30 115.41 3tim s MET 122 Ca 0.46 -1.49 -0.07 0.00 -1.25 0.00 0.00 55.69 53.33 3tim s MET 122 Cb -0.10 -3.87 -0.04 0.00 2.84 0.00 0.00 34.83 33.66 3tim s MET 122 CO 0.41 -1.01 0.16 0.08 -0.65 0.00 0.00 175.02 174.01 3tim s VAL 123 N 1.46 5.48 -0.35 10.11 1.01 -0.57 -0.88 120.40 136.65 3tim s VAL 123 Ca 0.04 0.24 0.01 0.00 0.00 0.00 0.00 61.98 62.27 3tim s VAL 123 Cb -0.24 -3.42 0.09 0.00 0.00 0.00 0.00 36.38 32.82 3tim s VAL 123 CO 0.02 0.62 0.08 -0.63 0.00 0.00 0.00 175.10 175.19 3tim s ILE 124 N -1.04 2.63 -0.03 2.22 1.01 0.12 -0.61 121.20 125.51 3tim s ILE 124 Ca 0.16 -2.11 -0.16 0.00 0.00 0.00 0.00 60.65 58.54 3tim s ILE 124 Cb -0.12 -2.82 -0.05 0.00 0.01 0.00 0.00 42.46 39.47 3tim s ILE 124 CO 0.05 -0.53 0.44 0.00 0.00 0.00 0.00 174.94 174.90 3tim s ALA 125 N 1.02 3.63 -0.13 9.38 0.00 0.00 -0.73 121.76 134.93 3tim s ALA 125 Ca 0.07 -0.19 -0.03 0.00 0.00 0.00 0.00 51.96 51.80 3tim s ALA 125 Cb -0.20 -2.48 -0.03 0.00 0.00 0.00 0.00 23.12 20.41 3tim s ALA 125 CO -0.06 0.34 -0.01 0.00 0.00 0.00 0.00 175.76 176.03 3tim s ILE 127 N -0.16 0.44 0.00 0.00 -4.36 -0.75 -4.67 121.20 111.69 3tim s ILE 127 Ca 0.04 -1.37 0.00 0.00 -0.26 0.00 0.00 60.65 59.06 3tim s ILE 127 Cb -0.13 -0.95 0.00 0.00 1.25 0.00 0.00 42.46 42.64 3tim s ILE 127 CO 0.02 -0.63 0.00 0.61 0.24 0.00 0.00 174.94 175.19 3tim n GLY 128 N 0.90 1.76 3.89 6.27 0.00 -1.26 0.25 105.19 117.00 3tim n GLY 128 Ca -0.19 -0.52 -0.31 0.00 0.00 0.00 0.00 46.02 45.01 3tim n GLY 128 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3tim s GLU 129 N -2.00 3.69 0.85 1.61 4.04 -1.26 -4.85 118.70 120.78 3tim s GLU 129 Ca 0.00 0.08 -0.12 0.00 0.04 0.00 0.00 54.97 54.97 3tim s GLU 129 Cb 0.00 -2.70 0.10 0.00 0.02 0.00 0.00 34.13 31.55 3tim s GLU 129 CO 0.00 0.32 1.10 0.95 -1.84 0.00 0.00 175.26 175.79 3tim s THR 130 N -1.87 2.80 0.13 1.83 -4.23 -1.26 -1.44 115.64 111.60 3tim s THR 130 Ca 0.44 0.26 -0.17 0.00 -1.18 0.00 0.00 61.69 61.05 3tim s THR 130 Cb -0.11 -2.92 -0.02 0.00 1.34 0.00 0.00 72.50 70.79 3tim s THR 130 CO 0.25 -0.34 1.69 0.25 -0.54 0.00 0.00 174.62 175.93 3tim h LEU 131 N -1.30 0.47 -0.57 4.79 6.46 -1.82 -1.02 115.31 122.33 3tim h LEU 131 Ca -0.48 -0.14 0.11 0.00 -0.12 0.00 0.00 57.88 57.24 3tim h LEU 131 Cb 1.28 -0.12 -0.11 0.00 -0.73 0.00 0.00 40.66 40.98 3tim h LEU 131 CO 0.58 0.48 -0.24 -0.61 -0.62 0.00 0.00 178.44 178.04 3tim h GLN 132 N 0.43 -0.09 0.22 1.25 -0.00 -1.96 0.15 115.11 115.11 3tim h GLN 132 Ca 0.12 0.01 -0.01 0.00 -0.00 0.00 0.00 58.65 58.77 3tim h GLN 132 Cb 0.15 0.02 0.00 0.00 0.00 0.00 0.00 27.48 27.65 3tim h GLN 132 CO -0.01 -0.06 -0.11 0.93 0.00 0.00 0.00 178.83 179.58 3tim h GLU 133 N -0.10 -0.28 -0.67 1.69 5.08 -1.90 -2.66 114.58 115.74 3tim h GLU 133 Ca 0.26 0.02 0.11 0.00 -1.00 0.00 0.00 59.36 58.75 3tim h GLU 133 Cb 0.50 0.06 -0.08 0.00 0.50 0.00 0.00 28.75 29.73 3tim h GLU 133 CO -0.63 0.07 0.26 -0.09 -1.00 0.00 0.00 179.01 177.62 3tim h ARG 134 N -0.70 0.42 -0.80 2.33 2.43 -0.87 0.40 114.38 117.58 3tim h ARG 134 Ca -0.03 -0.03 0.12 0.00 -0.81 0.00 0.00 59.98 59.24 3tim h ARG 134 Cb 0.49 -0.09 -0.08 0.00 -0.42 0.00 0.00 29.97 29.86 3tim h ARG 134 CO 0.05 0.28 0.41 0.93 -1.51 0.00 0.00 179.97 180.12 3tim h GLU 135 N 0.43 0.62 -0.62 0.20 5.08 -0.71 0.11 114.58 119.68 3tim h GLU 135 Ca 0.35 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.67 3tim h GLU 135 Cb 0.46 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.57 3tim h GLU 135 CO -0.34 0.41 0.00 -1.13 -1.00 0.00 0.00 179.01 176.95 3tim n SER 136 N -4.85 2.73 -3.23 1.42 3.41 -0.59 -4.92 113.62 107.59 3tim n SER 136 Ca 0.14 -2.27 -0.23 0.00 -0.26 0.00 0.00 58.87 56.26 3tim n SER 136 Cb 0.35 -0.45 0.05 0.00 -0.26 0.00 0.00 64.21 63.91 3tim n SER 136 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3tim n GLY 137 N 0.61 -0.53 1.54 5.00 0.00 0.38 -4.91 105.19 107.28 3tim n GLY 137 Ca 0.13 0.18 0.08 0.00 0.00 0.00 0.00 46.02 46.41 3tim n GLY 137 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3tim n ARG 138 N -4.39 3.68 0.11 1.61 1.74 0.03 -4.61 116.66 114.83 3tim n ARG 138 Ca -0.07 -2.66 -0.14 0.00 -0.77 0.00 0.00 57.85 54.22 3tim n ARG 138 Cb 0.60 -1.91 -0.08 0.00 -1.02 0.00 0.00 32.46 30.05 3tim n ARG 138 CO 0.00 0.00 0.00 1.15 -1.52 0.00 0.00 177.63 177.26 3tim h THR 139 N 3.74 0.00 -0.56 0.55 2.02 -1.84 -0.38 112.91 116.43 3tim h THR 139 Ca 0.00 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.24 3tim h THR 139 Cb 1.44 0.00 -0.05 0.00 -1.74 0.00 0.00 68.15 67.79 3tim h THR 139 CO 0.26 0.00 0.27 0.00 0.37 0.00 0.00 175.52 176.41 3tim h ALA 140 N -0.77 0.73 -0.66 6.16 0.00 -1.98 0.13 119.26 122.87 3tim h ALA 140 Ca -0.01 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 3tim h ALA 140 Cb 0.63 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 3tim h ALA 140 CO -0.22 -0.10 0.40 -0.39 0.00 0.00 0.00 179.25 178.94 3tim h VAL 141 N 0.51 1.19 0.51 0.00 -1.51 -1.83 -2.59 116.25 112.52 3tim h VAL 141 Ca 0.26 -0.44 -0.02 0.00 -1.23 0.00 0.00 66.70 65.27 3tim h VAL 141 Cb 0.22 0.29 0.00 0.00 -2.13 0.00 0.00 31.29 29.67 3tim h VAL 141 CO -0.20 0.20 -0.24 0.58 -1.23 0.00 0.00 177.57 176.67 3tim h VAL 142 N 0.90 0.00 -0.61 7.19 2.07 -0.44 -1.74 116.25 123.62 3tim h VAL 142 Ca 0.24 -0.08 0.18 0.00 0.82 0.00 0.00 66.70 67.85 3tim h VAL 142 Cb -0.02 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 29.73 3tim h VAL 142 CO -0.04 0.00 0.49 -0.37 0.02 0.00 0.00 177.57 177.67 3tim h VAL 143 N -0.76 0.55 0.12 2.57 -1.51 -0.82 -2.22 116.25 114.17 3tim h VAL 143 Ca -0.07 0.00 -0.33 0.00 -1.23 0.00 0.00 66.70 65.07 3tim h VAL 143 Cb 0.52 0.64 -0.01 0.00 -2.13 0.00 0.00 31.29 30.32 3tim h VAL 143 CO 0.11 0.00 -1.71 -0.07 -1.23 0.00 0.00 177.57 174.68 3tim h LEU 144 N 0.00 0.39 -0.13 4.19 3.38 -1.48 -2.91 115.31 118.75 3tim h LEU 144 Ca 0.29 -0.64 0.03 0.00 0.09 0.00 0.00 57.88 57.65 3tim h LEU 144 Cb 1.27 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.86 3tim h LEU 144 CO -0.00 1.55 -0.06 0.74 0.09 0.00 0.00 178.44 180.76 3tim h THR 145 N 0.07 0.81 0.22 0.22 2.02 -0.97 0.71 112.91 115.99 3tim h THR 145 Ca -0.31 0.00 0.01 0.00 0.77 0.00 0.00 66.41 66.88 3tim h THR 145 Cb 2.04 0.81 -0.02 0.00 -1.74 0.00 0.00 68.15 69.23 3tim h THR 145 CO 0.14 0.00 -0.27 1.56 0.37 0.00 0.00 175.52 177.31 3tim h GLN 146 N -0.04 -0.53 -0.29 6.66 4.20 -1.51 -1.71 115.11 121.89 3tim h GLN 146 Ca 0.07 0.04 -0.04 0.00 0.06 0.00 0.00 58.65 58.78 3tim h GLN 146 Cb 0.15 0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.03 3tim h GLN 146 CO -0.16 -0.35 0.01 0.97 -0.67 0.00 0.00 178.83 178.63 3tim h ILE 147 N -0.55 1.17 -0.79 2.54 -0.00 -1.35 -2.63 117.51 115.89 3tim h ILE 147 Ca 0.00 -0.64 0.00 0.00 -0.00 0.00 0.00 64.86 64.22 3tim h ILE 147 Cb 0.53 0.94 -0.04 0.00 -0.00 0.00 0.00 36.82 38.25 3tim h ILE 147 CO -0.09 0.22 0.51 0.00 -0.00 0.00 0.00 178.15 178.79 3tim h ALA 148 N 1.61 1.40 0.00 0.18 0.00 -0.37 -0.18 119.26 121.90 3tim h ALA 148 Ca 0.09 -0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 3tim h ALA 148 Cb 0.26 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 3tim h ALA 148 CO 0.01 0.54 -0.39 0.00 0.00 0.00 0.00 179.25 179.41 3tim h ALA 149 N 1.48 1.33 -0.06 0.00 0.00 -0.95 -1.90 119.26 119.15 3tim h ALA 149 Ca 0.29 -0.35 -0.11 0.00 0.00 0.00 0.00 54.91 54.74 3tim h ALA 149 Cb -0.10 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 17.64 3tim h ALA 149 CO -0.06 0.48 -0.38 0.82 0.00 0.00 0.00 179.25 180.11 3tim h ILE 150 N 0.00 1.42 -0.95 0.00 2.04 -0.93 -3.30 117.51 115.79 3tim h ILE 150 Ca -0.00 -1.80 0.02 0.00 1.00 0.00 0.00 64.86 64.08 3tim h ILE 150 Cb 0.69 2.36 -0.05 0.00 -0.74 0.00 0.00 36.82 39.09 3tim h ILE 150 CO 0.05 0.52 0.63 0.00 0.00 0.00 0.00 178.15 179.35 3tim h ALA 151 N 0.41 1.35 -0.64 1.87 0.00 -1.10 -2.87 119.26 118.28 3tim h ALA 151 Ca -0.03 -0.05 0.19 0.00 0.00 0.00 0.00 54.91 55.01 3tim h ALA 151 Cb 1.04 -0.36 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 3tim h ALA 151 CO 0.08 0.57 0.53 0.87 0.00 0.00 0.00 179.25 181.31 3tim h LYS 152 N 1.25 0.00 -0.01 0.00 1.57 -1.42 -0.57 116.57 117.38 3tim h LYS 152 Ca 0.37 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.15 3tim h LYS 152 Cb -0.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.25 3tim h LYS 152 CO -0.10 0.00 -0.62 1.63 -0.57 0.00 0.00 179.45 179.79 3tim n LYS 153 N -4.04 0.73 -3.80 3.15 5.02 -1.09 -4.98 118.16 113.16 3tim n LYS 153 Ca 0.13 -0.59 -0.30 0.00 -2.02 0.00 0.00 58.31 55.53 3tim n LYS 153 Cb 0.78 -1.49 -0.04 0.00 -0.02 0.00 0.00 35.03 34.26 3tim n LYS 153 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3tim s LEU 154 N -2.67 4.30 -0.03 -0.35 1.02 -0.22 -4.91 118.68 115.81 3tim s LEU 154 Ca 0.15 0.39 -0.02 0.00 0.02 0.00 0.00 54.13 54.68 3tim s LEU 154 Cb 0.18 -3.11 -0.04 0.00 0.02 0.00 0.00 46.19 43.24 3tim s LEU 154 CO 0.67 0.08 0.09 -0.54 0.02 0.00 0.00 176.35 176.67 3tim s LYS 155 N -2.78 3.15 0.33 1.70 1.02 -1.26 -4.98 119.74 116.92 3tim s LYS 155 Ca 0.38 -0.41 0.10 0.00 0.02 0.00 0.00 55.97 56.06 3tim s LYS 155 Cb -0.12 -2.92 1.00 0.00 -0.52 0.00 0.00 37.83 35.27 3tim s LYS 155 CO 0.27 0.68 1.59 -0.22 -0.92 0.00 0.00 175.35 176.75 3tim h LYS 156 N 4.31 0.06 -0.09 1.68 3.64 -1.99 -0.75 116.57 123.44 3tim h LYS 156 Ca -0.50 -0.00 0.03 0.00 -1.27 0.00 0.00 60.65 58.91 3tim h LYS 156 Cb 1.19 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.96 3tim h LYS 156 CO 0.61 0.04 -0.14 0.00 -2.27 0.00 0.00 179.45 177.70 3tim h ALA 157 N 1.95 -0.08 -1.46 5.00 0.00 -2.03 -2.94 119.26 119.69 3tim h ALA 157 Ca 0.70 0.04 0.42 0.00 0.00 0.00 0.00 54.91 56.07 3tim h ALA 157 Cb 1.64 0.27 -0.06 0.00 0.00 0.00 0.00 17.79 19.63 3tim h ALA 157 CO -0.80 -0.60 1.12 -0.44 0.00 0.00 0.00 179.25 178.53 3tim h ASP 158 N -0.18 0.00 -0.23 0.00 3.45 -1.53 -1.96 116.42 115.98 3tim h ASP 158 Ca 0.08 0.00 0.07 0.00 0.43 0.00 0.00 57.03 57.60 3tim h ASP 158 Cb 0.29 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 39.05 3tim h ASP 158 CO -0.20 0.00 0.20 -0.50 -1.57 0.00 0.00 179.24 177.17 3tim h TRP 159 N 0.00 0.00 -0.34 4.55 4.06 -1.58 0.27 115.95 122.91 3tim h TRP 159 Ca 0.70 0.00 0.10 0.00 2.06 0.00 0.00 58.89 61.74 3tim h TRP 159 Cb 2.92 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 31.07 3tim h TRP 159 CO 0.00 0.00 0.35 0.00 -3.56 0.00 0.00 178.44 175.23 3tim h ALA 160 N 1.81 2.05 -0.00 1.49 0.00 -1.58 -1.07 119.26 121.96 3tim h ALA 160 Ca 0.11 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3tim h ALA 160 Cb 0.50 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.32 3tim h ALA 160 CO -0.00 -0.52 -0.67 1.63 0.00 0.00 0.00 179.25 179.69 3tim n LYS 161 N -3.83 0.37 -3.59 0.00 4.76 0.08 -4.96 118.16 110.99 3tim n LYS 161 Ca 0.05 -0.28 -0.37 0.00 -2.87 0.00 0.00 58.31 54.85 3tim n LYS 161 Cb 0.51 -1.49 -0.06 0.00 -1.84 0.00 0.00 35.03 32.15 3tim n LYS 161 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 3tim s VAL 162 N -2.82 5.12 -0.04 -0.18 1.01 -0.41 -1.51 120.40 121.58 3tim s VAL 162 Ca 0.13 0.61 0.02 0.00 0.00 0.00 0.00 61.98 62.74 3tim s VAL 162 Cb 0.17 -3.64 0.01 0.00 0.00 0.00 0.00 36.38 32.92 3tim s VAL 162 CO 0.72 0.49 -0.07 -0.69 0.00 0.00 0.00 175.10 175.55 3tim s VAL 163 N -1.18 0.65 -0.17 2.92 1.01 0.22 -4.55 120.40 119.31 3tim s VAL 163 Ca 0.25 -0.23 -0.06 0.00 0.00 0.00 0.00 61.98 61.94 3tim s VAL 163 Cb -0.15 -0.63 -0.04 0.00 0.00 0.00 0.00 36.38 35.56 3tim s VAL 163 CO 0.14 0.24 0.03 -0.63 0.00 0.00 0.00 175.10 174.88 3tim s ILE 164 N 0.62 4.55 -0.25 2.22 1.09 -0.46 -0.82 121.20 128.15 3tim s ILE 164 Ca -0.09 -0.12 0.03 0.00 -1.10 0.00 0.00 60.65 59.36 3tim s ILE 164 Cb -0.12 -3.03 0.06 0.00 -1.06 0.00 0.00 42.46 38.30 3tim s ILE 164 CO 0.01 0.48 -0.12 0.00 -0.10 0.00 0.00 174.94 175.21 3tim s ALA 165 N 0.31 2.52 -0.35 9.38 0.00 -0.42 0.84 121.76 134.04 3tim s ALA 165 Ca 0.01 -1.70 -0.22 0.00 0.00 0.00 0.00 51.96 50.06 3tim s ALA 165 Cb -0.13 -1.54 0.00 0.00 0.00 0.00 0.00 23.12 21.45 3tim s ALA 165 CO 0.01 -1.12 0.72 -0.47 0.00 0.00 0.00 175.76 174.90 3tim s TYR 166 N 1.13 3.15 -0.35 0.00 5.04 -0.49 -1.82 117.35 124.01 3tim s TYR 166 Ca -0.08 0.54 -0.11 0.00 -2.44 0.00 0.00 57.07 54.98 3tim s TYR 166 Cb -0.19 -3.25 0.01 0.00 0.35 0.00 0.00 41.96 38.88 3tim s TYR 166 CO -0.06 -0.65 0.20 -1.21 -1.34 0.00 0.00 175.55 172.49 3tim s GLU 167 N 2.91 3.08 -1.27 4.97 2.02 0.14 -0.52 118.70 130.03 3tim s GLU 167 Ca 0.29 -0.91 -0.19 0.00 0.02 0.00 0.00 54.97 54.18 3tim s GLU 167 Cb -0.14 -3.70 0.03 0.00 0.10 0.00 0.00 34.13 30.42 3tim s GLU 167 CO 0.15 -0.58 1.80 -0.35 0.02 0.00 0.00 175.26 176.30 3tim n PRO 168 N 5.01 2.76 0.21 0.39 -0.04 -1.26 -4.03 135.00 138.05 3tim n PRO 168 Ca -0.13 -3.05 0.06 0.00 -0.04 0.00 0.00 63.50 60.35 3tim n PRO 168 Cb 0.48 -3.56 0.55 0.00 -0.04 0.00 0.00 33.50 30.93 3tim n PRO 168 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 3tim h VAL 169 N 5.70 1.07 0.00 0.52 2.07 -1.81 0.10 116.25 123.90 3tim h VAL 169 Ca 0.39 -0.30 -0.00 0.00 0.82 0.00 0.00 66.70 67.61 3tim h VAL 169 Cb 0.88 1.09 -0.00 0.00 -1.52 0.00 0.00 31.29 31.75 3tim h VAL 169 CO 1.41 0.09 -0.00 4.11 0.02 0.00 0.00 177.57 183.20 3tim h TRP 170 N 0.07 0.00 0.00 1.57 5.08 -1.44 -1.33 115.95 119.89 3tim h TRP 170 Ca 0.02 0.00 -0.30 0.00 1.08 0.00 0.00 58.89 59.69 3tim h TRP 170 Cb 0.14 0.00 -0.05 0.00 -3.00 0.00 0.00 29.16 26.25 3tim h TRP 170 CO 0.00 0.00 -1.87 0.00 -1.28 0.00 0.00 178.44 175.29 3tim n ALA 171 N -2.09 1.56 -2.07 0.11 0.00 0.32 -4.63 120.51 113.71 3tim n ALA 171 Ca -0.03 -0.89 -0.42 0.00 0.00 0.00 0.00 53.44 52.09 3tim n ALA 171 Cb 0.08 -0.68 -0.03 0.00 0.00 0.00 0.00 19.45 18.82 3tim n ALA 171 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3tim s ILE 172 N -2.62 3.69 -1.42 0.00 -1.09 -0.50 -3.63 121.20 115.62 3tim s ILE 172 Ca -0.06 0.82 -0.03 0.00 -2.23 0.00 0.00 60.65 59.16 3tim s ILE 172 Cb 0.08 -3.55 0.00 0.00 -1.58 0.00 0.00 42.46 37.40 3tim s ILE 172 CO 0.83 -0.10 0.33 0.61 -1.23 0.00 0.00 174.94 175.37 3tim n GLY 173 N 4.14 -0.26 0.00 6.18 0.00 -1.26 -4.84 105.19 109.14 3tim n GLY 173 Ca 0.17 0.18 0.00 0.00 0.00 0.00 0.00 46.02 46.37 3tim n GLY 173 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3tim n THR 174 N -4.47 0.21 -3.01 2.61 -2.24 -1.24 -4.98 114.28 101.16 3tim n THR 174 Ca -0.30 -0.30 -0.11 0.00 -2.27 0.00 0.00 64.05 61.07 3tim n THR 174 Cb 0.68 1.18 0.04 0.00 -2.10 0.00 0.00 70.33 70.13 3tim n THR 174 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3tim n GLY 175 N -0.10 0.25 3.22 3.38 0.00 -1.26 -5.02 105.19 105.65 3tim n GLY 175 Ca 0.00 -0.24 -0.28 0.00 0.00 0.00 0.00 46.02 45.50 3tim n GLY 175 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3tim s LYS 176 N -5.60 1.80 -0.15 1.61 -0.14 -1.26 -5.12 119.74 110.88 3tim s LYS 176 Ca 0.27 -0.76 0.01 0.00 -1.36 0.00 0.00 55.97 54.13 3tim s LYS 176 Cb -0.12 -1.69 0.00 0.00 -1.68 0.00 0.00 37.83 34.34 3tim s LYS 176 CO 0.34 0.43 -0.16 0.08 -0.76 0.00 0.00 175.35 175.27 3tim s VAL 177 N -0.41 2.55 -0.07 3.17 1.01 -1.26 -4.75 120.40 120.63 3tim s VAL 177 Ca 0.06 -0.81 -0.16 0.00 0.00 0.00 0.00 61.98 61.07 3tim s VAL 177 Cb -0.09 -2.07 -0.05 0.00 0.00 0.00 0.00 36.38 34.17 3tim s VAL 177 CO -0.00 0.52 0.41 0.00 0.00 0.00 0.00 175.10 176.03 3tim s ALA 178 N 0.82 3.60 0.15 5.51 0.00 -1.26 -5.07 121.76 125.51 3tim s ALA 178 Ca -0.05 -0.25 0.01 0.00 0.00 0.00 0.00 51.96 51.67 3tim s ALA 178 Cb -0.15 -2.48 -0.04 0.00 0.00 0.00 0.00 23.12 20.44 3tim s ALA 178 CO -0.01 0.23 0.30 0.95 0.00 0.00 0.00 175.76 177.24 3tim s THR 179 N -0.16 5.30 0.32 0.00 -4.23 -1.26 -4.98 115.64 110.62 3tim s THR 179 Ca 0.23 -0.54 0.08 0.00 -1.18 0.00 0.00 61.69 60.28 3tim s THR 179 Cb -0.15 -3.72 0.31 0.00 1.34 0.00 0.00 72.50 70.27 3tim s THR 179 CO 0.10 -0.08 1.76 -0.65 -0.54 0.00 0.00 174.62 175.21 3tim h PRO 180 N 2.25 0.65 -0.19 3.99 0.11 -1.97 0.11 132.00 136.94 3tim h PRO 180 Ca -0.48 -0.04 0.05 0.00 0.11 0.00 0.00 66.00 65.64 3tim h PRO 180 Cb 1.19 -0.15 -0.05 0.00 0.11 0.00 0.00 31.00 32.11 3tim h PRO 180 CO 0.70 0.43 -0.11 -0.56 -0.21 0.00 0.00 178.00 178.25 3tim h GLN 181 N 0.66 -0.09 -0.61 1.05 3.07 -1.97 -1.64 115.11 115.59 3tim h GLN 181 Ca 0.61 0.01 -0.01 0.00 0.09 0.00 0.00 58.65 59.34 3tim h GLN 181 Cb 1.07 0.02 -0.03 0.00 0.08 0.00 0.00 27.48 28.62 3tim h GLN 181 CO -0.42 -0.06 0.32 1.96 0.09 0.00 0.00 178.83 180.73 3tim h GLN 182 N -0.09 0.85 0.70 0.06 4.20 -1.21 -2.50 115.11 117.11 3tim h GLN 182 Ca 0.11 -0.09 -0.03 0.00 0.06 0.00 0.00 58.65 58.69 3tim h GLN 182 Cb 0.25 -0.17 0.01 0.00 0.30 0.00 0.00 27.48 27.87 3tim h GLN 182 CO -0.25 0.63 -0.33 0.00 -0.67 0.00 0.00 178.83 178.21 3tim h ALA 183 N 1.50 -0.94 -0.86 3.87 0.00 -0.98 -3.19 119.26 118.66 3tim h ALA 183 Ca 0.22 -0.22 0.20 0.00 0.00 0.00 0.00 54.91 55.11 3tim h ALA 183 Cb 0.04 0.36 -0.12 0.00 0.00 0.00 0.00 17.79 18.08 3tim h ALA 183 CO -0.03 -0.90 0.37 0.37 0.00 0.00 0.00 179.25 179.05 3tim h GLN 184 N -1.19 0.41 -0.77 0.00 5.75 -1.17 0.46 115.11 118.60 3tim h GLN 184 Ca -0.10 -0.02 0.03 0.00 -0.15 0.00 0.00 58.65 58.41 3tim h GLN 184 Cb 0.74 -0.09 -0.05 0.00 1.07 0.00 0.00 27.48 29.15 3tim h GLN 184 CO 0.16 0.27 0.49 0.93 -2.65 0.00 0.00 178.83 178.03 3tim h GLU 185 N 0.42 0.93 -0.07 1.69 5.08 -1.49 0.13 114.58 121.28 3tim h GLU 185 Ca 0.52 -0.06 -0.22 0.00 -1.00 0.00 0.00 59.36 58.60 3tim h GLU 185 Cb 0.93 -0.21 0.01 0.00 0.50 0.00 0.00 28.75 29.98 3tim h GLU 185 CO -0.49 0.62 -0.86 0.00 -1.00 0.00 0.00 179.01 177.27 3tim h ALA 186 N 1.32 0.35 -0.31 3.43 0.00 -1.22 -1.46 119.26 121.38 3tim h ALA 186 Ca 0.31 -0.65 -0.07 0.00 0.00 0.00 0.00 54.91 54.50 3tim h ALA 186 Cb 0.01 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 3tim h ALA 186 CO -0.11 0.73 -0.12 0.45 0.00 0.00 0.00 179.25 180.21 3tim h HIS 187 N 0.38 0.57 -0.13 0.00 3.86 -0.47 -2.52 115.15 116.84 3tim h HIS 187 Ca -0.07 -0.09 -0.15 0.00 -1.16 0.00 0.00 60.37 58.91 3tim h HIS 187 Cb 1.48 -0.15 -0.01 0.00 1.06 0.00 0.00 27.41 29.79 3tim h HIS 187 CO 0.07 0.63 -0.55 0.00 0.86 0.00 0.00 177.93 178.95 3tim h ALA 188 N 1.39 0.82 0.36 2.45 0.00 -0.68 -1.45 119.26 122.15 3tim h ALA 188 Ca 0.09 -0.51 -0.02 0.00 0.00 0.00 0.00 54.91 54.47 3tim h ALA 188 Cb 0.50 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.20 3tim h ALA 188 CO 0.03 0.69 -0.17 1.25 0.00 0.00 0.00 179.25 181.05 3tim h LEU 189 N 0.30 -0.41 -0.48 0.00 6.46 -1.02 -0.81 115.31 119.35 3tim h LEU 189 Ca 0.01 -0.08 0.06 0.00 -0.12 0.00 0.00 57.88 57.74 3tim h LEU 189 Cb 1.05 0.11 -0.05 0.00 -0.73 0.00 0.00 40.66 41.04 3tim h LEU 189 CO 0.09 -0.16 0.19 0.40 -0.62 0.00 0.00 178.44 178.35 3tim h ILE 190 N -0.65 0.87 -0.88 4.05 2.04 -1.32 -0.49 117.51 121.14 3tim h ILE 190 Ca -0.05 -0.13 0.07 0.00 1.00 0.00 0.00 64.86 65.75 3tim h ILE 190 Cb 0.46 0.46 -0.06 0.00 -0.74 0.00 0.00 36.82 36.94 3tim h ILE 190 CO 0.08 0.07 0.55 -0.09 0.00 0.00 0.00 178.15 178.76 3tim h ARG 191 N 0.38 0.95 -0.62 2.37 9.65 -1.19 -0.51 114.38 125.41 3tim h ARG 191 Ca 0.23 -0.06 0.10 0.00 -1.10 0.00 0.00 59.98 59.15 3tim h ARG 191 Cb 0.21 -0.21 -0.08 0.00 -1.39 0.00 0.00 29.97 28.50 3tim h ARG 191 CO -0.21 0.63 0.22 0.77 2.80 0.00 0.00 179.97 184.17 3tim h SER 192 N 0.98 0.19 0.24 -3.80 0.02 0.36 0.44 113.55 111.99 3tim h SER 192 Ca 0.39 0.09 -0.13 0.00 -0.84 0.00 0.00 61.79 61.29 3tim h SER 192 Cb 0.21 0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.82 3tim h SER 192 CO -0.19 0.11 -0.52 -0.25 -1.14 0.00 0.00 176.83 174.84 3tim h TRP 193 N 0.38 0.38 0.09 3.45 7.01 0.14 -0.38 115.95 127.03 3tim h TRP 193 Ca 0.32 -0.13 -0.00 0.00 2.11 0.00 0.00 58.89 61.19 3tim h TRP 193 Cb 0.43 -0.07 0.00 0.00 -2.10 0.00 0.00 29.16 27.41 3tim h TRP 193 CO -0.18 0.77 -0.04 0.28 -2.79 0.00 0.00 178.44 176.47 3tim h VAL 194 N 0.24 1.15 -0.97 2.65 2.07 -0.17 -1.74 116.25 119.49 3tim h VAL 194 Ca 0.01 -1.10 0.19 0.00 0.82 0.00 0.00 66.70 66.62 3tim h VAL 194 Cb 1.00 1.84 -0.11 0.00 -1.52 0.00 0.00 31.29 32.50 3tim h VAL 194 CO 0.08 0.26 0.56 -1.28 0.02 0.00 0.00 177.57 177.21 3tim h SER 195 N -0.65 0.68 0.38 0.57 0.87 -0.99 0.39 113.55 114.81 3tim h SER 195 Ca -0.01 0.11 -0.02 0.00 -1.23 0.00 0.00 61.79 60.64 3tim h SER 195 Cb 0.52 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.48 3tim h SER 195 CO 0.02 0.22 -0.18 0.28 -0.53 0.00 0.00 176.83 176.64 3tim h SER 196 N 0.68 -0.43 -0.63 6.23 0.02 -1.00 -3.24 113.55 115.18 3tim h SER 196 Ca 0.57 0.01 -0.07 0.00 -0.84 0.00 0.00 61.79 61.46 3tim h SER 196 Cb 0.91 0.11 -0.03 0.00 0.14 0.00 0.00 62.40 63.54 3tim h SER 196 CO -0.41 -0.09 0.11 0.11 -1.14 0.00 0.00 176.83 175.42 3tim h LYS 197 N -0.95 1.04 0.00 3.45 6.56 -1.02 -3.39 116.57 122.25 3tim h LYS 197 Ca -0.05 -0.27 -0.36 0.00 -1.06 0.00 0.00 60.65 58.90 3tim h LYS 197 Cb 0.39 -0.12 -0.06 0.00 -0.57 0.00 0.00 32.23 31.87 3tim h LYS 197 CO 0.09 0.96 -2.23 -0.89 -2.06 0.00 0.00 179.45 175.32 3tim n ILE 198 N -4.27 1.21 0.00 1.86 -0.00 0.13 -5.07 119.36 113.22 3tim n ILE 198 Ca 0.04 -0.34 0.00 0.00 -0.00 0.00 0.00 62.75 62.45 3tim n ILE 198 Cb 0.28 -1.70 0.00 0.00 -0.00 0.00 0.00 39.64 38.22 3tim n ILE 198 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 3tim n GLY 199 N 1.77 4.38 0.30 7.39 0.00 -0.78 -4.97 105.19 113.28 3tim n GLY 199 Ca -0.43 -0.87 0.16 0.00 0.00 0.00 0.00 46.02 44.89 3tim n GLY 199 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3tim h ALA 200 N 0.00 1.37 -0.39 4.61 0.00 -1.81 -2.68 119.26 120.36 3tim h ALA 200 Ca 0.00 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 3tim h ALA 200 Cb 0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3tim h ALA 200 CO 0.00 0.02 -0.12 0.38 0.00 0.00 0.00 179.25 179.53 3tim h ASP 201 N 0.00 0.79 -0.29 0.00 -0.00 -1.93 -1.91 116.42 113.07 3tim h ASP 201 Ca -0.00 -0.38 -0.17 0.00 -0.00 0.00 0.00 57.03 56.48 3tim h ASP 201 Cb 0.06 -0.22 -0.00 0.00 -0.00 0.00 0.00 39.33 39.17 3tim h ASP 201 CO 0.00 0.99 -0.46 0.58 -0.00 0.00 0.00 179.24 180.35 3tim h VAL 202 N 0.59 1.28 -0.60 4.15 2.07 -1.86 -2.78 116.25 119.09 3tim h VAL 202 Ca 0.10 -1.64 -0.00 0.00 0.82 0.00 0.00 66.70 65.97 3tim h VAL 202 Cb 0.66 1.51 -0.03 0.00 -1.52 0.00 0.00 31.29 31.91 3tim h VAL 202 CO 0.04 0.54 0.36 -0.09 0.02 0.00 0.00 177.57 178.45 3tim h ARG 203 N 0.69 0.82 0.00 1.57 1.12 -1.45 0.27 114.38 117.40 3tim h ARG 203 Ca 0.04 -0.08 -0.05 0.00 -1.11 0.00 0.00 59.98 58.78 3tim h ARG 203 Cb 1.05 -0.17 -0.01 0.00 -0.01 0.00 0.00 29.97 30.83 3tim h ARG 203 CO 0.10 0.59 -0.24 0.78 -3.11 0.00 0.00 179.97 178.10 3tim h GLY 204 N 0.82 0.00 0.83 2.80 0.00 -1.21 -2.74 103.07 103.56 3tim h GLY 204 Ca 0.22 0.00 -0.23 0.00 0.00 0.00 0.00 47.33 47.32 3tim h GLY 204 CO -0.04 0.00 -1.66 1.18 0.00 0.00 0.00 176.54 176.02 3tim n GLU 205 N -3.43 0.63 -1.69 4.80 -0.58 -0.98 -4.67 120.64 114.71 3tim n GLU 205 Ca -0.00 0.21 -0.42 0.00 -0.42 0.00 0.00 57.16 56.53 3tim n GLU 205 Cb 0.43 -1.76 0.00 0.00 -0.57 0.00 0.00 31.44 29.54 3tim n GLU 205 CO 0.00 0.00 0.00 -0.11 -0.48 0.00 0.00 177.13 176.54 3tim n LEU 206 N -2.90 3.74 -4.25 -4.62 7.94 0.90 -4.87 117.00 112.94 3tim n LEU 206 Ca -0.15 1.15 -0.38 0.00 -1.11 0.00 0.00 56.01 55.52 3tim n LEU 206 Cb 0.94 -1.48 -0.12 0.00 0.53 0.00 0.00 43.42 43.29 3tim n LEU 206 CO 0.44 -0.63 -0.24 -0.13 -1.11 0.00 0.00 177.39 175.72 3tim s ARG 207 N -2.06 2.55 -0.36 1.96 0.52 -1.26 -4.91 118.95 115.40 3tim s ARG 207 Ca 0.59 -1.27 -0.08 0.00 -0.52 0.00 0.00 55.73 54.45 3tim s ARG 207 Cb -0.54 -3.48 0.04 0.00 0.52 0.00 0.00 34.95 31.50 3tim s ARG 207 CO 0.60 -0.72 0.16 0.42 0.02 0.00 0.00 175.30 175.77 3tim s ILE 208 N 1.37 4.04 0.47 1.52 1.01 -1.25 -1.36 121.20 127.00 3tim s ILE 208 Ca -0.01 -1.12 -0.06 0.00 0.00 0.00 0.00 60.65 59.46 3tim s ILE 208 Cb -0.20 -3.32 -0.04 0.00 0.01 0.00 0.00 42.46 38.91 3tim s ILE 208 CO 0.02 -0.25 0.78 -0.76 0.00 0.00 0.00 174.94 174.73 3tim s LEU 209 N 1.44 3.65 -0.28 2.97 1.43 0.25 -1.01 118.68 127.12 3tim s LEU 209 Ca 0.00 0.94 -0.06 0.00 -1.03 0.00 0.00 54.13 53.98 3tim s LEU 209 Cb -0.20 -3.89 0.00 0.00 0.03 0.00 0.00 46.19 42.13 3tim s LEU 209 CO 0.04 -0.56 0.06 -0.47 0.23 0.00 0.00 176.35 175.64 3tim s TYR 210 N -2.70 3.12 -0.31 0.29 6.14 -0.10 -1.40 117.35 122.39 3tim s TYR 210 Ca 0.48 -0.95 0.11 0.00 0.64 0.00 0.00 57.07 57.34 3tim s TYR 210 Cb -0.10 -2.22 0.72 0.00 0.42 0.00 0.00 41.96 40.77 3tim s TYR 210 CO 0.44 -0.56 1.75 0.41 0.64 0.00 0.00 175.55 178.23 3tim n GLY 211 N 4.85 3.77 1.86 8.97 0.00 0.33 -1.69 105.19 123.27 3tim n GLY 211 Ca -0.15 -1.02 -0.13 0.00 0.00 0.00 0.00 46.02 44.71 3tim n GLY 211 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3tim n GLY 212 N -0.24 -0.82 3.59 -0.02 0.00 -1.26 -4.67 105.19 101.77 3tim n GLY 212 Ca 0.38 -1.76 -0.43 0.00 0.00 0.00 0.00 46.02 44.22 3tim n GLY 212 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3tim s SER 213 N -3.25 6.20 0.20 1.61 1.04 -1.26 -4.75 113.70 113.49 3tim s SER 213 Ca 0.35 0.77 0.10 0.00 0.48 0.00 0.00 55.95 57.65 3tim s SER 213 Cb -0.01 -2.54 -0.04 0.00 0.10 0.00 0.00 66.02 63.53 3tim s SER 213 CO 0.24 -1.56 -0.13 -0.69 0.98 0.00 0.00 173.24 172.09 3tim s VAL 214 N 5.87 2.97 0.18 5.02 1.01 -1.26 -5.01 120.40 129.18 3tim s VAL 214 Ca 0.62 -1.81 -0.24 0.00 0.00 0.00 0.00 61.98 60.55 3tim s VAL 214 Cb -0.14 -2.48 0.05 0.00 0.00 0.00 0.00 36.38 33.81 3tim s VAL 214 CO 0.31 -0.15 0.89 0.54 0.00 0.00 0.00 175.10 176.69 3tim s ASN 215 N -2.91 -0.22 0.44 3.32 2.20 -1.26 -4.65 114.94 111.87 3tim s ASN 215 Ca 0.25 -0.42 0.33 0.00 -0.94 0.00 0.00 52.86 52.08 3tim s ASN 215 Cb -0.08 0.54 1.49 0.00 -2.00 0.00 0.00 41.25 41.20 3tim s ASN 215 CO 0.14 -1.00 1.54 0.61 -2.94 0.00 0.00 177.10 175.46 3tim n GLY 216 N -0.46 -0.84 0.00 0.45 0.00 -1.26 -1.99 105.19 101.10 3tim n GLY 216 Ca -0.06 0.75 0.00 0.00 0.00 0.00 0.00 46.02 46.71 3tim n GLY 216 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3tim n LYS 217 N -4.64 0.00 0.24 1.61 5.02 -1.26 -4.32 118.16 114.81 3tim n LYS 217 Ca 0.40 0.41 0.16 0.00 -2.02 0.00 0.00 58.31 57.26 3tim n LYS 217 Cb 1.58 -0.97 0.83 0.00 -0.02 0.00 0.00 35.03 36.44 3tim n LYS 217 CO 0.00 0.00 0.00 -2.95 -0.52 0.00 0.00 177.40 173.93 3tim h ASN 218 N 0.00 0.00 -0.25 4.39 -1.07 -1.96 -3.25 115.58 113.43 3tim h ASN 218 Ca 0.00 0.00 0.04 0.00 0.07 0.00 0.00 56.30 56.41 3tim h ASN 218 Cb 0.00 0.00 -0.04 0.00 -2.07 0.00 0.00 38.32 36.21 3tim h ASN 218 CO 0.00 0.00 0.01 0.00 0.07 0.00 0.00 177.43 177.51 3tim h ALA 219 N 2.03 0.23 -0.79 4.14 0.00 -1.59 -3.12 119.26 120.17 3tim h ALA 219 Ca 0.00 0.06 0.07 0.00 0.00 0.00 0.00 54.91 55.05 3tim h ALA 219 Cb 0.11 0.10 -0.09 0.00 0.00 0.00 0.00 17.79 17.91 3tim h ALA 219 CO 0.00 -0.41 -0.47 -2.13 0.00 0.00 0.00 179.25 176.25 3tim n ARG 220 N -5.13 -0.35 -0.31 0.00 0.63 -1.23 -2.08 116.66 108.19 3tim n ARG 220 Ca -0.01 1.36 -0.02 0.00 -0.92 0.00 0.00 57.85 58.25 3tim n ARG 220 Cb 0.13 -2.00 0.14 0.00 0.45 0.00 0.00 32.46 31.17 3tim n ARG 220 CO 0.00 0.00 0.00 1.79 -2.51 0.00 0.00 177.63 176.91 3tim h THR 221 N 0.00 1.24 -0.01 5.15 1.35 -1.79 -3.05 112.91 115.81 3tim h THR 221 Ca 0.13 -0.55 -0.00 0.00 -0.55 0.00 0.00 66.41 65.44 3tim h THR 221 Cb 0.32 0.01 -0.00 0.00 -1.73 0.00 0.00 68.15 66.76 3tim h THR 221 CO -0.74 0.26 -0.00 -0.07 -0.25 0.00 0.00 175.52 174.71 3tim h LEU 222 N 1.21 0.02 -2.17 3.87 3.38 -1.41 -3.07 115.31 117.15 3tim h LEU 222 Ca 0.31 -0.38 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 3tim h LEU 222 Cb -0.04 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 40.70 3tim h LEU 222 CO -0.06 0.39 -0.06 0.22 0.09 0.00 0.00 178.44 179.03 3tim h TYR 223 N -0.36 0.00 -0.07 1.13 5.03 -1.34 -1.71 116.97 119.65 3tim h TYR 223 Ca 0.00 0.00 0.02 0.00 2.58 0.00 0.00 58.73 61.33 3tim h TYR 223 Cb 0.39 0.00 -0.00 0.00 1.55 0.00 0.00 36.73 38.66 3tim h TYR 223 CO 0.06 0.06 0.08 1.96 -1.32 0.00 0.00 178.16 179.00 3tim h GLN 224 N 0.00 0.00 -6.99 1.82 4.20 -1.43 -3.44 115.11 109.27 3tim h GLN 224 Ca -0.00 0.00 -0.53 0.00 0.06 0.00 0.00 58.65 58.18 3tim h GLN 224 Cb 0.14 0.00 0.10 0.00 0.30 0.00 0.00 27.48 28.02 3tim h GLN 224 CO 0.01 0.00 0.59 -0.65 -0.67 0.00 0.00 178.83 178.11 3tim s GLN 225 N -4.65 3.66 0.48 1.46 -1.52 -0.65 -4.92 119.66 113.53 3tim s GLN 225 Ca -0.05 2.12 0.33 0.00 -1.95 0.00 0.00 55.36 55.80 3tim s GLN 225 Cb 0.15 -2.53 1.64 0.00 -0.22 0.00 0.00 33.01 32.05 3tim s GLN 225 CO 0.55 -0.73 1.99 -0.09 -0.25 0.00 0.00 175.29 176.76 3tim h ARG 226 N 2.16 0.00 0.00 2.91 9.65 -1.88 -3.21 114.38 124.01 3tim h ARG 226 Ca -0.50 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.38 3tim h ARG 226 Cb 1.26 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.84 3tim h ARG 226 CO 0.60 0.00 -0.02 -0.25 2.80 0.00 0.00 179.97 183.10 3tim n ASP 227 N -2.70 1.64 -4.39 -3.80 8.00 -1.26 -4.95 116.55 109.08 3tim n ASP 227 Ca -0.01 -2.02 -0.39 0.00 0.71 0.00 0.00 54.79 53.08 3tim n ASP 227 Cb 0.13 -0.08 -0.12 0.00 -0.02 0.00 0.00 41.12 41.03 3tim n ASP 227 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3tim s VAL 228 N -1.11 4.45 -0.43 2.53 1.01 -1.21 -4.68 120.40 120.96 3tim s VAL 228 Ca 0.05 -0.64 0.05 0.00 0.00 0.00 0.00 61.98 61.43 3tim s VAL 228 Cb 0.05 -3.35 0.55 0.00 0.00 0.00 0.00 36.38 33.62 3tim s VAL 228 CO 0.00 -0.04 1.73 0.59 0.00 0.00 0.00 175.10 177.38 3tim n ASN 229 N 4.96 4.23 0.00 3.32 5.03 -0.18 -4.83 115.26 127.79 3tim n ASN 229 Ca -0.13 -3.72 0.00 0.00 0.87 0.00 0.00 54.58 51.59 3tim n ASN 229 Cb 0.48 -0.76 0.00 0.00 -1.02 0.00 0.00 39.78 38.48 3tim n ASN 229 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3tim n GLY 230 N -1.06 0.60 3.15 7.41 0.00 -1.26 -2.18 105.19 111.85 3tim n GLY 230 Ca 0.50 -2.12 -0.17 0.00 0.00 0.00 0.00 46.02 44.24 3tim n GLY 230 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3tim s PHE 231 N -0.97 1.09 -0.57 1.61 0.08 -0.34 -0.92 117.98 117.96 3tim s PHE 231 Ca 0.00 -0.48 -0.03 0.00 0.12 0.00 0.00 56.93 56.54 3tim s PHE 231 Cb 0.00 -0.62 0.15 0.00 -0.57 0.00 0.00 43.02 41.98 3tim s PHE 231 CO 0.00 0.02 0.38 -1.17 -0.10 0.00 0.00 175.22 174.35 3tim s LEU 232 N -1.77 5.23 0.06 -0.37 2.96 -0.68 -0.66 118.68 123.45 3tim s LEU 232 Ca -0.03 -2.65 -0.15 0.00 -0.22 0.00 0.00 54.13 51.07 3tim s LEU 232 Cb -0.09 -1.85 -0.06 0.00 0.50 0.00 0.00 46.19 44.69 3tim s LEU 232 CO 0.02 -0.41 0.48 -0.69 -1.32 0.00 0.00 176.35 174.42 3tim s VAL 233 N 0.23 4.93 0.00 1.68 1.01 -0.23 -4.35 120.40 123.67 3tim s VAL 233 Ca 0.15 0.88 0.00 0.00 0.00 0.00 0.00 61.98 63.01 3tim s VAL 233 Cb -0.21 -3.75 0.00 0.00 0.00 0.00 0.00 36.38 32.42 3tim s VAL 233 CO -0.03 0.46 0.00 0.61 0.00 0.00 0.00 175.10 176.14 3tim n GLY 234 N 1.46 1.14 0.37 4.51 0.00 -1.26 -1.83 105.19 109.58 3tim n GLY 234 Ca -0.10 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.89 3tim n GLY 234 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3tim h GLY 235 N 0.00 -0.02 1.52 -0.02 0.00 -1.92 -2.63 103.07 100.00 3tim h GLY 235 Ca 0.00 0.48 0.00 0.00 0.00 0.00 0.00 47.33 47.81 3tim h GLY 235 CO 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 176.54 176.34 3tim n ALA 236 N -3.32 1.73 1.48 3.60 0.00 -1.26 -2.13 120.51 120.60 3tim n ALA 236 Ca 0.07 -0.06 0.15 0.00 0.00 0.00 0.00 53.44 53.61 3tim n ALA 236 Cb 0.38 -1.19 0.77 0.00 0.00 0.00 0.00 19.45 19.41 3tim n ALA 236 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3tim n SER 237 N -1.26 0.01 -0.00 0.00 3.41 -0.99 -2.58 113.62 112.21 3tim n SER 237 Ca 0.06 -0.24 0.09 0.00 -0.26 0.00 0.00 58.87 58.52 3tim n SER 237 Cb 0.09 -0.25 -0.12 0.00 -0.26 0.00 0.00 64.21 63.67 3tim n SER 237 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3tim n LEU 238 N -1.25 0.68 -4.83 1.04 4.77 -0.91 -4.90 117.00 111.60 3tim n LEU 238 Ca 0.15 -0.38 -0.22 0.00 -0.03 0.00 0.00 56.01 55.53 3tim n LEU 238 Cb 0.23 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.27 3tim n LEU 238 CO 0.23 0.17 -0.06 -0.54 -1.33 0.00 0.00 177.39 175.86 3tim s LYS 239 N -2.90 2.44 0.00 3.23 3.01 -1.07 -5.00 119.74 119.45 3tim s LYS 239 Ca 0.04 -1.63 0.22 0.00 -1.01 0.00 0.00 55.97 53.59 3tim s LYS 239 Cb 0.14 -2.25 1.09 0.00 -1.01 0.00 0.00 37.83 35.80 3tim s LYS 239 CO 0.78 -0.15 1.70 -2.30 0.51 0.00 0.00 175.35 175.89 3tim n PRO 240 N -1.43 0.29 0.22 -1.68 -0.02 -1.26 -2.60 135.00 128.51 3tim n PRO 240 Ca 0.02 0.08 0.05 0.00 -2.02 0.00 0.00 63.50 61.63 3tim n PRO 240 Cb 0.63 -1.50 0.51 0.00 -0.02 0.00 0.00 33.50 33.11 3tim n PRO 240 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3tim h GLU 241 N 0.00 0.01 -1.04 -0.52 5.08 -1.96 -2.04 114.58 114.11 3tim h GLU 241 Ca 0.00 -0.00 0.27 0.00 -1.00 0.00 0.00 59.36 58.63 3tim h GLU 241 Cb 0.22 -0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.38 3tim h GLU 241 CO 0.00 0.18 0.68 0.35 -1.00 0.00 0.00 179.01 179.22 3tim h PHE 242 N 0.01 0.58 0.40 4.33 3.57 -1.23 0.19 116.94 124.79 3tim h PHE 242 Ca 0.00 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.51 3tim h PHE 242 Cb 0.30 -0.17 -0.00 0.00 2.79 0.00 0.00 35.95 38.87 3tim h PHE 242 CO 0.00 0.06 -0.23 0.28 -2.23 0.00 0.00 178.31 176.19 3tim h VAL 243 N 0.35 0.53 -0.98 1.41 2.07 -1.61 -0.84 116.25 117.18 3tim h VAL 243 Ca 0.58 0.00 0.19 0.00 0.82 0.00 0.00 66.70 68.30 3tim h VAL 243 Cb 1.57 0.53 -0.11 0.00 -1.52 0.00 0.00 31.29 31.76 3tim h VAL 243 CO -0.26 0.00 0.57 0.44 0.02 0.00 0.00 177.57 178.34 3tim h ASP 244 N -0.59 0.71 -0.56 0.57 5.19 -0.79 -1.60 116.42 119.35 3tim h ASP 244 Ca -0.05 0.11 -0.08 0.00 -0.62 0.00 0.00 57.03 56.39 3tim h ASP 244 Cb 0.47 -0.02 -0.02 0.00 0.18 0.00 0.00 39.33 39.95 3tim h ASP 244 CO 0.06 0.23 0.03 0.40 -3.12 0.00 0.00 179.24 176.84 3tim h ILE 245 N 0.70 1.26 -0.42 0.35 2.04 -0.78 -1.31 117.51 119.34 3tim h ILE 245 Ca 0.57 -1.07 0.02 0.00 1.00 0.00 0.00 64.86 65.38 3tim h ILE 245 Cb 0.92 0.86 -0.03 0.00 -0.74 0.00 0.00 36.82 37.83 3tim h ILE 245 CO -0.40 0.39 0.24 0.40 0.00 0.00 0.00 178.15 178.77 3tim h ILE 246 N 0.85 1.03 0.00 -0.67 2.04 -0.22 -1.88 117.51 118.66 3tim h ILE 246 Ca 0.16 -0.17 0.00 0.00 1.00 0.00 0.00 64.86 65.86 3tim h ILE 246 Cb 0.50 0.50 0.00 0.00 -0.74 0.00 0.00 36.82 37.08 3tim h ILE 246 CO 0.02 0.09 0.00 2.29 0.00 0.00 0.00 178.15 180.55 3tim n LYS 247 N -4.86 0.07 0.00 2.37 2.85 -0.83 -0.88 118.16 116.88 3tim n LYS 247 Ca 0.02 0.28 0.11 0.00 -1.05 0.00 0.00 58.31 57.67 3tim n LYS 247 Cb 0.07 -1.63 0.55 0.00 -0.65 0.00 0.00 35.03 33.37 3tim n LYS 247 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 3tim n ALA 248 N -1.60 2.13 1.19 0.58 0.00 -0.51 -3.27 120.51 119.04 3tim n ALA 248 Ca 0.03 -0.10 0.05 0.00 0.00 0.00 0.00 53.44 53.43 3tim n ALA 248 Cb 0.22 -1.36 0.33 0.00 0.00 0.00 0.00 19.45 18.63 3tim n ALA 248 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3tim n THR 249 N -1.31 0.00 0.00 0.00 -2.24 -0.06 -4.71 114.28 105.97 3tim n THR 249 Ca 0.10 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.88 3tim n THR 249 Cb 0.19 -0.49 0.00 0.00 -2.10 0.00 0.00 70.33 67.93 3tim n THR 249 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50