#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dfd s ARG 2 N 0.00 3.82 0.00 0.00 1.70 -1.26 -4.81 118.95 118.41 1dfd s ARG 2 Ca 0.00 1.31 0.00 0.00 -0.47 0.00 0.00 55.73 56.57 1dfd s ARG 2 Cb 0.00 -3.95 0.00 0.00 -0.57 0.00 0.00 34.95 30.43 1dfd s ARG 2 CO 0.00 -1.24 0.00 1.17 -1.08 0.00 0.00 175.30 174.15 1dfd n LYS 3 N 7.53 1.98 -3.15 3.89 4.81 -0.51 -4.97 118.16 127.73 1dfd n LYS 3 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.60 1dfd n LYS 3 Cb 0.46 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.51 1dfd n LYS 3 CO 0.00 0.00 0.00 1.97 1.17 0.00 0.00 177.40 180.54 1dfd n PHE 4 N -0.34 0.00 -0.58 5.64 -1.74 -1.25 -1.35 117.46 117.84 1dfd n PHE 4 Ca 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.89 1dfd n PHE 4 Cb 0.00 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.00 1dfd n PHE 4 CO 0.00 0.00 0.00 2.48 -0.56 0.00 0.00 176.76 178.68 1dfd n TYR 5 N 1.32 0.00 -3.93 2.97 0.18 -1.26 -4.54 117.16 111.89 1dfd n TYR 5 Ca 0.00 0.00 -0.09 0.00 1.88 0.00 0.00 57.90 59.69 1dfd n TYR 5 Cb 0.00 0.00 -0.09 0.00 -0.38 0.00 0.00 39.34 38.87 1dfd n TYR 5 CO 0.00 0.00 0.00 0.08 -2.08 0.00 0.00 176.86 174.86 1dfd s VAL 6 N -2.17 0.14 -1.05 -3.48 1.01 -1.26 -1.44 120.40 112.14 1dfd s VAL 6 Ca 0.00 -1.15 -0.05 0.00 0.00 0.00 0.00 61.98 60.78 1dfd s VAL 6 Cb 0.00 -0.97 0.29 0.00 0.00 0.00 0.00 36.38 35.70 1dfd s VAL 6 CO 0.00 -0.63 1.24 0.47 0.00 0.00 0.00 175.10 176.17 1dfd n ASP 7 N 0.66 5.73 -0.11 3.32 9.92 -1.08 -4.74 116.55 130.25 1dfd n ASP 7 Ca -0.18 -3.25 0.24 0.00 -0.53 0.00 0.00 54.79 51.07 1dfd n ASP 7 Cb 0.59 -1.26 0.40 0.00 -0.64 0.00 0.00 41.12 40.21 1dfd n ASP 7 CO 0.00 0.00 0.00 0.06 0.13 0.00 0.00 177.20 177.39 1dfd h GLN 8 N 5.88 0.00 -0.63 -1.24 -0.00 -1.89 1.09 115.11 118.33 1dfd h GLN 8 Ca 0.19 0.00 0.16 0.00 -0.00 0.00 0.00 58.65 59.00 1dfd h GLN 8 Cb 0.73 0.00 -0.03 0.00 -0.00 0.00 0.00 27.48 28.18 1dfd h GLN 8 CO 1.14 0.00 0.44 -0.44 -0.00 0.00 0.00 178.83 179.97 1dfd h ASP 9 N 0.00 0.11 -0.70 0.06 3.32 -1.89 0.65 116.42 117.97 1dfd h ASP 9 Ca 0.40 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.46 1dfd h ASP 9 Cb 2.67 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 42.20 1dfd h ASP 9 CO -0.00 0.06 0.00 1.21 -1.72 0.00 0.00 179.24 178.78 1dfd n GLU 10 N -4.40 3.00 -2.52 3.56 4.07 0.38 -4.93 120.64 119.80 1dfd n GLU 10 Ca 0.12 -2.71 -0.43 0.00 -0.06 0.00 0.00 57.16 54.09 1dfd n GLU 10 Cb 0.62 -1.64 -0.02 0.00 -0.06 0.00 0.00 31.44 30.33 1dfd n GLU 10 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1dfd n ILE 12 N 5.06 0.00 -2.58 0.00 -5.35 -1.26 -4.91 119.36 110.33 1dfd n ILE 12 Ca 0.12 0.00 -0.33 0.00 -0.27 0.00 0.00 62.75 62.27 1dfd n ILE 12 Cb 0.46 0.00 -0.00 0.00 -1.74 0.00 0.00 39.64 38.36 1dfd n ILE 12 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1dfd n ALA 13 N -3.00 5.44 -2.50 -1.28 0.00 -1.26 -4.94 120.51 112.97 1dfd n ALA 13 Ca 0.00 -4.49 -0.09 0.00 0.00 0.00 0.00 53.44 48.87 1dfd n ALA 13 Cb 0.00 -1.26 -0.10 0.00 0.00 0.00 0.00 19.45 18.09 1dfd n ALA 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1dfd n GLU 15 N 0.78 1.57 -0.22 0.00 0.28 -1.26 -4.81 120.64 116.98 1dfd n GLU 15 Ca -0.18 -2.65 -0.12 0.00 -0.16 0.00 0.00 57.16 54.05 1dfd n GLU 15 Cb 0.58 -1.56 -0.09 0.00 1.43 0.00 0.00 31.44 31.80 1dfd n GLU 15 CO 0.00 0.00 0.00 1.03 -0.16 0.00 0.00 177.13 178.00 1dfd h SER 16 N 0.34 -1.80 -0.61 -1.84 0.87 -1.96 0.26 113.55 108.82 1dfd h SER 16 Ca 0.00 0.25 0.13 0.00 -1.23 0.00 0.00 61.79 60.94 1dfd h SER 16 Cb 1.08 0.76 -0.11 0.00 -0.44 0.00 0.00 62.40 63.70 1dfd h SER 16 CO 0.04 -0.31 -0.03 0.00 -0.53 0.00 0.00 176.83 176.00 1dfd h VAL 18 N 0.09 0.56 -0.08 0.00 2.07 -0.78 0.43 116.25 118.54 1dfd h VAL 18 Ca 0.31 -0.15 -0.20 0.00 0.82 0.00 0.00 66.70 67.49 1dfd h VAL 18 Cb 0.50 0.10 -0.00 0.00 -1.52 0.00 0.00 31.29 30.37 1dfd h VAL 18 CO -0.54 0.08 -0.76 -0.33 0.02 0.00 0.00 177.57 176.03 1dfd h GLU 19 N 0.42 0.47 -0.36 1.57 3.07 0.99 -0.31 114.58 120.43 1dfd h GLU 19 Ca 0.57 -0.40 0.00 0.00 -0.50 0.00 0.00 59.36 59.04 1dfd h GLU 19 Cb 1.41 0.09 0.00 0.00 -0.84 0.00 0.00 28.75 29.41 1dfd h GLU 19 CO -0.28 1.03 0.00 -0.89 -1.40 0.00 0.00 179.01 177.47 1dfd n ILE 20 N -3.84 0.35 -2.69 3.13 -0.00 0.12 -4.20 119.36 112.23 1dfd n ILE 20 Ca -0.05 -0.27 -0.05 0.00 -0.00 0.00 0.00 62.75 62.38 1dfd n ILE 20 Cb 0.73 -0.02 0.08 0.00 -0.00 0.00 0.00 39.64 40.43 1dfd n ILE 20 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1dfd n ALA 21 N 0.06 -2.68 -0.75 -1.39 0.00 0.42 -4.47 120.51 111.71 1dfd n ALA 21 Ca 0.06 -0.70 -0.18 0.00 0.00 0.00 0.00 53.44 52.62 1dfd n ALA 21 Cb 0.23 -2.55 -0.05 0.00 0.00 0.00 0.00 19.45 17.08 1dfd n ALA 21 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1dfd n PRO 22 N 1.17 1.94 0.00 0.00 -0.04 -0.18 -2.28 135.00 135.61 1dfd n PRO 22 Ca 0.02 -1.23 0.00 0.00 -0.04 0.00 0.00 63.50 62.25 1dfd n PRO 22 Cb 0.70 -2.25 0.00 0.00 -0.04 0.00 0.00 33.50 31.91 1dfd n PRO 22 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1dfd n GLY 23 N 3.36 0.00 0.08 0.55 0.00 -1.26 -4.95 105.19 102.97 1dfd n GLY 23 Ca 0.41 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.44 1dfd n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dfd n ALA 24 N -0.23 2.05 -2.84 4.61 0.00 -1.10 -4.06 120.51 118.94 1dfd n ALA 24 Ca 0.00 -0.72 -0.28 0.00 0.00 0.00 0.00 53.44 52.44 1dfd n ALA 24 Cb 0.00 -0.73 -0.16 0.00 0.00 0.00 0.00 19.45 18.56 1dfd n ALA 24 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1dfd s PHE 25 N -2.97 1.97 -0.18 0.00 2.19 -0.97 -0.93 117.98 117.10 1dfd s PHE 25 Ca -0.06 -0.58 -0.28 0.00 0.33 0.00 0.00 56.93 56.35 1dfd s PHE 25 Cb 0.09 -1.31 0.09 0.00 -1.31 0.00 0.00 43.02 40.58 1dfd s PHE 25 CO 0.84 -0.18 0.81 0.00 1.83 0.00 0.00 175.22 178.52 1dfd s ALA 26 N -0.04 -1.84 0.51 11.12 0.00 -0.91 -4.60 121.76 126.00 1dfd s ALA 26 Ca -0.04 1.68 -0.18 0.00 0.00 0.00 0.00 51.96 53.43 1dfd s ALA 26 Cb -0.12 -0.75 -0.08 0.00 0.00 0.00 0.00 23.12 22.17 1dfd s ALA 26 CO 0.03 -0.33 1.00 1.41 0.00 0.00 0.00 175.76 177.88 1dfd s MET 27 N -0.44 3.84 0.27 0.00 1.75 -1.26 -0.28 119.30 123.17 1dfd s MET 27 Ca -0.03 1.13 0.09 0.00 -1.25 0.00 0.00 55.69 55.62 1dfd s MET 27 Cb -0.03 -2.11 -0.05 0.00 2.84 0.00 0.00 34.83 35.48 1dfd s MET 27 CO 0.03 -0.37 -0.12 0.34 -0.65 0.00 0.00 175.02 174.24 1dfd s ASP 28 N -2.61 3.03 0.17 1.11 2.15 -0.68 -4.79 116.67 115.06 1dfd s ASP 28 Ca 0.62 -1.10 0.25 0.00 0.43 0.00 0.00 52.55 52.75 1dfd s ASP 28 Cb -0.12 -0.21 0.55 0.00 -0.30 0.00 0.00 42.92 42.83 1dfd s ASP 28 CO 0.26 -0.18 1.54 1.55 -0.17 0.00 0.00 175.17 178.17 1dfd h PRO 29 N 2.32 0.00 0.07 4.34 0.13 -1.94 3.76 132.00 140.68 1dfd h PRO 29 Ca -0.40 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.42 1dfd h PRO 29 Cb 1.24 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.34 1dfd h PRO 29 CO 0.64 0.00 -1.72 1.49 -0.23 0.00 0.00 178.00 178.19 1dfd h GLU 30 N 0.00 0.14 -0.01 0.86 4.81 -1.96 -3.33 114.58 115.08 1dfd h GLU 30 Ca 0.00 -0.24 0.00 0.00 -0.13 0.00 0.00 59.36 58.99 1dfd h GLU 30 Cb 0.75 0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.22 1dfd h GLU 30 CO 0.00 0.88 -0.15 0.44 -0.73 0.00 0.00 179.01 179.45 1dfd n ILE 31 N -3.29 0.00 -2.93 2.32 -5.35 -1.20 -4.94 119.36 103.97 1dfd n ILE 31 Ca -0.20 -0.42 -0.17 0.00 -0.27 0.00 0.00 62.75 61.69 1dfd n ILE 31 Cb 1.04 1.23 -0.03 0.00 -1.74 0.00 0.00 39.64 40.14 1dfd n ILE 31 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1dfd n GLU 32 N 0.30 -1.64 -3.55 6.28 1.02 1.24 -4.73 120.64 119.56 1dfd n GLU 32 Ca 0.07 0.05 -0.15 0.00 -0.02 0.00 0.00 57.16 57.11 1dfd n GLU 32 Cb 0.33 -3.51 -0.05 0.00 -0.02 0.00 0.00 31.44 28.18 1dfd n GLU 32 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1dfd s LYS 33 N -4.80 1.05 0.44 3.49 -0.14 -1.04 -4.77 119.74 113.97 1dfd s LYS 33 Ca 0.32 -0.04 -0.25 0.00 -1.36 0.00 0.00 55.97 54.64 1dfd s LYS 33 Cb -0.19 0.48 -0.08 0.00 -1.68 0.00 0.00 37.83 36.36 1dfd s LYS 33 CO 0.40 -0.36 1.40 0.00 -0.76 0.00 0.00 175.35 176.03 1dfd s ALA 34 N -1.96 3.25 0.19 5.17 0.00 -1.25 -1.68 121.76 125.48 1dfd s ALA 34 Ca -0.08 1.42 -0.05 0.00 0.00 0.00 0.00 51.96 53.25 1dfd s ALA 34 Cb -0.01 -3.57 -0.03 0.00 0.00 0.00 0.00 23.12 19.52 1dfd s ALA 34 CO 0.03 -1.11 0.23 1.52 0.00 0.00 0.00 175.76 176.42 1dfd s TYR 35 N -1.21 0.80 -1.27 0.00 1.13 0.61 -4.21 117.35 113.20 1dfd s TYR 35 Ca 0.60 -1.10 -0.15 0.00 -1.41 0.00 0.00 57.07 55.01 1dfd s TYR 35 Cb -0.43 -0.29 0.12 0.00 -1.10 0.00 0.00 41.96 40.27 1dfd s TYR 35 CO 0.55 -0.72 1.65 0.28 -2.51 0.00 0.00 175.55 174.80 1dfd n VAL 36 N -0.26 4.09 0.72 -3.49 0.31 -1.25 -2.15 118.33 116.30 1dfd n VAL 36 Ca -0.02 -4.33 0.07 0.00 -0.01 0.00 0.00 64.34 60.05 1dfd n VAL 36 Cb 0.64 -2.42 0.37 0.00 -0.91 0.00 0.00 33.84 31.52 1dfd n VAL 36 CO 0.00 0.00 0.00 2.29 -1.32 0.00 0.00 176.83 177.80 1dfd n LYS 37 N 6.59 0.28 0.00 5.55 2.85 -0.10 -4.69 118.16 128.63 1dfd n LYS 37 Ca 0.43 0.10 0.00 0.00 -1.05 0.00 0.00 58.31 57.79 1dfd n LYS 37 Cb 0.43 -1.50 0.00 0.00 -0.65 0.00 0.00 35.03 33.31 1dfd n LYS 37 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 1dfd n ASP 38 N -1.19 0.00 0.07 -5.58 2.03 -1.18 -4.94 116.55 105.76 1dfd n ASP 38 Ca 0.08 0.00 -0.08 0.00 0.52 0.00 0.00 54.79 55.31 1dfd n ASP 38 Cb 0.09 0.00 -0.11 0.00 -0.72 0.00 0.00 41.12 40.38 1dfd n ASP 38 CO 0.00 0.00 0.00 -0.37 -1.92 0.00 0.00 177.20 174.91 1dfd h VAL 39 N 0.00 1.68 -0.00 5.18 -1.51 -1.86 -3.15 116.25 116.59 1dfd h VAL 39 Ca 0.00 -3.31 0.00 0.00 -1.23 0.00 0.00 66.70 62.16 1dfd h VAL 39 Cb 0.00 2.82 0.00 0.00 -2.13 0.00 0.00 31.29 31.98 1dfd h VAL 39 CO 0.00 0.95 -0.20 -0.62 -1.23 0.00 0.00 177.57 176.47 1dfd n GLU 40 N -3.40 0.03 0.31 5.19 1.02 -1.26 -3.55 120.64 118.98 1dfd n GLU 40 Ca -0.01 -0.01 0.19 0.00 -0.02 0.00 0.00 57.16 57.31 1dfd n GLU 40 Cb 0.93 -1.50 1.03 0.00 -0.02 0.00 0.00 31.44 31.88 1dfd n GLU 40 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 1dfd h GLY 41 N 5.00 0.00 -5.50 0.62 0.00 -1.77 -3.41 103.07 98.00 1dfd h GLY 41 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 47.33 47.00 1dfd h GLY 41 CO 0.00 0.00 -0.75 0.00 0.00 0.00 0.00 176.54 175.79 1dfd s ALA 42 N -4.19 0.42 0.71 3.60 0.00 -1.23 -3.76 121.76 117.30 1dfd s ALA 42 Ca -0.04 -0.17 -0.12 0.00 0.00 0.00 0.00 51.96 51.63 1dfd s ALA 42 Cb 0.13 -0.14 0.02 0.00 0.00 0.00 0.00 23.12 23.13 1dfd s ALA 42 CO 0.48 0.08 1.08 -1.12 0.00 0.00 0.00 175.76 176.28 1dfd s SER 43 N 0.03 5.01 0.25 0.00 0.01 -1.26 -4.53 113.70 113.21 1dfd s SER 43 Ca 0.00 1.81 -0.05 0.00 1.31 0.00 0.00 55.95 59.01 1dfd s SER 43 Cb -0.04 -2.52 0.47 0.00 0.21 0.00 0.00 66.02 64.14 1dfd s SER 43 CO -0.00 -1.70 1.66 -0.61 0.41 0.00 0.00 173.24 173.00 1dfd h GLN 44 N -0.59 0.17 0.00 12.44 4.15 -1.98 2.20 115.11 131.50 1dfd h GLN 44 Ca -0.45 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 58.96 1dfd h GLN 44 Cb 1.23 -0.04 0.00 0.00 0.21 0.00 0.00 27.48 28.88 1dfd h GLN 44 CO 0.54 0.11 0.00 0.39 -1.93 0.00 0.00 178.83 177.94 1dfd n GLU 45 N -5.26 0.02 -0.11 1.69 -0.58 -1.26 -0.08 120.64 115.06 1dfd n GLU 45 Ca 0.14 0.31 -0.20 0.00 -0.42 0.00 0.00 57.16 56.99 1dfd n GLU 45 Cb 0.49 -1.50 -0.12 0.00 -0.57 0.00 0.00 31.44 29.74 1dfd n GLU 45 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 1dfd n GLU 46 N -1.48 0.66 -0.30 3.49 1.02 0.68 -2.40 120.64 122.31 1dfd n GLU 46 Ca 0.03 0.20 -0.05 0.00 -0.02 0.00 0.00 57.16 57.32 1dfd n GLU 46 Cb 0.12 -1.56 0.07 0.00 -0.02 0.00 0.00 31.44 30.05 1dfd n GLU 46 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1dfd h VAL 47 N -0.17 1.25 0.22 2.62 2.07 0.11 0.34 116.25 122.68 1dfd h VAL 47 Ca -0.56 -0.69 -0.01 0.00 0.82 0.00 0.00 66.70 66.26 1dfd h VAL 47 Cb 1.86 0.19 0.00 0.00 -1.52 0.00 0.00 31.29 31.83 1dfd h VAL 47 CO -0.11 0.30 -0.10 -0.33 0.02 0.00 0.00 177.57 177.34 1dfd h GLU 48 N 1.16 -0.28 -0.64 1.57 5.08 -0.65 -2.10 114.58 118.71 1dfd h GLU 48 Ca 0.28 0.02 0.11 0.00 -1.00 0.00 0.00 59.36 58.77 1dfd h GLU 48 Cb 0.10 0.06 -0.08 0.00 0.50 0.00 0.00 28.75 29.33 1dfd h GLU 48 CO -0.04 0.07 0.23 1.49 -1.00 0.00 0.00 179.01 179.76 1dfd h GLU 49 N -0.95 0.38 0.00 2.33 4.81 -1.40 1.01 114.58 120.77 1dfd h GLU 49 Ca -0.03 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 1dfd h GLU 49 Cb 0.47 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.77 1dfd h GLU 49 CO 0.05 0.25 0.00 0.00 -0.73 0.00 0.00 179.01 178.58 1dfd h ALA 50 N 1.46 1.00 0.21 2.92 0.00 -0.37 -2.24 119.26 122.23 1dfd h ALA 50 Ca 0.33 0.00 -0.29 0.00 0.00 0.00 0.00 54.91 54.95 1dfd h ALA 50 Cb 0.45 0.00 0.03 0.00 0.00 0.00 0.00 17.79 18.27 1dfd h ALA 50 CO -0.35 0.00 -1.31 1.98 0.00 0.00 0.00 179.25 179.58 1dfd h MET 51 N 0.00 0.44 0.00 0.00 4.05 0.17 -3.23 114.93 116.36 1dfd h MET 51 Ca 0.00 -0.75 -0.04 0.00 -0.28 0.00 0.00 59.70 58.63 1dfd h MET 51 Cb 0.19 0.28 -0.01 0.00 -0.80 0.00 0.00 31.60 31.27 1dfd h MET 51 CO 0.00 1.36 -0.21 0.22 0.23 0.00 0.00 176.91 178.51 1dfd h ASP 52 N -0.04 0.00 0.35 1.39 3.58 -0.63 -2.79 116.42 118.28 1dfd h ASP 52 Ca -0.24 0.00 -0.16 0.00 0.42 0.00 0.00 57.03 57.06 1dfd h ASP 52 Cb 1.98 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 43.02 1dfd h ASP 52 CO 0.22 0.21 -0.64 0.71 -2.88 0.00 0.00 179.24 176.85 1dfd h THR 53 N 0.00 1.39 -4.03 2.25 1.35 -1.52 -3.44 112.91 108.91 1dfd h THR 53 Ca -0.00 -2.05 -0.53 0.00 -0.55 0.00 0.00 66.41 63.28 1dfd h THR 53 Cb 0.61 2.05 0.10 0.00 -1.73 0.00 0.00 68.15 69.18 1dfd h THR 53 CO 0.03 0.61 0.54 0.00 -0.25 0.00 0.00 175.52 176.45 1dfd h PRO 55 N 1.70 -0.00 0.00 0.00 0.13 -1.87 -3.36 132.00 128.60 1dfd h PRO 55 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 1dfd h PRO 55 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 1dfd h PRO 55 CO 0.58 -0.00 0.00 -0.24 -0.23 0.00 0.00 178.00 178.11 1dfd h VAL 56 N -0.05 0.00 -4.92 1.56 3.04 -1.93 -3.47 116.25 110.47 1dfd h VAL 56 Ca -0.00 -0.50 -0.28 0.00 -1.01 0.00 0.00 66.70 64.92 1dfd h VAL 56 Cb 0.00 1.41 0.13 0.00 -2.01 0.00 0.00 31.29 30.83 1dfd h VAL 56 CO 0.00 0.00 -0.60 0.00 -1.01 0.00 0.00 177.57 175.96 1dfd n GLN 57 N -2.53 -5.57 0.11 4.17 6.02 -1.26 -4.82 117.38 113.51 1dfd n GLN 57 Ca 0.03 0.68 0.19 0.00 -0.01 0.00 0.00 57.00 57.89 1dfd n GLN 57 Cb 0.37 -5.21 0.61 0.00 1.02 0.00 0.00 30.24 27.02 1dfd n GLN 57 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1dfd s ILE 59 N -4.38 3.25 0.00 0.00 2.07 -1.26 -2.62 121.20 118.26 1dfd s ILE 59 Ca -0.03 0.44 0.00 0.00 -1.41 0.00 0.00 60.65 59.64 1dfd s ILE 59 Cb 0.12 -2.91 0.00 0.00 0.13 0.00 0.00 42.46 39.80 1dfd s ILE 59 CO 0.40 -0.50 0.00 1.41 -1.91 0.00 0.00 174.94 174.34 1dfd n HIS 60 N -3.36 0.00 -3.96 3.50 8.25 -0.52 -4.93 115.22 114.19 1dfd n HIS 60 Ca 0.09 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.46 1dfd n HIS 60 Cb 0.53 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.58 1dfd n HIS 60 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 1dfd s TRP 61 N 1.90 0.31 -0.19 4.41 0.52 -1.26 -4.16 118.94 120.47 1dfd s TRP 61 Ca 0.00 -0.67 -0.04 0.00 0.02 0.00 0.00 56.10 55.41 1dfd s TRP 61 Cb 0.00 0.18 0.09 0.00 -1.15 0.00 0.00 33.47 32.59 1dfd s TRP 61 CO 0.00 -0.95 0.29 -2.00 0.02 0.00 0.00 176.95 174.31 1dfd s GLU 62 N -3.99 0.22 0.08 4.98 2.12 -0.46 -4.61 118.70 117.04 1dfd s GLU 62 Ca 0.20 0.55 0.00 0.00 0.36 0.00 0.00 54.97 56.08 1dfd s GLU 62 Cb -0.00 -0.48 0.00 0.00 0.26 0.00 0.00 34.13 33.91 1dfd s GLU 62 CO 0.06 -0.48 0.00 -0.25 -0.54 0.00 0.00 175.26 174.05 1dfd n ASP 63 N 5.35 -0.01 -0.23 -1.70 8.00 -1.26 -1.43 116.55 125.27 1dfd n ASP 63 Ca -0.05 0.14 0.03 0.00 0.71 0.00 0.00 54.79 55.61 1dfd n ASP 63 Cb 0.50 0.10 0.02 0.00 -0.02 0.00 0.00 41.12 41.72 1dfd n ASP 63 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02