#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dtp h ALA 2 N 0.00 0.96 0.00 4.61 0.00 -1.85 -3.32 119.26 119.66 1dtp h ALA 2 Ca 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1dtp h ALA 2 Cb 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1dtp h ALA 2 CO 0.00 0.62 0.32 0.22 0.00 0.00 0.00 179.25 180.41 1dtp h ASP 3 N 0.37 0.00 -0.05 0.00 3.58 -1.87 -1.98 116.42 116.47 1dtp h ASP 3 Ca 0.03 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.48 1dtp h ASP 3 Cb 0.86 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.91 1dtp h ASP 3 CO 0.07 0.00 0.00 -0.67 -2.88 0.00 0.00 179.24 175.76 1dtp n ASP 4 N -2.51 2.51 0.00 2.28 -0.08 -1.25 -4.21 116.55 113.29 1dtp n ASP 4 Ca -0.01 -2.78 0.00 0.00 -1.51 0.00 0.00 54.79 50.48 1dtp n ASP 4 Cb 0.35 -0.34 0.00 0.00 2.34 0.00 0.00 41.12 43.47 1dtp n ASP 4 CO 0.00 0.00 0.00 0.52 0.12 0.00 0.00 177.20 177.84 1dtp n VAL 5 N -1.00 0.00 -4.73 5.18 0.31 -0.89 -4.84 118.33 112.36 1dtp n VAL 5 Ca 0.13 0.00 -0.25 0.00 -0.01 0.00 0.00 64.34 64.20 1dtp n VAL 5 Cb 0.58 0.09 -0.16 0.00 -0.91 0.00 0.00 33.84 33.44 1dtp n VAL 5 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1dtp s VAL 6 N -0.52 1.31 -0.49 2.52 1.01 -0.80 0.29 120.40 123.72 1dtp s VAL 6 Ca 0.00 -0.62 -0.24 0.00 0.00 0.00 0.00 61.98 61.13 1dtp s VAL 6 Cb 0.00 -1.15 0.03 0.00 0.00 0.00 0.00 36.38 35.26 1dtp s VAL 6 CO 0.00 0.39 0.87 -0.62 0.00 0.00 0.00 175.10 175.74 1dtp s ASP 7 N 0.32 6.40 0.48 3.32 -1.08 0.46 -4.69 116.67 121.87 1dtp s ASP 7 Ca -0.09 -0.18 0.27 0.00 -0.52 0.00 0.00 52.55 52.04 1dtp s ASP 7 Cb -0.13 -2.42 1.04 0.00 -1.46 0.00 0.00 42.92 39.95 1dtp s ASP 7 CO 0.03 -1.06 1.87 0.77 0.52 0.00 0.00 175.17 177.30 1dtp h SER 8 N 9.13 0.00 -0.16 -0.34 4.64 -1.90 -2.90 113.55 122.01 1dtp h SER 8 Ca -0.25 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.07 1dtp h SER 8 Cb 1.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.17 1dtp h SER 8 CO 1.02 0.13 0.00 -1.54 -0.87 0.00 0.00 176.83 175.57 1dtp n SER 9 N -3.25 1.05 -1.07 4.97 3.41 -1.26 -2.63 113.62 114.84 1dtp n SER 9 Ca 0.01 -2.03 0.04 0.00 -0.26 0.00 0.00 58.87 56.63 1dtp n SER 9 Cb 0.39 -0.17 0.08 0.00 -0.26 0.00 0.00 64.21 64.25 1dtp n SER 9 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1dtp n LYS 10 N 0.01 0.50 -4.39 4.33 4.76 -1.10 -5.07 118.16 117.21 1dtp n LYS 10 Ca 0.06 -2.27 -0.27 0.00 -2.87 0.00 0.00 58.31 52.96 1dtp n LYS 10 Cb 0.18 -0.58 -0.12 0.00 -1.84 0.00 0.00 35.03 32.67 1dtp n LYS 10 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 1dtp s SER 11 N -2.27 3.25 0.24 4.39 0.01 -1.08 -4.46 113.70 113.78 1dtp s SER 11 Ca 0.31 -0.81 -0.22 0.00 1.31 0.00 0.00 55.95 56.54 1dtp s SER 11 Cb 0.33 -0.22 0.05 0.00 0.21 0.00 0.00 66.02 66.39 1dtp s SER 11 CO -0.11 0.12 0.86 0.72 0.41 0.00 0.00 173.24 175.24 1dtp s PHE 12 N -1.44 -0.10 0.12 2.43 -0.12 -1.21 -5.01 117.98 112.65 1dtp s PHE 12 Ca 0.17 -0.33 0.10 0.00 -0.05 0.00 0.00 56.93 56.82 1dtp s PHE 12 Cb -0.09 0.70 -0.04 0.00 -0.63 0.00 0.00 43.02 42.97 1dtp s PHE 12 CO 0.08 -1.10 -0.26 0.08 -0.05 0.00 0.00 175.22 173.97 1dtp s VAL 13 N -3.27 2.15 -0.02 -2.49 1.01 -1.26 -2.20 120.40 114.33 1dtp s VAL 13 Ca 0.13 -1.68 -0.18 0.00 0.00 0.00 0.00 61.98 60.25 1dtp s VAL 13 Cb -0.04 -1.90 0.03 0.00 0.00 0.00 0.00 36.38 34.47 1dtp s VAL 13 CO 0.06 0.09 0.38 -0.32 0.00 0.00 0.00 175.10 175.31 1dtp s MET 14 N -1.95 0.75 -0.19 2.72 0.00 -0.03 -4.94 119.30 115.67 1dtp s MET 14 Ca 0.12 -0.12 -0.29 0.00 0.00 0.00 0.00 55.69 55.40 1dtp s MET 14 Cb -0.10 0.34 0.00 0.00 0.00 0.00 0.00 34.83 35.07 1dtp s MET 14 CO 0.05 -0.22 1.03 -1.83 0.00 0.00 0.00 175.02 174.05 1dtp s GLU 15 N -1.36 4.32 -1.10 4.11 4.04 -1.23 -2.30 118.70 125.16 1dtp s GLU 15 Ca -0.13 1.37 -0.15 0.00 0.04 0.00 0.00 54.97 56.10 1dtp s GLU 15 Cb -0.04 -3.61 -0.03 0.00 0.02 0.00 0.00 34.13 30.47 1dtp s GLU 15 CO 0.05 -0.52 0.84 0.09 -1.84 0.00 0.00 175.26 173.89 1dtp n ASN 16 N 5.85 -5.82 -4.64 0.83 4.13 0.13 -4.89 115.26 110.86 1dtp n ASN 16 Ca 0.11 -0.90 -0.43 0.00 1.68 0.00 0.00 54.58 55.04 1dtp n ASN 16 Cb 0.47 -4.08 -0.02 0.00 -1.54 0.00 0.00 39.78 34.61 1dtp n ASN 16 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 1dtp s PHE 17 N -3.44 3.17 0.03 3.10 5.36 -1.25 -4.83 117.98 120.12 1dtp s PHE 17 Ca 0.47 1.18 0.01 0.00 -0.96 0.00 0.00 56.93 57.62 1dtp s PHE 17 Cb -0.13 -3.63 -0.04 0.00 -0.34 0.00 0.00 43.02 38.89 1dtp s PHE 17 CO 0.82 -0.73 0.11 -1.54 -1.46 0.00 0.00 175.22 172.41 1dtp s SER 18 N 1.63 5.81 0.17 6.13 1.04 -1.26 -2.16 113.70 125.05 1dtp s SER 18 Ca 0.44 0.14 -0.13 0.00 0.48 0.00 0.00 55.95 56.87 1dtp s SER 18 Cb -0.12 -1.67 0.01 0.00 0.10 0.00 0.00 66.02 64.33 1dtp s SER 18 CO 0.15 0.22 0.40 -0.94 0.98 0.00 0.00 173.24 174.05 1dtp s SER 19 N -2.09 -0.11 -0.10 7.02 1.04 -0.84 -4.94 113.70 113.69 1dtp s SER 19 Ca 0.27 -0.65 -0.02 0.00 0.48 0.00 0.00 55.95 56.03 1dtp s SER 19 Cb -0.12 0.50 -0.03 0.00 0.10 0.00 0.00 66.02 66.47 1dtp s SER 19 CO 0.19 -0.96 -0.02 -0.31 0.98 0.00 0.00 173.24 173.12 1dtp s TYR 20 N -3.91 3.09 0.13 5.02 2.02 -0.14 -1.05 117.35 122.51 1dtp s TYR 20 Ca 0.12 0.05 0.09 0.00 -0.37 0.00 0.00 57.07 56.96 1dtp s TYR 20 Cb 0.01 -1.83 -0.04 0.00 -0.40 0.00 0.00 41.96 39.71 1dtp s TYR 20 CO -0.02 0.32 -0.17 -1.58 -1.57 0.00 0.00 175.55 172.53 1dtp s HIS 21 N -0.53 2.56 -0.25 2.71 5.65 -0.68 -1.49 115.29 123.25 1dtp s HIS 21 Ca 0.09 -0.25 -0.10 0.00 0.25 0.00 0.00 55.06 55.05 1dtp s HIS 21 Cb -0.12 -1.34 -0.05 0.00 -1.18 0.00 0.00 32.58 29.90 1dtp s HIS 21 CO 0.02 0.41 0.14 0.20 -0.65 0.00 0.00 174.74 174.86 1dtp s GLY 22 N -2.25 1.92 -0.12 1.59 0.00 -1.26 -1.16 107.32 106.04 1dtp s GLY 22 Ca 0.19 -0.97 0.01 0.00 0.00 0.00 0.00 44.72 43.94 1dtp s GLY 22 CO 0.11 0.46 -0.15 -1.59 0.00 0.00 0.00 173.10 171.93 1dtp s THR 23 N 1.28 2.93 1.26 0.90 2.01 -1.05 -4.75 115.64 118.21 1dtp s THR 23 Ca 0.07 -0.71 -0.19 0.00 0.31 0.00 0.00 61.69 61.16 1dtp s THR 23 Cb -0.14 -2.21 0.31 0.00 0.01 0.00 0.00 72.50 70.46 1dtp s THR 23 CO 0.06 0.53 1.04 -0.54 -0.69 0.00 0.00 174.62 175.02 1dtp s LYS 24 N 0.28 -1.64 0.44 4.92 3.01 -1.26 -2.83 119.74 122.66 1dtp s LYS 24 Ca -0.11 0.12 -0.22 0.00 -1.01 0.00 0.00 55.97 54.76 1dtp s LYS 24 Cb -0.16 -1.53 -0.09 0.00 -1.01 0.00 0.00 37.83 35.04 1dtp s LYS 24 CO 0.06 -4.03 1.04 -2.14 0.51 0.00 0.00 175.35 170.79 1dtp s PRO 25 N -5.18 3.98 0.00 -1.68 0.02 -1.26 -3.99 135.00 126.89 1dtp s PRO 25 Ca 0.70 1.43 0.00 0.00 0.02 0.00 0.00 61.00 63.14 1dtp s PRO 25 Cb -0.13 -2.30 0.00 0.00 0.02 0.00 0.00 34.50 32.09 1dtp s PRO 25 CO 0.58 -0.29 0.00 0.41 -0.33 0.00 0.00 177.00 177.37 1dtp n GLY 26 N 0.02 2.16 0.00 0.52 0.00 -1.26 -4.77 105.19 101.86 1dtp n GLY 26 Ca 0.07 -0.70 0.03 0.00 0.00 0.00 0.00 46.02 45.41 1dtp n GLY 26 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1dtp n TYR 27 N 0.00 0.00 0.04 1.61 4.01 -1.26 -3.53 117.16 118.04 1dtp n TYR 27 Ca 0.00 0.00 -0.02 0.00 -0.16 0.00 0.00 57.90 57.72 1dtp n TYR 27 Cb 0.00 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.02 1dtp n TYR 27 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1dtp h VAL 28 N 0.00 0.00 -0.24 -0.72 2.07 -1.86 -2.98 116.25 112.51 1dtp h VAL 28 Ca 0.00 -0.03 0.07 0.00 0.82 0.00 0.00 66.70 67.56 1dtp h VAL 28 Cb 0.00 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 29.76 1dtp h VAL 28 CO 0.00 0.00 0.21 0.44 0.02 0.00 0.00 177.57 178.24 1dtp h ASP 29 N -0.14 0.00 1.22 0.57 5.19 -1.96 0.25 116.42 121.56 1dtp h ASP 29 Ca -0.01 0.00 -0.15 0.00 -0.62 0.00 0.00 57.03 56.24 1dtp h ASP 29 Cb 0.09 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.58 1dtp h ASP 29 CO 0.02 0.00 -0.74 0.77 -3.12 0.00 0.00 179.24 176.17 1dtp h SER 30 N 0.00 0.00 0.53 6.45 4.64 -1.82 -2.85 113.55 120.51 1dtp h SER 30 Ca 0.12 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.33 1dtp h SER 30 Cb 0.54 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.61 1dtp h SER 30 CO -0.00 0.74 -0.51 -0.29 -0.87 0.00 0.00 176.83 175.89 1dtp h ILE 31 N 0.00 1.35 0.00 0.95 2.10 -0.33 -0.88 117.51 120.70 1dtp h ILE 31 Ca -0.01 -1.77 0.00 0.00 1.08 0.00 0.00 64.86 64.17 1dtp h ILE 31 Cb 1.55 1.96 0.00 0.00 -1.09 0.00 0.00 36.82 39.24 1dtp h ILE 31 CO 0.10 0.50 0.00 1.56 -1.08 0.00 0.00 178.15 179.23 1dtp h GLN 32 N 0.00 0.00 -0.36 2.19 4.20 -1.35 0.71 115.11 120.50 1dtp h GLN 32 Ca -0.01 0.00 -0.16 0.00 0.06 0.00 0.00 58.65 58.55 1dtp h GLN 32 Cb 0.92 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.69 1dtp h GLN 32 CO 0.07 0.00 -0.40 0.87 -0.67 0.00 0.00 178.83 178.69 1dtp h LYS 33 N 0.00 0.88 0.00 1.46 1.79 -0.95 -3.45 116.57 116.31 1dtp h LYS 33 Ca 0.00 -0.47 0.00 0.00 -2.18 0.00 0.00 60.65 58.00 1dtp h LYS 33 Cb 0.54 0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.21 1dtp h LYS 33 CO 0.00 1.12 0.00 0.41 -1.08 0.00 0.00 179.45 179.90 1dtp n GLY 34 N 0.13 -0.04 3.86 3.86 0.00 0.25 -5.00 105.19 108.26 1dtp n GLY 34 Ca -0.02 -1.55 -0.33 0.00 0.00 0.00 0.00 46.02 44.12 1dtp n GLY 34 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1dtp s ILE 35 N -1.65 5.20 -0.19 -0.61 1.09 -1.26 -4.49 121.20 119.29 1dtp s ILE 35 Ca 0.00 -0.24 -0.35 0.00 -1.10 0.00 0.00 60.65 58.96 1dtp s ILE 35 Cb 0.00 -3.41 0.14 0.00 -1.06 0.00 0.00 42.46 38.12 1dtp s ILE 35 CO 0.00 0.33 1.20 -1.58 -0.10 0.00 0.00 174.94 174.79 1dtp s GLN 36 N -1.87 0.32 0.43 2.79 -0.44 -1.26 -4.39 119.66 115.23 1dtp s GLN 36 Ca 0.26 -0.11 -0.17 0.00 -2.50 0.00 0.00 55.36 52.84 1dtp s GLN 36 Cb -0.12 0.15 -0.09 0.00 -1.64 0.00 0.00 33.01 31.30 1dtp s GLN 36 CO 0.17 -0.14 0.90 0.21 0.50 0.00 0.00 175.29 176.93 1dtp s LYS 37 N -2.34 4.05 0.42 1.67 2.20 -1.26 -5.04 119.74 119.44 1dtp s LYS 37 Ca 0.09 0.91 -0.27 0.00 -0.36 0.00 0.00 55.97 56.35 1dtp s LYS 37 Cb -0.01 -2.24 -0.10 0.00 -1.51 0.00 0.00 37.83 33.98 1dtp s LYS 37 CO -0.05 -0.07 1.47 -2.30 -0.36 0.00 0.00 175.35 174.04 1dtp n PRO 38 N -0.94 2.46 -0.01 4.03 -0.02 -1.26 -4.97 135.00 134.30 1dtp n PRO 38 Ca 0.06 0.87 -0.16 0.00 -2.02 0.00 0.00 63.50 62.25 1dtp n PRO 38 Cb 0.54 -2.66 -0.14 0.00 -0.02 0.00 0.00 33.50 31.22 1dtp n PRO 38 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1dtp n LYS 39 N 0.08 0.70 -1.95 -0.52 5.02 -1.26 -4.72 118.16 115.52 1dtp n LYS 39 Ca 0.03 0.26 -0.26 0.00 -2.02 0.00 0.00 58.31 56.33 1dtp n LYS 39 Cb 0.40 -1.73 -0.07 0.00 -0.02 0.00 0.00 35.03 33.61 1dtp n LYS 39 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1dtp n SER 40 N -3.28 2.73 0.00 4.39 3.41 -1.26 -4.83 113.62 114.79 1dtp n SER 40 Ca -0.27 -2.66 0.00 0.00 -0.26 0.00 0.00 58.87 55.68 1dtp n SER 40 Cb 1.05 -1.72 0.00 0.00 -0.26 0.00 0.00 64.21 63.28 1dtp n SER 40 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1dtp n GLY 41 N 5.82 -0.12 0.39 5.00 0.00 -1.26 -4.42 105.19 110.60 1dtp n GLY 41 Ca 0.44 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.30 1dtp n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dtp h THR 42 N 0.00 0.25 -4.73 2.61 1.03 -1.91 -3.47 112.91 106.70 1dtp h THR 42 Ca 0.00 0.00 -0.22 0.00 -0.01 0.00 0.00 66.41 66.18 1dtp h THR 42 Cb 0.00 0.25 -0.04 0.00 -1.07 0.00 0.00 68.15 67.29 1dtp h THR 42 CO 0.00 0.00 -0.31 0.00 -0.01 0.00 0.00 175.52 175.20 1dtp n GLN 43 N -5.47 -2.67 0.00 0.00 6.02 -1.26 -3.37 117.38 110.63 1dtp n GLN 43 Ca -0.10 0.37 0.00 0.00 -0.01 0.00 0.00 57.00 57.26 1dtp n GLN 43 Cb 0.37 -4.97 0.00 0.00 1.02 0.00 0.00 30.24 26.67 1dtp n GLN 43 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1dtp n GLY 44 N -0.82 3.39 3.33 1.08 0.00 -1.26 -2.35 105.19 108.57 1dtp n GLY 44 Ca -0.06 -0.73 -0.12 0.00 0.00 0.00 0.00 46.02 45.11 1dtp n GLY 44 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1dtp s ASN 45 N 0.00 -0.30 0.07 1.61 3.84 -1.22 -4.83 114.94 114.12 1dtp s ASN 45 Ca 0.00 -0.09 -0.26 0.00 0.21 0.00 0.00 52.86 52.72 1dtp s ASN 45 Cb 0.00 0.46 -0.17 0.00 -0.55 0.00 0.00 41.25 40.99 1dtp s ASN 45 CO 0.00 -0.75 1.63 1.88 -2.79 0.00 0.00 177.10 177.07 1dtp h TYR 46 N 2.72 -0.23 -3.28 0.43 -1.99 -1.92 -3.43 116.97 109.27 1dtp h TYR 46 Ca -0.32 -0.01 -0.54 0.00 2.00 0.00 0.00 58.73 59.87 1dtp h TYR 46 Cb 1.23 0.08 -0.00 0.00 2.00 0.00 0.00 36.73 40.03 1dtp h TYR 46 CO 0.37 -0.08 0.49 0.34 -0.00 0.00 0.00 178.16 179.27 1dtp s ASP 47 N -5.04 7.19 0.27 3.88 2.15 -1.26 -4.95 116.67 118.91 1dtp s ASP 47 Ca -0.14 1.89 0.00 0.00 0.43 0.00 0.00 52.55 54.73 1dtp s ASP 47 Cb 0.05 -2.58 0.57 0.00 -0.30 0.00 0.00 42.92 40.66 1dtp s ASP 47 CO 0.64 -0.39 1.76 0.44 -0.17 0.00 0.00 175.17 177.45 1dtp h ASP 48 N 6.74 0.55 -0.98 -0.34 5.19 -2.00 -0.76 116.42 124.83 1dtp h ASP 48 Ca -0.41 0.10 0.23 0.00 -0.62 0.00 0.00 57.03 56.32 1dtp h ASP 48 Cb 1.22 0.01 -0.12 0.00 0.18 0.00 0.00 39.33 40.61 1dtp h ASP 48 CO 0.79 0.22 0.55 0.44 -3.12 0.00 0.00 179.24 178.11 1dtp h ASP 49 N 0.63 0.61 -0.45 6.45 3.32 -1.91 -3.09 116.42 121.98 1dtp h ASP 49 Ca 0.48 0.14 -0.01 0.00 0.02 0.00 0.00 57.03 57.66 1dtp h ASP 49 Cb 0.71 0.05 -0.00 0.00 0.22 0.00 0.00 39.33 40.30 1dtp h ASP 49 CO -0.38 0.10 0.01 0.79 -1.72 0.00 0.00 179.24 178.04 1dtp n TRP 50 N -4.91 1.62 -2.75 4.55 7.02 -0.29 -0.33 117.44 122.36 1dtp n TRP 50 Ca 0.25 -0.81 -0.40 0.00 -1.02 0.00 0.00 57.50 55.52 1dtp n TRP 50 Cb 0.70 -0.44 -0.06 0.00 -2.42 0.00 0.00 31.31 29.10 1dtp n TRP 50 CO 0.00 0.00 0.00 0.15 -2.02 0.00 0.00 177.69 175.82 1dtp s LYS 51 N -2.81 4.82 0.00 -0.99 1.02 -1.17 -4.12 119.74 116.49 1dtp s LYS 51 Ca 0.50 1.48 0.00 0.00 0.02 0.00 0.00 55.97 57.96 1dtp s LYS 51 Cb 0.39 -3.30 0.00 0.00 -0.52 0.00 0.00 37.83 34.40 1dtp s LYS 51 CO 0.13 0.45 0.00 0.41 -0.92 0.00 0.00 175.35 175.42 1dtp n GLY 52 N 1.66 -1.36 3.68 -3.33 0.00 -0.99 -4.64 105.19 100.21 1dtp n GLY 52 Ca -0.01 -0.96 -0.37 0.00 0.00 0.00 0.00 46.02 44.68 1dtp n GLY 52 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1dtp s PHE 53 N -2.65 3.37 -0.20 1.61 2.19 -0.60 -4.25 117.98 117.45 1dtp s PHE 53 Ca 0.00 0.45 -0.08 0.00 0.33 0.00 0.00 56.93 57.63 1dtp s PHE 53 Cb 0.00 -2.37 -0.04 0.00 -1.31 0.00 0.00 43.02 39.30 1dtp s PHE 53 CO 0.00 0.09 0.08 0.71 1.83 0.00 0.00 175.22 177.93 1dtp s TYR 54 N 0.97 3.24 0.33 10.12 1.51 -1.26 -0.67 117.35 131.59 1dtp s TYR 54 Ca 0.13 0.03 0.06 0.00 -1.01 0.00 0.00 57.07 56.29 1dtp s TYR 54 Cb -0.14 -2.14 -0.03 0.00 -0.11 0.00 0.00 41.96 39.55 1dtp s TYR 54 CO 0.05 0.06 0.24 -1.54 -1.11 0.00 0.00 175.55 173.25 1dtp s SER 55 N 0.68 1.75 0.18 2.29 1.04 -0.88 -4.80 113.70 113.96 1dtp s SER 55 Ca 0.04 -1.72 -0.10 0.00 0.48 0.00 0.00 55.95 54.65 1dtp s SER 55 Cb -0.13 0.54 -0.00 0.00 0.10 0.00 0.00 66.02 66.52 1dtp s SER 55 CO 0.02 -1.03 0.34 0.28 0.98 0.00 0.00 173.24 173.83 1dtp s THR 56 N -3.46 0.05 -0.04 2.02 -1.32 -0.55 -0.33 115.64 112.00 1dtp s THR 56 Ca 0.38 -1.32 0.21 0.00 -1.21 0.00 0.00 61.69 59.75 1dtp s THR 56 Cb 0.03 -1.87 0.20 0.00 -1.51 0.00 0.00 72.50 69.34 1dtp s THR 56 CO 0.24 -0.22 1.68 -2.24 -2.21 0.00 0.00 174.62 171.87 1dtp h ASP 57 N 2.45 0.00 -3.61 8.08 2.03 -1.86 -0.35 116.42 123.16 1dtp h ASP 57 Ca -0.31 0.00 -0.68 0.00 -0.73 0.00 0.00 57.03 55.31 1dtp h ASP 57 Cb 1.24 0.00 -0.28 0.00 -0.83 0.00 0.00 39.33 39.46 1dtp h ASP 57 CO 0.45 0.28 -0.64 0.21 -1.03 0.00 0.00 179.24 178.51 1dtp s ASN 58 N -6.26 5.05 0.28 4.15 3.84 -1.26 -4.80 114.94 115.93 1dtp s ASN 58 Ca 0.03 -0.84 0.08 0.00 0.21 0.00 0.00 52.86 52.33 1dtp s ASN 58 Cb 0.09 -1.84 0.39 0.00 -0.55 0.00 0.00 41.25 39.33 1dtp s ASN 58 CO 0.67 -0.21 1.64 0.07 -2.79 0.00 0.00 177.10 176.48 1dtp h LYS 59 N 8.19 0.14 0.53 0.43 2.10 -1.93 0.32 116.57 126.36 1dtp h LYS 59 Ca -0.29 -0.08 -0.03 0.00 -2.00 0.00 0.00 60.65 58.25 1dtp h LYS 59 Cb 1.11 0.01 0.01 0.00 -0.90 0.00 0.00 32.23 32.46 1dtp h LYS 59 CO 0.60 0.64 -0.26 1.88 -2.00 0.00 0.00 179.45 180.31 1dtp h TYR 60 N 0.11 -0.67 -0.09 0.07 0.05 -1.95 0.43 116.97 114.92 1dtp h TYR 60 Ca -0.00 -0.02 0.03 0.00 0.05 0.00 0.00 58.73 58.79 1dtp h TYR 60 Cb 0.98 0.22 -0.00 0.00 1.01 0.00 0.00 36.73 38.94 1dtp h TYR 60 CO 0.01 -0.38 0.07 -0.44 -1.05 0.00 0.00 178.16 176.37 1dtp h ASP 61 N -0.81 0.00 -0.59 3.88 5.19 -1.90 0.33 116.42 122.52 1dtp h ASP 61 Ca -0.07 0.00 -0.10 0.00 -0.62 0.00 0.00 57.03 56.24 1dtp h ASP 61 Cb 0.59 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.08 1dtp h ASP 61 CO 0.12 0.00 -0.02 0.00 -3.12 0.00 0.00 179.24 176.22 1dtp h ALA 62 N 1.95 0.80 -0.03 3.45 0.00 0.90 -3.25 119.26 123.09 1dtp h ALA 62 Ca 0.04 -0.32 0.01 0.00 0.00 0.00 0.00 54.91 54.64 1dtp h ALA 62 Cb 0.18 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 1dtp h ALA 62 CO -0.00 0.66 0.05 0.00 0.00 0.00 0.00 179.25 179.96 1dtp h ALA 63 N 0.98 1.39 -0.33 0.00 0.00 0.39 -0.61 119.26 121.07 1dtp h ALA 63 Ca 0.17 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1dtp h ALA 63 Cb 0.59 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1dtp h ALA 63 CO 0.03 -0.06 0.00 0.41 0.00 0.00 0.00 179.25 179.64 1dtp n GLY 64 N -1.25 0.62 0.57 0.00 0.00 -1.23 -0.70 105.19 103.20 1dtp n GLY 64 Ca -0.02 -0.39 0.11 0.00 0.00 0.00 0.00 46.02 45.72 1dtp n GLY 64 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1dtp n TYR 65 N 0.51 0.00 0.03 1.61 4.02 -0.24 -4.44 117.16 118.66 1dtp n TYR 65 Ca 0.12 0.00 -0.03 0.00 -0.01 0.00 0.00 57.90 57.99 1dtp n TYR 65 Cb 0.30 -0.00 0.15 0.00 -0.02 0.00 0.00 39.34 39.77 1dtp n TYR 65 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 1dtp n SER 66 N 0.19 3.31 -4.48 7.72 3.41 0.12 -4.58 113.62 119.31 1dtp n SER 66 Ca 0.10 -2.58 -0.23 0.00 -0.26 0.00 0.00 58.87 55.90 1dtp n SER 66 Cb 0.49 -0.62 -0.10 0.00 -0.26 0.00 0.00 64.21 63.71 1dtp n SER 66 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1dtp s VAL 67 N -1.73 1.87 0.00 -3.33 1.01 -1.26 -1.70 120.40 115.26 1dtp s VAL 67 Ca 0.27 -2.15 0.00 0.00 0.00 0.00 0.00 61.98 60.10 1dtp s VAL 67 Cb 0.21 -2.56 0.00 0.00 0.00 0.00 0.00 36.38 34.03 1dtp s VAL 67 CO 0.07 -0.24 0.00 -0.90 0.00 0.00 0.00 175.10 174.03 1dtp n ASP 68 N -0.68 0.00 -1.07 3.32 5.68 -1.26 -4.94 116.55 117.60 1dtp n ASP 68 Ca -0.05 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.24 1dtp n ASP 68 Cb 0.64 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.62 1dtp n ASP 68 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 1dtp n ASN 69 N -1.04 -1.43 -2.82 -1.12 2.85 -1.26 -4.70 115.26 105.75 1dtp n ASN 69 Ca 0.00 0.00 -0.01 0.00 -0.11 0.00 0.00 54.58 54.46 1dtp n ASN 69 Cb 0.00 -0.71 0.00 0.00 1.24 0.00 0.00 39.78 40.31 1dtp n ASN 69 CO 0.00 0.00 0.00 -0.62 -2.11 0.00 0.00 177.26 174.53 1dtp n GLU 70 N -0.07 -2.89 -0.42 1.20 1.02 -1.26 -4.99 120.64 113.24 1dtp n GLU 70 Ca 0.00 2.41 0.00 0.00 -0.02 0.00 0.00 57.16 59.55 1dtp n GLU 70 Cb 0.00 -4.62 0.00 0.00 -0.02 0.00 0.00 31.44 26.80 1dtp n GLU 70 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1dtp n ASN 71 N 0.74 -0.56 0.00 1.62 3.02 -1.26 -5.05 115.26 113.77 1dtp n ASN 71 Ca 0.01 0.00 0.08 0.00 -0.03 0.00 0.00 54.58 54.63 1dtp n ASN 71 Cb 0.12 -0.28 0.35 0.00 -0.61 0.00 0.00 39.78 39.36 1dtp n ASN 71 CO 0.00 0.00 0.00 -2.65 -2.62 0.00 0.00 177.26 171.99 1dtp n PRO 72 N -0.04 0.06 0.13 3.52 -0.02 -1.26 -2.51 135.00 134.88 1dtp n PRO 72 Ca 0.00 0.21 0.00 0.00 -2.02 0.00 0.00 63.50 61.69 1dtp n PRO 72 Cb 0.00 -1.50 0.06 0.00 -0.02 0.00 0.00 33.50 32.04 1dtp n PRO 72 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1dtp h LEU 73 N 0.00 0.00 -8.96 2.45 -0.00 -2.01 -3.37 115.31 103.41 1dtp h LEU 73 Ca 0.00 0.00 -0.58 0.00 -0.00 0.00 0.00 57.88 57.30 1dtp h LEU 73 Cb 0.24 0.00 -0.07 0.00 -0.00 0.00 0.00 40.66 40.82 1dtp h LEU 73 CO 0.00 0.63 0.71 -0.94 -0.00 0.00 0.00 178.44 178.83 1dtp s SER 74 N -6.55 6.87 0.00 -0.43 1.04 -1.04 -4.93 113.70 108.66 1dtp s SER 74 Ca 0.02 0.98 -0.02 0.00 0.48 0.00 0.00 55.95 57.41 1dtp s SER 74 Cb 0.09 -2.50 -0.08 0.00 0.10 0.00 0.00 66.02 63.63 1dtp s SER 74 CO 0.76 -0.77 1.55 0.61 0.98 0.00 0.00 173.24 176.37 1dtp n GLY 75 N 3.89 1.72 0.00 7.32 0.00 -1.20 -4.90 105.19 112.02 1dtp n GLY 75 Ca 0.10 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.75 1dtp n GLY 75 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1dtp n LYS 76 N 2.47 1.14 0.00 1.61 2.85 -0.99 0.31 118.16 125.55 1dtp n LYS 76 Ca 0.13 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.39 1dtp n LYS 76 Cb 0.34 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.72 1dtp n LYS 76 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1dtp n ALA 77 N -3.00 0.00 -0.02 0.58 0.00 -1.26 -0.75 120.51 116.07 1dtp n ALA 77 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 1dtp n ALA 77 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.45 1dtp n ALA 77 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1dtp h GLY 78 N 0.00 0.00 0.00 0.00 0.00 -1.20 0.23 103.07 102.10 1dtp h GLY 78 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1dtp h GLY 78 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 1dtp n GLY 79 N 1.81 -0.53 2.94 4.60 0.00 -1.13 0.93 105.19 113.80 1dtp n GLY 79 Ca -0.01 -0.85 -0.13 0.00 0.00 0.00 0.00 46.02 45.02 1dtp n GLY 79 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1dtp s VAL 80 N -3.43 0.22 0.19 1.61 1.01 0.20 -2.54 120.40 117.66 1dtp s VAL 80 Ca 0.00 -0.30 0.11 0.00 0.00 0.00 0.00 61.98 61.79 1dtp s VAL 80 Cb 0.00 -0.23 -0.04 0.00 0.00 0.00 0.00 36.38 36.11 1dtp s VAL 80 CO 0.00 -0.06 -0.24 0.68 0.00 0.00 0.00 175.10 175.48 1dtp s VAL 81 N -0.36 2.32 -0.35 2.92 -7.23 -0.31 -0.72 120.40 116.67 1dtp s VAL 81 Ca -0.02 -2.01 -0.12 0.00 -1.81 0.00 0.00 61.98 58.01 1dtp s VAL 81 Cb -0.03 -2.10 -0.01 0.00 0.56 0.00 0.00 36.38 34.80 1dtp s VAL 81 CO -0.00 -0.11 0.23 -0.75 -0.31 0.00 0.00 175.10 174.16 1dtp s LYS 82 N -2.64 3.37 0.02 4.82 2.20 -0.83 -1.69 119.74 124.98 1dtp s LYS 82 Ca 0.20 -0.73 -0.03 0.00 -0.36 0.00 0.00 55.97 55.05 1dtp s LYS 82 Cb -0.08 -3.78 -0.04 0.00 -1.51 0.00 0.00 37.83 32.41 1dtp s LYS 82 CO 0.09 -0.49 0.22 0.14 -0.36 0.00 0.00 175.35 174.96 1dtp s VAL 83 N 1.69 5.37 -0.12 4.02 -7.23 -0.21 -1.57 120.40 122.35 1dtp s VAL 83 Ca 0.05 -0.11 -0.06 0.00 -1.81 0.00 0.00 61.98 60.05 1dtp s VAL 83 Cb -0.18 -3.57 0.05 0.00 0.56 0.00 0.00 36.38 33.24 1dtp s VAL 83 CO 0.10 0.27 0.29 0.28 -0.31 0.00 0.00 175.10 175.73 1dtp s THR 84 N -1.38 -0.05 -0.11 5.32 -1.32 0.07 -1.98 115.64 116.19 1dtp s THR 84 Ca 0.30 0.14 -0.22 0.00 -1.21 0.00 0.00 61.69 60.69 1dtp s THR 84 Cb -0.13 -0.44 -0.03 0.00 -1.51 0.00 0.00 72.50 70.39 1dtp s THR 84 CO 0.20 0.06 0.67 -0.31 -2.21 0.00 0.00 174.62 173.03 1dtp s TYR 85 N 1.33 3.52 -0.55 9.09 2.02 -0.92 -0.55 117.35 131.29 1dtp s TYR 85 Ca -0.09 1.14 -0.28 0.00 -0.37 0.00 0.00 57.07 57.47 1dtp s TYR 85 Cb -0.10 -2.79 0.01 0.00 -0.40 0.00 0.00 41.96 38.68 1dtp s TYR 85 CO -0.10 0.02 1.46 -2.14 -1.57 0.00 0.00 175.55 173.23 1dtp s PRO 86 N 1.09 3.26 0.12 -1.71 0.02 -1.26 -3.89 135.00 132.63 1dtp s PRO 86 Ca 0.34 0.51 0.00 0.00 0.02 0.00 0.00 61.00 61.88 1dtp s PRO 86 Cb -0.17 -4.14 0.00 0.00 0.02 0.00 0.00 34.50 30.21 1dtp s PRO 86 CO 0.15 -1.99 0.00 0.41 -0.33 0.00 0.00 177.00 175.25 1dtp n GLY 87 N 5.30 0.93 2.89 0.52 0.00 -1.26 -4.85 105.19 108.71 1dtp n GLY 87 Ca 0.13 -0.92 -0.30 0.00 0.00 0.00 0.00 46.02 44.93 1dtp n GLY 87 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1dtp s LEU 88 N 0.00 2.95 -0.04 0.99 2.96 -1.25 0.17 118.68 124.46 1dtp s LEU 88 Ca 0.00 -1.53 0.05 0.00 -0.22 0.00 0.00 54.13 52.43 1dtp s LEU 88 Cb 0.00 -1.17 -0.01 0.00 0.50 0.00 0.00 46.19 45.51 1dtp s LEU 88 CO 0.00 -0.33 -0.19 -0.89 -1.32 0.00 0.00 176.35 173.62 1dtp s THR 89 N 1.36 1.56 0.57 3.68 2.01 -0.97 0.32 115.64 124.17 1dtp s THR 89 Ca 0.03 -0.80 0.01 0.00 0.31 0.00 0.00 61.69 61.24 1dtp s THR 89 Cb -0.18 -1.32 0.04 0.00 0.01 0.00 0.00 72.50 71.05 1dtp s THR 89 CO -0.12 0.44 0.80 -0.75 -0.69 0.00 0.00 174.62 174.30 1dtp s LYS 90 N -0.11 2.44 -0.18 4.92 2.47 -0.19 -0.85 119.74 128.23 1dtp s LYS 90 Ca -0.01 -0.82 -0.06 0.00 -1.56 0.00 0.00 55.97 53.52 1dtp s LYS 90 Cb -0.11 -2.47 0.09 0.00 -1.46 0.00 0.00 37.83 33.88 1dtp s LYS 90 CO 0.02 -0.80 0.36 0.08 0.16 0.00 0.00 175.35 175.17 1dtp s VAL 91 N -2.81 -0.57 -0.22 4.02 1.01 -0.93 -3.02 120.40 117.88 1dtp s VAL 91 Ca 0.58 0.18 -0.04 0.00 0.00 0.00 0.00 61.98 62.71 1dtp s VAL 91 Cb -0.10 -0.61 -0.01 0.00 0.00 0.00 0.00 36.38 35.67 1dtp s VAL 91 CO 0.39 0.06 -0.05 -0.22 0.00 0.00 0.00 175.10 175.29 1dtp s LEU 92 N 2.54 2.88 -0.28 3.92 0.20 -0.55 -3.33 118.68 124.06 1dtp s LEU 92 Ca 0.01 -0.40 -0.14 0.00 0.69 0.00 0.00 54.13 54.29 1dtp s LEU 92 Cb -0.12 -1.73 -0.04 0.00 -0.43 0.00 0.00 46.19 43.86 1dtp s LEU 92 CO -0.12 -0.02 0.31 0.00 -0.29 0.00 0.00 176.35 176.23 1dtp s ALA 93 N 1.47 3.55 0.19 5.97 0.00 -1.26 -0.80 121.76 130.89 1dtp s ALA 93 Ca 0.06 -0.93 -0.20 0.00 0.00 0.00 0.00 51.96 50.88 1dtp s ALA 93 Cb -0.14 -2.63 -0.08 0.00 0.00 0.00 0.00 23.12 20.27 1dtp s ALA 93 CO -0.04 -0.64 0.71 -0.51 0.00 0.00 0.00 175.76 175.29 1dtp s LEU 94 N 1.96 4.40 0.00 0.00 1.43 -0.36 -0.40 118.68 125.71 1dtp s LEU 94 Ca 0.12 1.42 0.15 0.00 -1.03 0.00 0.00 54.13 54.79 1dtp s LEU 94 Cb -0.16 -3.45 0.21 0.00 0.03 0.00 0.00 46.19 42.82 1dtp s LEU 94 CO 0.10 0.09 1.08 1.17 0.23 0.00 0.00 176.35 179.03 1dtp n LYS 95 N 0.98 1.60 -3.53 1.70 4.81 0.14 -4.66 118.16 119.20 1dtp n LYS 95 Ca -0.04 -1.65 -0.20 0.00 -0.87 0.00 0.00 58.31 55.55 1dtp n LYS 95 Cb 0.51 -1.31 -0.14 0.00 0.02 0.00 0.00 35.03 34.11 1dtp n LYS 95 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 1dtp s VAL 96 N -1.16 -0.26 -1.25 3.15 1.01 -1.24 -4.94 120.40 115.70 1dtp s VAL 96 Ca 0.21 -0.11 -0.05 0.00 0.00 0.00 0.00 61.98 62.04 1dtp s VAL 96 Cb 0.13 -0.63 0.14 0.00 0.00 0.00 0.00 36.38 36.02 1dtp s VAL 96 CO 0.19 -0.21 2.33 -0.90 0.00 0.00 0.00 175.10 176.51 1dtp n ASP 97 N 5.31 7.92 -3.41 3.32 5.75 -1.26 -4.85 116.55 129.33 1dtp n ASP 97 Ca -0.06 -3.22 -0.01 0.00 -0.01 0.00 0.00 54.79 51.49 1dtp n ASP 97 Cb 0.49 -1.33 -0.04 0.00 -1.03 0.00 0.00 41.12 39.21 1dtp n ASP 97 CO 0.00 0.00 0.00 0.21 -0.11 0.00 0.00 177.20 177.30 1dtp s ASN 98 N 0.16 -0.93 0.27 -1.12 2.47 -1.26 -5.08 114.94 109.44 1dtp s ASN 98 Ca 0.52 1.04 -0.03 0.00 0.42 0.00 0.00 52.86 54.81 1dtp s ASN 98 Cb 0.19 1.96 0.38 0.00 -1.45 0.00 0.00 41.25 42.33 1dtp s ASN 98 CO -0.11 -0.25 1.91 0.00 -3.72 0.00 0.00 177.10 174.93 1dtp h ALA 99 N 8.05 1.38 0.00 1.71 0.00 -1.97 0.21 119.26 128.64 1dtp h ALA 99 Ca -0.20 -0.04 -0.18 0.00 0.00 0.00 0.00 54.91 54.49 1dtp h ALA 99 Cb 1.13 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 1dtp h ALA 99 CO 0.19 0.51 -0.85 1.49 0.00 0.00 0.00 179.25 180.59 1dtp h GLU 100 N 1.22 0.05 0.00 0.00 4.81 -1.98 0.27 114.58 118.95 1dtp h GLU 100 Ca 0.40 -0.06 -0.12 0.00 -0.13 0.00 0.00 59.36 59.44 1dtp h GLU 100 Cb 0.05 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.43 1dtp h GLU 100 CO -0.13 0.87 -0.59 1.15 -0.73 0.00 0.00 179.01 179.57 1dtp h THR 101 N 0.03 1.25 0.40 0.32 2.02 -1.95 0.22 112.91 115.19 1dtp h THR 101 Ca -0.02 -2.15 -0.02 0.00 0.77 0.00 0.00 66.41 64.99 1dtp h THR 101 Cb 1.49 2.22 0.00 0.00 -1.74 0.00 0.00 68.15 70.12 1dtp h THR 101 CO 0.12 0.58 -0.19 0.40 0.37 0.00 0.00 175.52 176.79 1dtp h ILE 102 N 0.00 0.40 -0.20 3.11 2.04 -0.15 -2.42 117.51 120.29 1dtp h ILE 102 Ca -0.01 -0.62 0.06 0.00 1.00 0.00 0.00 64.86 65.29 1dtp h ILE 102 Cb 1.17 0.60 -0.01 0.00 -0.74 0.00 0.00 36.82 37.85 1dtp h ILE 102 CO 0.08 0.08 0.14 0.11 0.00 0.00 0.00 178.15 178.56 1dtp h LYS 103 N -0.98 0.00 0.00 2.37 1.57 -0.21 -2.65 116.57 116.66 1dtp h LYS 103 Ca -0.06 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1dtp h LYS 103 Cb 0.54 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.85 1dtp h LYS 103 CO 0.09 0.00 -0.02 -0.22 -0.57 0.00 0.00 179.45 178.73 1dtp h LYS 104 N 0.00 0.00 0.00 3.15 1.63 -0.53 0.96 116.57 121.78 1dtp h LYS 104 Ca 0.10 0.00 -0.07 0.00 -0.85 0.00 0.00 60.65 59.82 1dtp h LYS 104 Cb 0.38 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.00 1dtp h LYS 104 CO -0.00 0.99 -0.34 0.93 -3.45 0.00 0.00 179.45 177.58 1dtp h GLU 105 N -1.00 0.00 0.00 1.90 4.39 -1.26 -0.72 114.58 117.89 1dtp h GLU 105 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1dtp h GLU 105 Cb 1.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.65 1dtp h GLU 105 CO -0.00 0.34 -0.04 -0.07 -1.16 0.00 0.00 179.01 178.08 1dtp h LEU 106 N 0.00 0.00 -2.80 1.33 3.38 -1.60 1.23 115.31 116.85 1dtp h LEU 106 Ca -0.00 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.88 1dtp h LEU 106 Cb 0.61 0.00 0.06 0.00 0.09 0.00 0.00 40.66 41.42 1dtp h LEU 106 CO 0.04 0.00 -0.28 0.61 0.09 0.00 0.00 178.44 178.91 1dtp n GLY 107 N 1.24 0.25 3.49 0.83 0.00 -0.08 -4.92 105.19 106.01 1dtp n GLY 107 Ca 0.05 -0.01 -0.24 0.00 0.00 0.00 0.00 46.02 45.82 1dtp n GLY 107 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1dtp s LEU 108 N -3.76 2.68 0.21 0.99 2.96 0.32 -5.01 118.68 117.07 1dtp s LEU 108 Ca 0.14 -0.95 -0.31 0.00 -0.22 0.00 0.00 54.13 52.80 1dtp s LEU 108 Cb -0.02 -1.21 -0.10 0.00 0.50 0.00 0.00 46.19 45.36 1dtp s LEU 108 CO 0.24 0.04 1.51 -0.55 -1.32 0.00 0.00 176.35 176.27 1dtp s SER 109 N -3.46 6.61 0.00 3.68 0.15 -1.26 -4.58 113.70 114.84 1dtp s SER 109 Ca 0.29 2.66 0.00 0.00 0.70 0.00 0.00 55.95 59.60 1dtp s SER 109 Cb -0.06 -2.61 0.00 0.00 -1.71 0.00 0.00 66.02 61.64 1dtp s SER 109 CO 0.15 -0.77 0.39 0.18 1.20 0.00 0.00 173.24 174.39 1dtp n LEU 110 N 3.07 0.40 -1.19 3.45 4.77 -1.26 -3.67 117.00 122.57 1dtp n LEU 110 Ca 0.10 -0.20 -0.04 0.00 -0.03 0.00 0.00 56.01 55.84 1dtp n LEU 110 Cb 0.39 -0.20 -0.01 0.00 -2.33 0.00 0.00 43.42 41.27 1dtp n LEU 110 CO 0.61 0.10 0.30 0.35 -1.33 0.00 0.00 177.39 177.42 1dtp n THR 111 N -0.02 0.00 -4.56 -5.08 -2.24 -1.26 -5.09 114.28 96.03 1dtp n THR 111 Ca 0.00 -0.17 -0.26 0.00 -2.27 0.00 0.00 64.05 61.35 1dtp n THR 111 Cb 0.10 0.45 -0.11 0.00 -2.10 0.00 0.00 70.33 68.67 1dtp n THR 111 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1dtp s GLU 112 N 0.02 1.85 0.12 -0.78 8.01 -1.24 -5.08 118.70 121.60 1dtp s GLU 112 Ca 0.01 -1.99 -0.31 0.00 0.01 0.00 0.00 54.97 52.69 1dtp s GLU 112 Cb 0.07 -1.62 -0.09 0.00 -4.31 0.00 0.00 34.13 28.19 1dtp s GLU 112 CO -0.02 0.06 1.47 -2.14 0.01 0.00 0.00 175.26 174.64 1dtp s PRO 113 N -3.66 4.27 0.24 0.39 0.02 -1.26 -4.84 135.00 130.16 1dtp s PRO 113 Ca 0.33 2.19 -0.05 0.00 0.02 0.00 0.00 61.00 63.49 1dtp s PRO 113 Cb 0.05 -3.25 0.38 0.00 0.02 0.00 0.00 34.50 31.70 1dtp s PRO 113 CO 0.17 -0.52 1.79 1.25 -0.33 0.00 0.00 177.00 179.35 1dtp h LEU 114 N 6.99 0.54 0.00 -5.54 5.85 -1.85 -0.88 115.31 120.42 1dtp h LEU 114 Ca -0.42 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.36 1dtp h LEU 114 Cb 1.21 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.20 1dtp h LEU 114 CO 0.89 0.30 0.00 0.23 -0.34 0.00 0.00 178.44 179.51 1dtp n MET 115 N -4.83 0.05 -0.03 1.25 2.81 0.55 -1.50 117.12 115.42 1dtp n MET 115 Ca 0.13 0.28 -0.16 0.00 -1.81 0.00 0.00 57.70 56.13 1dtp n MET 115 Cb 0.29 -1.50 -0.13 0.00 -0.71 0.00 0.00 33.22 31.17 1dtp n MET 115 CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 1dtp h GLU 116 N 0.00 0.10 -0.74 0.03 3.07 -1.43 -3.33 114.58 112.29 1dtp h GLU 116 Ca 0.00 -0.16 -0.05 0.00 -0.50 0.00 0.00 59.36 58.64 1dtp h GLU 116 Cb 0.15 0.06 -0.03 0.00 -0.84 0.00 0.00 28.75 28.09 1dtp h GLU 116 CO 0.00 1.05 0.25 1.96 -1.40 0.00 0.00 179.01 180.86 1dtp h GLN 117 N -0.75 1.13 -0.41 2.33 4.20 -0.87 -1.76 115.11 118.96 1dtp h GLN 117 Ca -0.04 -0.23 0.12 0.00 0.06 0.00 0.00 58.65 58.56 1dtp h GLN 117 Cb 1.17 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 28.76 1dtp h GLN 117 CO 0.05 0.95 0.73 0.28 -0.67 0.00 0.00 178.83 180.17 1dtp h VAL 118 N 1.09 0.12 0.00 -0.54 2.07 -1.38 -1.76 116.25 115.85 1dtp h VAL 118 Ca 0.24 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.68 1dtp h VAL 118 Cb 0.28 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 30.40 1dtp h VAL 118 CO -0.01 0.00 -0.37 1.23 0.02 0.00 0.00 177.57 178.44 1dtp h GLY 119 N 0.00 0.00 -1.97 2.17 0.00 -1.43 -3.36 103.07 98.48 1dtp h GLY 119 Ca 0.20 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 47.01 1dtp h GLY 119 CO -0.00 0.00 0.43 -0.51 0.00 0.00 0.00 176.54 176.46 1dtp s THR 120 N -3.04 2.92 0.20 4.70 -4.23 -0.66 -4.79 115.64 110.74 1dtp s THR 120 Ca 0.05 0.53 -0.11 0.00 -1.18 0.00 0.00 61.69 60.97 1dtp s THR 120 Cb 0.07 -3.14 0.14 0.00 1.34 0.00 0.00 72.50 70.90 1dtp s THR 120 CO 0.72 -0.17 1.72 1.05 -0.54 0.00 0.00 174.62 177.40 1dtp h GLU 121 N 0.68 0.28 -0.02 3.99 -0.00 -1.90 0.17 114.58 117.78 1dtp h GLU 121 Ca -0.49 -0.02 0.00 0.00 -0.00 0.00 0.00 59.36 58.86 1dtp h GLU 121 Cb 1.27 -0.06 -0.00 0.00 -0.00 0.00 0.00 28.75 29.96 1dtp h GLU 121 CO 0.55 0.18 0.02 0.93 -0.00 0.00 0.00 179.01 180.69 1dtp h GLU 122 N 0.28 0.00 0.00 1.06 4.39 -1.93 0.26 114.58 118.65 1dtp h GLU 122 Ca 0.29 0.00 -0.17 0.00 0.34 0.00 0.00 59.36 59.82 1dtp h GLU 122 Cb 0.40 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.02 1dtp h GLU 122 CO -0.35 0.00 -1.07 0.34 -1.16 0.00 0.00 179.01 176.77 1dtp n PHE 123 N -3.71 0.99 -0.31 4.33 -0.00 -0.30 -2.39 117.46 116.07 1dtp n PHE 123 Ca -0.03 0.43 0.03 0.00 -0.00 0.00 0.00 57.45 57.88 1dtp n PHE 123 Cb 0.10 -1.01 0.11 0.00 -0.00 0.00 0.00 39.48 38.68 1dtp n PHE 123 CO 0.00 0.00 0.00 0.82 -0.00 0.00 0.00 176.76 177.58 1dtp h ILE 124 N -1.00 0.12 0.00 -2.13 5.03 -0.54 0.91 117.51 119.90 1dtp h ILE 124 Ca -0.26 0.00 0.00 0.00 -0.12 0.00 0.00 64.86 64.48 1dtp h ILE 124 Cb 1.08 0.12 0.00 0.00 -3.03 0.00 0.00 36.82 34.99 1dtp h ILE 124 CO -0.16 0.00 0.00 1.17 -0.68 0.00 0.00 178.15 178.48 1dtp n LYS 125 N -5.55 0.00 -0.24 2.37 4.81 0.06 -0.29 118.16 119.32 1dtp n LYS 125 Ca 0.13 0.21 0.20 0.00 -0.87 0.00 0.00 58.31 57.98 1dtp n LYS 125 Cb 0.44 -1.08 0.52 0.00 0.02 0.00 0.00 35.03 34.93 1dtp n LYS 125 CO 0.00 0.00 0.00 -0.09 1.17 0.00 0.00 177.40 178.48 1dtp h ARG 126 N 0.00 0.37 -0.00 1.64 2.43 -0.95 -1.61 114.38 116.26 1dtp h ARG 126 Ca 0.00 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 1dtp h ARG 126 Cb 0.00 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.47 1dtp h ARG 126 CO 0.00 0.24 -0.41 1.19 -1.51 0.00 0.00 179.97 179.48 1dtp n PHE 127 N -4.50 0.00 1.40 2.20 3.01 0.23 -4.73 117.46 115.06 1dtp n PHE 127 Ca 0.20 0.00 0.13 0.00 1.01 0.00 0.00 57.45 58.78 1dtp n PHE 127 Cb 0.72 0.00 0.47 0.00 -0.01 0.00 0.00 39.48 40.67 1dtp n PHE 127 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1dtp n GLY 128 N 1.17 0.10 3.28 1.37 0.00 0.61 -4.91 105.19 106.79 1dtp n GLY 128 Ca 0.02 -0.43 -0.17 0.00 0.00 0.00 0.00 46.02 45.44 1dtp n GLY 128 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1dtp n ASP 129 N 0.22 -1.63 0.00 1.61 2.03 -1.26 0.51 116.55 118.02 1dtp n ASP 129 Ca 0.18 -0.19 0.00 0.00 0.52 0.00 0.00 54.79 55.30 1dtp n ASP 129 Cb 0.34 -1.48 0.00 0.00 -0.72 0.00 0.00 41.12 39.27 1dtp n ASP 129 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1dtp n GLY 130 N -0.76 1.91 3.78 0.27 0.00 -1.26 -5.06 105.19 104.07 1dtp n GLY 130 Ca 0.03 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.77 1dtp n GLY 130 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dtp s ALA 131 N -2.00 3.54 0.22 4.61 0.00 0.18 -4.94 121.76 123.38 1dtp s ALA 131 Ca 0.00 -1.14 -0.06 0.00 0.00 0.00 0.00 51.96 50.76 1dtp s ALA 131 Cb 0.00 -1.37 0.19 0.00 0.00 0.00 0.00 23.12 21.95 1dtp s ALA 131 CO 0.00 0.60 1.73 0.77 0.00 0.00 0.00 175.76 178.86 1dtp h SER 132 N 2.80 0.97 -5.11 0.00 0.02 -0.43 -3.43 113.55 108.36 1dtp h SER 132 Ca -0.47 -0.22 -0.03 0.00 -0.84 0.00 0.00 61.79 60.23 1dtp h SER 132 Cb 1.18 -0.26 -0.10 0.00 0.14 0.00 0.00 62.40 63.37 1dtp h SER 132 CO 0.64 0.97 -0.01 0.00 -1.14 0.00 0.00 176.83 177.29 1dtp s ARG 133 N -5.19 1.39 -0.05 3.45 3.03 -1.23 -4.96 118.95 115.39 1dtp s ARG 133 Ca -0.11 -0.94 0.04 0.00 2.03 0.00 0.00 55.73 56.76 1dtp s ARG 133 Cb 0.15 0.51 -0.02 0.00 -1.03 0.00 0.00 34.95 34.55 1dtp s ARG 133 CO 0.84 -0.59 -0.18 0.08 -1.13 0.00 0.00 175.30 174.33 1dtp s VAL 134 N -3.90 2.76 -0.08 4.99 1.01 -1.26 -1.02 120.40 122.90 1dtp s VAL 134 Ca 0.11 -0.83 0.05 0.00 0.00 0.00 0.00 61.98 61.31 1dtp s VAL 134 Cb -0.01 -2.06 -0.01 0.00 0.00 0.00 0.00 36.38 34.30 1dtp s VAL 134 CO -0.01 0.58 -0.24 -0.69 0.00 0.00 0.00 175.10 174.74 1dtp s VAL 135 N -0.54 2.09 0.88 2.92 1.01 -1.17 -4.54 120.40 121.06 1dtp s VAL 135 Ca 0.07 -1.03 -0.13 0.00 0.00 0.00 0.00 61.98 60.89 1dtp s VAL 135 Cb -0.11 -1.78 0.13 0.00 0.00 0.00 0.00 36.38 34.62 1dtp s VAL 135 CO 0.01 0.56 1.21 -0.76 0.00 0.00 0.00 175.10 176.13 1dtp s LEU 136 N 0.12 2.42 -0.20 3.92 1.43 -0.84 -1.49 118.68 124.04 1dtp s LEU 136 Ca -0.12 0.66 -0.14 0.00 -1.03 0.00 0.00 54.13 53.50 1dtp s LEU 136 Cb -0.16 -2.97 0.06 0.00 0.03 0.00 0.00 46.19 43.15 1dtp s LEU 136 CO 0.07 -2.32 0.51 -0.55 0.23 0.00 0.00 176.35 174.28 1dtp s SER 137 N -4.56 -0.61 0.05 2.29 0.15 0.02 -1.91 113.70 109.14 1dtp s SER 137 Ca 0.66 1.07 -0.01 0.00 0.70 0.00 0.00 55.95 58.37 1dtp s SER 137 Cb -0.09 1.01 -0.03 0.00 -1.71 0.00 0.00 66.02 65.19 1dtp s SER 137 CO 0.51 -0.20 -0.01 -0.76 1.20 0.00 0.00 173.24 173.98 1dtp s LEU 138 N 0.96 2.38 1.21 3.45 1.43 -1.14 -1.23 118.68 125.73 1dtp s LEU 138 Ca -0.06 -0.90 -0.19 0.00 -1.03 0.00 0.00 54.13 51.95 1dtp s LEU 138 Cb -0.06 0.25 0.29 0.00 0.03 0.00 0.00 46.19 46.70 1dtp s LEU 138 CO -0.08 -0.57 1.11 -2.84 0.23 0.00 0.00 176.35 174.20 1dtp s PRO 139 N -3.58 -1.25 -0.04 1.29 0.02 -1.26 0.25 135.00 130.43 1dtp s PRO 139 Ca 0.04 -0.08 -0.24 0.00 0.02 0.00 0.00 61.00 60.73 1dtp s PRO 139 Cb 0.05 -1.59 -0.19 0.00 0.02 0.00 0.00 34.50 32.79 1dtp s PRO 139 CO -0.09 -3.73 1.07 0.35 -0.33 0.00 0.00 177.00 174.27 1dtp h PHE 140 N -2.59 -0.10 -1.26 6.54 3.57 -1.54 -3.37 116.94 118.19 1dtp h PHE 140 Ca -0.45 -0.00 0.24 0.00 3.53 0.00 0.00 57.97 61.29 1dtp h PHE 140 Cb 1.29 0.03 -0.23 0.00 2.79 0.00 0.00 35.95 39.83 1dtp h PHE 140 CO -2.17 0.42 0.86 0.00 -2.23 0.00 0.00 178.31 175.19 1dtp s ALA 141 N -3.86 -2.09 -0.08 2.41 0.00 -1.26 -4.96 121.76 111.92 1dtp s ALA 141 Ca -0.15 1.76 -0.39 0.00 0.00 0.00 0.00 51.96 53.17 1dtp s ALA 141 Cb 0.01 -0.79 -0.18 0.00 0.00 0.00 0.00 23.12 22.17 1dtp s ALA 141 CO 0.60 -0.41 1.39 0.39 0.00 0.00 0.00 175.76 177.73 1dtp n GLU 142 N 0.27 0.75 -0.68 0.00 -0.58 -1.26 -1.48 120.64 117.66 1dtp n GLU 142 Ca -0.00 0.27 0.00 0.00 -0.42 0.00 0.00 57.16 57.01 1dtp n GLU 142 Cb 0.58 -1.88 0.00 0.00 -0.57 0.00 0.00 31.44 29.58 1dtp n GLU 142 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1dtp n GLY 143 N 2.80 0.33 3.73 0.62 0.00 -1.26 -4.98 105.19 106.43 1dtp n GLY 143 Ca 0.22 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.83 1dtp n GLY 143 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1dtp s SER 144 N -2.32 7.49 0.00 1.61 0.15 -0.55 -4.99 113.70 115.09 1dtp s SER 144 Ca 0.00 1.79 0.00 0.00 0.70 0.00 0.00 55.95 58.44 1dtp s SER 144 Cb 0.00 -2.59 0.00 0.00 -1.71 0.00 0.00 66.02 61.72 1dtp s SER 144 CO 0.00 -0.06 0.78 -1.54 1.20 0.00 0.00 173.24 173.61 1dtp n SER 145 N 2.78 0.22 -4.90 5.45 3.41 -1.26 -4.62 113.62 114.70 1dtp n SER 145 Ca 0.02 -1.77 -0.29 0.00 -0.26 0.00 0.00 58.87 56.56 1dtp n SER 145 Cb 0.49 -0.11 -0.04 0.00 -0.26 0.00 0.00 64.21 64.29 1dtp n SER 145 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1dtp s SER 146 N -0.87 6.18 0.43 4.04 0.01 -1.26 -5.03 113.70 117.21 1dtp s SER 146 Ca 0.00 0.18 0.08 0.00 1.31 0.00 0.00 55.95 57.52 1dtp s SER 146 Cb 0.00 -1.85 -0.01 0.00 0.21 0.00 0.00 66.02 64.38 1dtp s SER 146 CO 0.00 0.14 0.44 0.68 0.41 0.00 0.00 173.24 174.91 1dtp s VAL 147 N -1.56 2.64 0.04 3.43 -7.23 -1.26 -1.60 120.40 114.85 1dtp s VAL 147 Ca 0.34 -1.26 0.07 0.00 -1.81 0.00 0.00 61.98 59.32 1dtp s VAL 147 Cb -0.12 -2.90 -0.03 0.00 0.56 0.00 0.00 36.38 33.89 1dtp s VAL 147 CO 0.27 0.00 -0.21 -0.70 -0.31 0.00 0.00 175.10 174.15 1dtp s GLU 148 N -4.21 1.39 -0.19 4.82 2.12 0.14 -3.41 118.70 119.35 1dtp s GLU 148 Ca 0.49 -0.95 0.01 0.00 0.36 0.00 0.00 54.97 54.89 1dtp s GLU 148 Cb -0.05 -1.50 0.03 0.00 0.26 0.00 0.00 34.13 32.88 1dtp s GLU 148 CO 0.29 0.38 -0.14 0.71 -0.54 0.00 0.00 175.26 175.97 1dtp s TYR 149 N -0.81 2.55 -0.43 5.30 2.02 0.55 -2.90 117.35 123.63 1dtp s TYR 149 Ca 0.07 -1.61 -0.15 0.00 -0.37 0.00 0.00 57.07 55.01 1dtp s TYR 149 Cb -0.09 -1.73 0.04 0.00 -0.40 0.00 0.00 41.96 39.77 1dtp s TYR 149 CO 0.02 -0.76 0.33 0.42 -1.57 0.00 0.00 175.55 173.99 1dtp s ILE 150 N 1.36 5.25 0.06 2.71 1.01 -0.80 -2.06 121.20 128.72 1dtp s ILE 150 Ca 0.01 -0.78 -0.27 0.00 0.00 0.00 0.00 60.65 59.61 1dtp s ILE 150 Cb -0.15 -3.99 -0.05 0.00 0.01 0.00 0.00 42.46 38.28 1dtp s ILE 150 CO -0.10 -0.39 0.86 0.20 0.00 0.00 0.00 174.94 175.52 1dtp s ASN 151 N 1.95 7.34 0.78 3.58 0.01 0.16 -1.98 114.94 126.77 1dtp s ASN 151 Ca 0.05 1.60 -0.14 0.00 -0.71 0.00 0.00 52.86 53.66 1dtp s ASN 151 Cb -0.21 -2.53 0.07 0.00 0.41 0.00 0.00 41.25 39.00 1dtp s ASN 151 CO 0.09 -0.05 1.20 0.21 -1.51 0.00 0.00 177.10 177.04 1dtp s ASN 152 N 0.10 3.79 0.26 -1.22 3.84 -1.26 -1.55 114.94 118.88 1dtp s ASN 152 Ca 0.43 2.35 0.02 0.00 0.21 0.00 0.00 52.86 55.87 1dtp s ASN 152 Cb -0.22 -2.59 0.32 0.00 -0.55 0.00 0.00 41.25 38.22 1dtp s ASN 152 CO 0.26 -2.54 1.65 -0.50 -2.79 0.00 0.00 177.10 173.19 1dtp h TRP 153 N -0.73 0.54 0.06 0.43 -0.00 -1.82 -3.00 115.95 111.43 1dtp h TRP 153 Ca -0.47 -0.14 -0.12 0.00 -0.00 0.00 0.00 58.89 58.17 1dtp h TRP 153 Cb 1.29 -0.12 0.00 0.00 -0.00 0.00 0.00 29.16 30.34 1dtp h TRP 153 CO 0.47 0.77 -0.55 0.93 -0.00 0.00 0.00 178.44 180.05 1dtp h GLU 154 N 0.39 0.14 0.00 0.49 4.39 -1.94 -3.21 114.58 114.84 1dtp h GLU 154 Ca 0.04 -0.23 0.00 0.00 0.34 0.00 0.00 59.36 59.51 1dtp h GLU 154 Cb 0.82 0.09 0.00 0.00 -0.10 0.00 0.00 28.75 29.55 1dtp h GLU 154 CO 0.07 1.11 0.00 1.04 -1.16 0.00 0.00 179.01 180.07 1dtp n GLN 155 N -4.35 0.07 0.12 2.33 1.13 -1.26 -2.02 117.38 113.41 1dtp n GLN 155 Ca -0.15 0.23 0.12 0.00 -1.94 0.00 0.00 57.00 55.25 1dtp n GLN 155 Cb 0.67 -1.50 0.03 0.00 0.11 0.00 0.00 30.24 29.54 1dtp n GLN 155 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1dtp h ALA 156 N 2.23 0.57 -0.45 -1.58 0.00 -1.52 -3.39 119.26 115.13 1dtp h ALA 156 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1dtp h ALA 156 Cb 0.04 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1dtp h ALA 156 CO 0.00 0.00 0.26 0.87 0.00 0.00 0.00 179.25 180.38 1dtp h LYS 157 N 0.00 0.61 -2.13 0.00 6.56 -1.54 -2.98 116.57 117.10 1dtp h LYS 157 Ca 0.00 -0.06 -0.03 0.00 -1.06 0.00 0.00 60.65 59.50 1dtp h LYS 157 Cb 0.99 -0.13 -0.01 0.00 -0.57 0.00 0.00 32.23 32.52 1dtp h LYS 157 CO 0.00 0.47 -0.00 0.00 -2.06 0.00 0.00 179.45 177.85 1dtp n ALA 158 N -2.25 3.28 -2.66 3.86 0.00 -1.26 -4.37 120.51 117.10 1dtp n ALA 158 Ca 0.01 -0.31 -0.23 0.00 0.00 0.00 0.00 53.44 52.92 1dtp n ALA 158 Cb 0.06 -1.68 -0.06 0.00 0.00 0.00 0.00 19.45 17.77 1dtp n ALA 158 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1dtp s LEU 159 N 0.00 3.40 0.25 0.00 1.43 -1.13 -4.36 118.68 118.27 1dtp s LEU 159 Ca 0.11 -0.56 0.10 0.00 -1.03 0.00 0.00 54.13 52.76 1dtp s LEU 159 Cb 0.05 -1.92 -0.05 0.00 0.03 0.00 0.00 46.19 44.31 1dtp s LEU 159 CO 0.00 -0.10 -0.18 -0.94 0.23 0.00 0.00 176.35 175.36 1dtp s SER 160 N -3.78 3.19 -0.06 2.29 1.04 0.29 -4.78 113.70 111.90 1dtp s SER 160 Ca 0.34 -1.03 -0.01 0.00 0.48 0.00 0.00 55.95 55.73 1dtp s SER 160 Cb -0.06 -0.24 0.03 0.00 0.10 0.00 0.00 66.02 65.85 1dtp s SER 160 CO 0.22 -0.04 -0.00 -0.69 0.98 0.00 0.00 173.24 173.71 1dtp s VAL 161 N -2.69 0.37 0.21 5.02 1.01 -1.26 -0.75 120.40 122.30 1dtp s VAL 161 Ca 0.27 0.09 0.11 0.00 0.00 0.00 0.00 61.98 62.45 1dtp s VAL 161 Cb -0.03 -0.50 -0.05 0.00 0.00 0.00 0.00 36.38 35.81 1dtp s VAL 161 CO 0.12 0.24 -0.23 -0.70 0.00 0.00 0.00 175.10 174.53 1dtp s GLU 162 N 1.68 1.56 -0.32 2.72 2.56 -0.61 -4.88 118.70 121.42 1dtp s GLU 162 Ca 0.00 -1.56 -0.29 0.00 0.00 0.00 0.00 54.97 53.12 1dtp s GLU 162 Cb -0.13 -1.84 -0.01 0.00 2.00 0.00 0.00 34.13 34.15 1dtp s GLU 162 CO -0.04 0.39 1.59 -0.51 -0.56 0.00 0.00 175.26 176.13 1dtp s LEU 163 N -2.83 3.66 -0.06 2.70 1.43 -1.26 -1.97 118.68 120.36 1dtp s LEU 163 Ca 0.22 1.24 -0.26 0.00 -1.03 0.00 0.00 54.13 54.30 1dtp s LEU 163 Cb -0.07 -3.53 -0.22 0.00 0.03 0.00 0.00 46.19 42.39 1dtp s LEU 163 CO 0.11 -1.45 1.07 -0.33 0.23 0.00 0.00 176.35 175.97 1dtp h GLU 164 N 11.36 0.05 -3.36 1.70 4.39 -1.21 -3.46 114.58 124.05 1dtp h GLU 164 Ca -0.31 -0.04 -0.03 0.00 0.34 0.00 0.00 59.36 59.32 1dtp h GLU 164 Cb 1.14 0.01 -0.10 0.00 -0.10 0.00 0.00 28.75 29.70 1dtp h GLU 164 CO 1.04 0.74 -0.00 -1.50 -1.16 0.00 0.00 179.01 178.13 1dtp s ILE 165 N -3.40 0.03 -0.32 3.13 2.07 -1.08 -4.94 121.20 116.70 1dtp s ILE 165 Ca -0.17 -0.83 0.01 0.00 -1.41 0.00 0.00 60.65 58.25 1dtp s ILE 165 Cb 0.00 -1.60 0.14 0.00 0.13 0.00 0.00 42.46 41.14 1dtp s ILE 165 CO 0.70 -0.14 0.33 0.21 -1.91 0.00 0.00 174.94 174.12 1dtp s ASN 166 N -2.88 1.47 0.00 4.50 2.47 -1.26 -0.63 114.94 118.61 1dtp s ASN 166 Ca 0.10 -1.03 0.30 0.00 0.42 0.00 0.00 52.86 52.65 1dtp s ASN 166 Cb -0.01 0.54 1.43 0.00 -1.45 0.00 0.00 41.25 41.76 1dtp s ASN 166 CO -0.03 -0.34 1.98 0.49 -3.72 0.00 0.00 177.10 175.48 1dtp n PHE 167 N 4.95 0.00 0.31 0.43 3.72 0.26 -3.82 117.46 123.31 1dtp n PHE 167 Ca 0.03 0.00 0.16 0.00 -0.05 0.00 0.00 57.45 57.58 1dtp n PHE 167 Cb 0.46 -0.18 0.71 0.00 -0.94 0.00 0.00 39.48 39.53 1dtp n PHE 167 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 176.76 178.20 1dtp h GLU 168 N 0.35 0.00 0.03 -1.08 4.81 0.40 -2.48 114.58 116.62 1dtp h GLU 168 Ca 0.00 0.00 -0.22 0.00 -0.13 0.00 0.00 59.36 59.01 1dtp h GLU 168 Cb 0.28 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.65 1dtp h GLU 168 CO 0.00 0.00 -0.99 1.79 -0.73 0.00 0.00 179.01 179.08 1dtp h THR 169 N 0.00 1.53 0.00 0.32 1.35 -1.83 -3.31 112.91 110.96 1dtp h THR 169 Ca 0.00 -2.85 0.00 0.00 -0.55 0.00 0.00 66.41 63.01 1dtp h THR 169 Cb 0.31 2.65 0.00 0.00 -1.73 0.00 0.00 68.15 69.37 1dtp h THR 169 CO 0.00 0.83 0.00 0.54 -0.25 0.00 0.00 175.52 176.64 1dtp n ARG 170 N -3.58 0.81 0.00 4.72 1.74 -0.93 -4.86 116.66 114.56 1dtp n ARG 170 Ca -0.04 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.04 1dtp n ARG 170 Cb 0.89 -1.36 0.00 0.00 -1.02 0.00 0.00 32.46 30.97 1dtp n ARG 170 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1dtp n GLY 171 N 0.12 0.10 0.28 -0.13 0.00 -1.25 0.17 105.19 104.48 1dtp n GLY 171 Ca 0.00 0.06 -0.03 0.00 0.00 0.00 0.00 46.02 46.05 1dtp n GLY 171 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1dtp h LYS 172 N 0.00 0.69 -0.21 1.61 5.09 -1.89 -2.59 116.57 119.27 1dtp h LYS 172 Ca 0.00 -0.18 0.00 0.00 0.09 0.00 0.00 60.65 60.56 1dtp h LYS 172 Cb 0.00 -0.08 0.00 0.00 0.10 0.00 0.00 32.23 32.25 1dtp h LYS 172 CO 0.00 0.73 0.00 -2.13 -2.09 0.00 0.00 179.45 175.96 1dtp n ARG 173 N -4.22 1.68 0.29 0.07 0.63 0.44 -3.27 116.66 112.27 1dtp n ARG 173 Ca 0.02 -1.04 -0.16 0.00 -0.92 0.00 0.00 57.85 55.75 1dtp n ARG 173 Cb 0.30 -1.33 -0.09 0.00 0.45 0.00 0.00 32.46 31.79 1dtp n ARG 173 CO 0.00 0.00 0.00 0.78 -2.51 0.00 0.00 177.63 175.90 1dtp h GLY 174 N 5.15 -1.21 1.57 5.14 0.00 0.07 -1.07 103.07 112.72 1dtp h GLY 174 Ca 0.00 0.54 0.06 0.00 0.00 0.00 0.00 47.33 47.93 1dtp h GLY 174 CO 0.00 -0.37 0.16 1.46 0.00 0.00 0.00 176.54 177.78 1dtp h GLN 175 N -0.93 0.00 0.00 4.80 4.20 0.15 0.46 115.11 123.79 1dtp h GLN 175 Ca -0.07 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.64 1dtp h GLN 175 Cb 0.79 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.57 1dtp h GLN 175 CO -0.02 0.00 0.00 -0.25 -0.67 0.00 0.00 178.83 177.89 1dtp n ASP 176 N -4.32 0.00 -0.20 1.46 9.92 -1.15 -3.57 116.55 118.68 1dtp n ASP 176 Ca 0.02 0.38 0.13 0.00 -0.53 0.00 0.00 54.79 54.79 1dtp n ASP 176 Cb 0.30 -0.29 0.25 0.00 -0.64 0.00 0.00 41.12 40.73 1dtp n ASP 176 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1dtp n ALA 177 N -1.38 0.44 -0.26 2.24 0.00 -0.42 0.31 120.51 121.44 1dtp n ALA 177 Ca 0.00 0.63 0.21 0.00 0.00 0.00 0.00 53.44 54.29 1dtp n ALA 177 Cb 0.00 -0.53 0.54 0.00 0.00 0.00 0.00 19.45 19.46 1dtp n ALA 177 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.50 179.48 1dtp h MET 178 N 0.00 0.34 -0.53 0.00 -1.53 -0.99 -1.91 114.93 110.31 1dtp h MET 178 Ca 0.43 -0.02 -0.06 0.00 -3.44 0.00 0.00 59.70 56.60 1dtp h MET 178 Cb 1.00 -0.08 -0.02 0.00 -0.55 0.00 0.00 31.60 31.95 1dtp h MET 178 CO -0.52 0.22 0.07 1.88 0.14 0.00 0.00 176.91 178.70 1dtp h TYR 179 N 0.35 0.89 -0.34 1.39 0.05 -0.20 0.18 116.97 119.29 1dtp h TYR 179 Ca 0.49 -0.11 -0.02 0.00 0.05 0.00 0.00 58.73 59.15 1dtp h TYR 179 Cb 1.34 -0.25 -0.02 0.00 1.01 0.00 0.00 36.73 38.81 1dtp h TYR 179 CO -0.00 0.78 0.14 1.49 -1.05 0.00 0.00 178.16 179.52 1dtp h GLU 180 N 0.81 0.51 0.26 4.88 4.81 -1.46 0.42 114.58 124.80 1dtp h GLU 180 Ca 0.17 -0.09 -0.00 0.00 -0.13 0.00 0.00 59.36 59.30 1dtp h GLU 180 Cb 0.38 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.67 1dtp h GLU 180 CO 0.01 0.50 -0.21 -0.92 -0.73 0.00 0.00 179.01 177.67 1dtp h TYR 181 N 0.40 -0.54 0.00 0.92 3.20 -1.07 -1.05 116.97 118.83 1dtp h TYR 181 Ca 0.11 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.98 1dtp h TYR 181 Cb 0.18 0.20 0.00 0.00 1.54 0.00 0.00 36.73 38.66 1dtp h TYR 181 CO -0.00 -0.31 0.00 -1.33 -1.64 0.00 0.00 178.16 174.87 1dtp n MET 182 N -5.33 0.03 0.00 1.82 2.81 0.56 -0.71 117.12 116.30 1dtp n MET 182 Ca -0.09 0.30 0.14 0.00 -1.81 0.00 0.00 57.70 56.24 1dtp n MET 182 Cb 0.24 -1.50 0.59 0.00 -0.71 0.00 0.00 33.22 31.84 1dtp n MET 182 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1dtp n ALA 183 N -1.45 2.63 0.24 3.04 0.00 0.11 -3.79 120.51 121.28 1dtp n ALA 183 Ca 0.03 -0.40 0.14 0.00 0.00 0.00 0.00 53.44 53.21 1dtp n ALA 183 Cb 0.11 -1.23 0.42 0.00 0.00 0.00 0.00 19.45 18.76 1dtp n ALA 183 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1dtp h GLN 184 N 1.82 0.00 0.06 0.00 4.20 -0.82 -3.35 115.11 117.02 1dtp h GLN 184 Ca 0.00 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.71 1dtp h GLN 184 Cb 0.41 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.19 1dtp h GLN 184 CO 0.00 0.05 -0.03 0.00 -0.67 0.00 0.00 178.83 178.18 1dtp h ALA 185 N 1.95 -0.08 0.00 3.87 0.00 -1.77 0.61 119.26 123.84 1dtp h ALA 185 Ca -0.00 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1dtp h ALA 185 Cb 0.77 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.60 1dtp h ALA 185 CO 0.01 -0.43 0.00 0.00 0.00 0.00 0.00 179.25 178.83 1dtp n ALA 187 N -1.82 2.92 0.00 0.00 0.00 -0.72 -4.84 120.51 116.05 1dtp n ALA 187 Ca -0.01 -2.77 0.00 0.00 0.00 0.00 0.00 53.44 50.66 1dtp n ALA 187 Cb 0.06 -0.43 0.00 0.00 0.00 0.00 0.00 19.45 19.08 1dtp n ALA 187 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1dtp n GLY 188 N -0.88 -0.97 0.36 0.00 0.00 0.21 -4.81 105.19 99.09 1dtp n GLY 188 Ca 0.15 0.31 0.07 0.00 0.00 0.00 0.00 46.02 46.55 1dtp n GLY 188 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1dtp n ASN 189 N 0.00 1.65 0.00 1.61 5.03 -0.34 -4.46 115.26 118.76 1dtp n ASN 189 Ca 0.00 -2.94 0.00 0.00 0.87 0.00 0.00 54.58 52.51 1dtp n ASN 189 Cb 0.00 -0.39 0.00 0.00 -1.02 0.00 0.00 39.78 38.37 1dtp n ASN 189 CO 0.00 0.00 0.00 -2.11 -1.83 0.00 0.00 177.26 173.32