#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1f5f s PRO 14 N 0.00 3.50 -0.12 0.52 0.04 -1.26 -4.97 135.00 132.71 1f5f s PRO 14 Ca 0.00 1.98 -0.08 0.00 0.04 0.00 0.00 61.00 62.93 1f5f s PRO 14 Cb 0.00 -4.23 -0.04 0.00 0.04 0.00 0.00 34.50 30.26 1f5f s PRO 14 CO 0.00 -1.67 0.17 0.00 0.04 0.00 0.00 177.00 175.54 1f5f s ALA 15 N 6.67 3.82 0.22 8.56 0.00 -1.26 -4.59 121.76 135.17 1f5f s ALA 15 Ca 0.89 -0.60 0.09 0.00 0.00 0.00 0.00 51.96 52.33 1f5f s ALA 15 Cb -0.32 -2.06 -0.04 0.00 0.00 0.00 0.00 23.12 20.71 1f5f s ALA 15 CO 0.35 0.52 -0.01 0.14 0.00 0.00 0.00 175.76 176.76 1f5f s VAL 16 N -0.77 3.53 0.03 0.00 -7.23 0.48 -1.99 120.40 114.46 1f5f s VAL 16 Ca 0.15 -1.69 -0.30 0.00 -1.81 0.00 0.00 61.98 58.33 1f5f s VAL 16 Cb -0.12 -2.83 -0.04 0.00 0.56 0.00 0.00 36.38 33.95 1f5f s VAL 16 CO 0.04 -0.24 1.01 -2.28 -0.31 0.00 0.00 175.10 173.32 1f5f s HIS 17 N -2.01 3.66 -1.57 2.82 2.46 -0.50 -0.32 115.29 119.83 1f5f s HIS 17 Ca 0.29 1.67 0.30 0.00 0.47 0.00 0.00 55.06 57.79 1f5f s HIS 17 Cb -0.08 -3.15 1.54 0.00 -0.13 0.00 0.00 32.58 30.77 1f5f s HIS 17 CO 0.19 -0.13 2.05 1.28 -2.47 0.00 0.00 174.74 175.66 1f5f n LEU 18 N 3.64 0.08 -3.61 8.88 4.77 0.11 -4.69 117.00 126.18 1f5f n LEU 18 Ca 0.06 0.18 -0.10 0.00 -0.03 0.00 0.00 56.01 56.12 1f5f n LEU 18 Cb 0.50 -0.22 -0.10 0.00 -2.33 0.00 0.00 43.42 41.27 1f5f n LEU 18 CO 0.52 0.02 -0.03 -0.55 -1.33 0.00 0.00 177.39 176.02 1f5f s SER 19 N -2.45 -0.01 -0.22 -1.43 0.15 -1.25 -4.50 113.70 103.99 1f5f s SER 19 Ca 0.32 0.76 -0.19 0.00 0.70 0.00 0.00 55.95 57.54 1f5f s SER 19 Cb 0.21 1.14 -0.03 0.00 -1.71 0.00 0.00 66.02 65.63 1f5f s SER 19 CO 0.45 -0.25 0.55 0.21 1.20 0.00 0.00 173.24 175.40 1f5f s ASN 20 N 2.55 6.55 1.49 5.45 3.84 -1.26 -4.82 114.94 128.74 1f5f s ASN 20 Ca 0.01 0.66 0.00 0.00 0.21 0.00 0.00 52.86 53.74 1f5f s ASN 20 Cb -0.13 -2.30 0.00 0.00 -0.55 0.00 0.00 41.25 38.27 1f5f s ASN 20 CO -0.12 -0.25 0.00 0.61 -2.79 0.00 0.00 177.10 174.55 1f5f n GLY 21 N 4.05 1.45 1.05 1.21 0.00 -1.26 -3.19 105.19 108.50 1f5f n GLY 21 Ca -0.04 0.11 0.08 0.00 0.00 0.00 0.00 46.02 46.18 1f5f n GLY 21 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1f5f n PRO 22 N 0.00 2.44 -3.83 1.61 -0.04 -1.26 -5.00 135.00 128.93 1f5f n PRO 22 Ca 0.00 -1.96 -0.34 0.00 -0.04 0.00 0.00 63.50 61.16 1f5f n PRO 22 Cb 0.00 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 31.98 1f5f n PRO 22 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1f5f n GLY 23 N 1.23 -1.04 0.05 0.55 0.00 -1.19 -4.90 105.19 99.89 1f5f n GLY 23 Ca 0.18 0.45 -0.01 0.00 0.00 0.00 0.00 46.02 46.64 1f5f n GLY 23 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1f5f n GLN 24 N -3.96 1.04 -4.10 1.61 6.02 -1.26 -3.84 117.38 112.89 1f5f n GLN 24 Ca -0.15 -0.07 -0.08 0.00 -0.01 0.00 0.00 57.00 56.69 1f5f n GLN 24 Cb 0.60 -1.41 -0.10 0.00 1.02 0.00 0.00 30.24 30.35 1f5f n GLN 24 CO 0.00 0.00 0.00 -1.83 -1.01 0.00 0.00 177.06 174.22 1f5f s GLU 25 N -2.72 0.71 0.89 -1.09 -1.05 -1.26 -4.81 118.70 109.37 1f5f s GLU 25 Ca -0.07 -1.28 -0.10 0.00 -0.15 0.00 0.00 54.97 53.37 1f5f s GLU 25 Cb 0.07 0.22 0.13 0.00 -0.44 0.00 0.00 34.13 34.11 1f5f s GLU 25 CO 0.67 -0.16 1.12 -1.25 0.95 0.00 0.00 175.26 176.60 1f5f s PRO 26 N -3.96 1.28 0.27 -4.83 0.04 -1.26 -4.67 135.00 121.87 1f5f s PRO 26 Ca 0.12 1.36 0.15 0.00 0.04 0.00 0.00 61.00 62.67 1f5f s PRO 26 Cb 0.08 -1.77 0.05 0.00 0.04 0.00 0.00 34.50 32.89 1f5f s PRO 26 CO -0.07 -2.39 1.42 -0.84 0.04 0.00 0.00 177.00 175.17 1f5f h ILE 27 N -1.68 0.88 -1.93 0.56 3.07 -1.23 -3.44 117.51 113.74 1f5f h ILE 27 Ca -0.45 -2.26 -0.03 0.00 1.55 0.00 0.00 64.86 63.68 1f5f h ILE 27 Cb 1.26 2.43 -0.21 0.00 -0.27 0.00 0.00 36.82 40.03 1f5f h ILE 27 CO 0.46 0.50 0.21 0.00 -1.05 0.00 0.00 178.15 178.26 1f5f s ALA 28 N -2.95 -1.81 -0.13 0.16 0.00 -1.25 -4.34 121.76 111.45 1f5f s ALA 28 Ca 0.04 1.77 -0.00 0.00 0.00 0.00 0.00 51.96 53.76 1f5f s ALA 28 Cb 0.08 -0.81 0.03 0.00 0.00 0.00 0.00 23.12 22.41 1f5f s ALA 28 CO 0.75 -0.34 -0.07 0.08 0.00 0.00 0.00 175.76 176.18 1f5f s VAL 29 N -0.21 1.04 -0.06 0.00 1.01 0.31 -1.17 120.40 121.33 1f5f s VAL 29 Ca -0.03 -0.37 -0.01 0.00 0.00 0.00 0.00 61.98 61.57 1f5f s VAL 29 Cb -0.03 -1.10 -0.03 0.00 0.00 0.00 0.00 36.38 35.21 1f5f s VAL 29 CO 0.03 0.30 0.01 -0.04 0.00 0.00 0.00 175.10 175.40 1f5f s MET 30 N 1.69 2.93 -0.10 2.72 -1.94 0.81 -0.19 119.30 125.22 1f5f s MET 30 Ca 0.04 -0.47 0.03 0.00 -1.71 0.00 0.00 55.69 53.59 1f5f s MET 30 Cb -0.13 -2.76 -0.01 0.00 2.01 0.00 0.00 34.83 33.94 1f5f s MET 30 CO -0.08 0.68 -0.21 0.99 -0.01 0.00 0.00 175.02 176.38 1f5f s THR 31 N -0.96 2.32 -0.02 2.05 2.01 0.41 -0.56 115.64 120.89 1f5f s THR 31 Ca 0.16 -0.94 0.06 0.00 0.31 0.00 0.00 61.69 61.28 1f5f s THR 31 Cb -0.11 -1.90 -0.01 0.00 0.01 0.00 0.00 72.50 70.48 1f5f s THR 31 CO 0.05 0.56 -0.19 -0.36 -0.69 0.00 0.00 174.62 173.99 1f5f s PHE 32 N 0.20 1.71 -0.62 4.92 0.40 0.77 -0.49 117.98 124.86 1f5f s PHE 32 Ca -0.13 -0.35 -0.28 0.00 -0.60 0.00 0.00 56.93 55.58 1f5f s PHE 32 Cb -0.16 -1.11 0.03 0.00 0.51 0.00 0.00 43.02 42.29 1f5f s PHE 32 CO 0.07 -0.05 1.20 0.34 0.70 0.00 0.00 175.22 177.47 1f5f s ASP 33 N -0.37 6.36 0.46 1.36 2.15 -0.22 -1.20 116.67 125.21 1f5f s ASP 33 Ca 0.06 -0.08 0.11 0.00 0.43 0.00 0.00 52.55 53.07 1f5f s ASP 33 Cb -0.08 -2.55 1.04 0.00 -0.30 0.00 0.00 42.92 41.04 1f5f s ASP 33 CO -0.00 -1.56 2.09 0.25 -0.17 0.00 0.00 175.17 175.79 1f5f h LEU 34 N 12.13 0.27 -0.65 -1.34 5.85 -1.35 0.65 115.31 130.87 1f5f h LEU 34 Ca -0.26 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.46 1f5f h LEU 34 Cb 1.06 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 42.02 1f5f h LEU 34 CO 1.20 0.19 0.00 0.35 -0.34 0.00 0.00 178.44 179.85 1f5f n THR 35 N -4.50 0.83 0.45 1.05 -2.24 -1.26 -3.11 114.28 105.49 1f5f n THR 35 Ca 0.01 0.22 0.11 0.00 -2.27 0.00 0.00 64.05 62.11 1f5f n THR 35 Cb 0.09 -1.14 -0.08 0.00 -2.10 0.00 0.00 70.33 67.10 1f5f n THR 35 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1f5f n LYS 36 N -2.21 0.36 -2.25 -0.78 5.02 0.21 -4.96 118.16 113.56 1f5f n LYS 36 Ca 0.02 -0.06 -0.42 0.00 -2.02 0.00 0.00 58.31 55.83 1f5f n LYS 36 Cb 0.23 -1.56 -0.03 0.00 -0.02 0.00 0.00 35.03 33.65 1f5f n LYS 36 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1f5f s ILE 37 N -3.27 3.55 0.00 -0.18 1.01 -1.16 -4.65 121.20 116.50 1f5f s ILE 37 Ca 0.00 1.10 0.00 0.00 0.00 0.00 0.00 60.65 61.75 1f5f s ILE 37 Cb 0.14 -3.70 0.00 0.00 0.01 0.00 0.00 42.46 38.91 1f5f s ILE 37 CO 0.85 0.08 0.03 0.35 0.00 0.00 0.00 174.94 176.25 1f5f n THR 38 N 4.02 0.00 -3.94 2.92 -2.24 -1.26 -4.93 114.28 108.85 1f5f n THR 38 Ca 0.11 -0.45 -0.35 0.00 -2.27 0.00 0.00 64.05 61.09 1f5f n THR 38 Cb 0.44 1.01 -0.14 0.00 -2.10 0.00 0.00 70.33 69.53 1f5f n THR 38 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 1f5f s LYS 39 N -0.84 2.86 -0.71 -0.78 2.20 -1.26 -5.00 119.74 116.21 1f5f s LYS 39 Ca 0.00 -0.96 0.03 0.00 -0.36 0.00 0.00 55.97 54.67 1f5f s LYS 39 Cb 0.00 -3.03 0.35 0.00 -1.51 0.00 0.00 37.83 33.64 1f5f s LYS 39 CO 0.00 -0.40 1.32 0.25 -0.36 0.00 0.00 175.35 176.15 1f5f n THR 40 N 4.69 3.86 -3.82 3.43 -2.24 -1.26 -3.41 114.28 115.53 1f5f n THR 40 Ca -0.16 -5.48 -0.10 0.00 -2.27 0.00 0.00 64.05 56.04 1f5f n THR 40 Cb 0.47 -1.41 -0.08 0.00 -2.10 0.00 0.00 70.33 67.22 1f5f n THR 40 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1f5f s SER 41 N -2.68 0.01 0.03 3.42 1.04 -1.26 -0.79 113.70 113.47 1f5f s SER 41 Ca 0.46 -0.42 0.02 0.00 0.48 0.00 0.00 55.95 56.49 1f5f s SER 41 Cb 0.29 0.33 -0.02 0.00 0.10 0.00 0.00 66.02 66.72 1f5f s SER 41 CO -0.17 -0.65 -0.07 -0.44 0.98 0.00 0.00 173.24 172.90 1f5f s SER 42 N -2.38 0.71 -0.08 7.02 0.01 -0.24 -1.62 113.70 117.11 1f5f s SER 42 Ca -0.01 -0.51 -0.23 0.00 1.31 0.00 0.00 55.95 56.51 1f5f s SER 42 Cb 0.01 0.04 0.05 0.00 0.21 0.00 0.00 66.02 66.34 1f5f s SER 42 CO -0.07 -0.21 0.53 -0.94 0.41 0.00 0.00 173.24 172.97 1f5f s SER 43 N -1.45 -0.50 0.10 2.44 1.04 -0.38 -0.81 113.70 114.14 1f5f s SER 43 Ca -0.10 0.64 -0.26 0.00 0.48 0.00 0.00 55.95 56.71 1f5f s SER 43 Cb -0.09 0.64 0.08 0.00 0.10 0.00 0.00 66.02 66.75 1f5f s SER 43 CO 0.00 -0.44 1.01 0.72 0.98 0.00 0.00 173.24 175.51 1f5f s PHE 44 N -0.80 -0.14 0.01 5.02 -0.12 -0.33 -0.77 117.98 120.85 1f5f s PHE 44 Ca -0.09 -0.11 0.07 0.00 -0.05 0.00 0.00 56.93 56.76 1f5f s PHE 44 Cb -0.03 0.61 -0.03 0.00 -0.63 0.00 0.00 43.02 42.95 1f5f s PHE 44 CO 0.06 -0.70 -0.21 -1.21 -0.05 0.00 0.00 175.22 173.10 1f5f s GLU 45 N -3.12 2.08 0.11 1.99 2.02 0.32 -1.30 118.70 120.80 1f5f s GLU 45 Ca 0.12 -0.96 0.05 0.00 0.02 0.00 0.00 54.97 54.20 1f5f s GLU 45 Cb -0.00 -2.14 -0.04 0.00 0.10 0.00 0.00 34.13 32.06 1f5f s GLU 45 CO -0.00 0.55 -0.13 0.54 0.02 0.00 0.00 175.26 176.24 1f5f s VAL 46 N -0.79 1.18 -0.09 2.63 0.11 -0.64 -1.65 120.40 121.15 1f5f s VAL 46 Ca 0.12 -1.64 -0.04 0.00 -2.93 0.00 0.00 61.98 57.49 1f5f s VAL 46 Cb -0.10 -1.42 0.05 0.00 -1.53 0.00 0.00 36.38 33.38 1f5f s VAL 46 CO 0.02 -0.43 0.19 -0.60 -3.33 0.00 0.00 175.10 170.95 1f5f s ARG 47 N -2.59 0.10 0.17 1.54 3.52 -0.85 -1.01 118.95 119.84 1f5f s ARG 47 Ca 0.06 0.54 -0.23 0.00 -0.13 0.00 0.00 55.73 55.98 1f5f s ARG 47 Cb -0.05 -0.18 0.06 0.00 -1.56 0.00 0.00 34.95 33.23 1f5f s ARG 47 CO 0.02 -0.24 0.62 -0.08 -0.81 0.00 0.00 175.30 174.81 1f5f s THR 48 N 1.84 0.00 -0.76 4.11 -1.32 -1.26 -0.07 115.64 118.17 1f5f s THR 48 Ca -0.03 -0.13 0.07 0.00 -1.21 0.00 0.00 61.69 60.39 1f5f s THR 48 Cb -0.12 -1.14 0.03 0.00 -1.51 0.00 0.00 72.50 69.77 1f5f s THR 48 CO -0.07 0.00 0.62 0.79 -2.21 0.00 0.00 174.62 173.76 1f5f n TRP 49 N -0.39 0.00 -3.09 9.09 7.02 -1.26 -0.76 117.44 128.05 1f5f n TRP 49 Ca -0.15 0.00 -0.41 0.00 -1.02 0.00 0.00 57.50 55.92 1f5f n TRP 49 Cb 0.64 0.00 -0.06 0.00 -2.42 0.00 0.00 31.31 29.47 1f5f n TRP 49 CO 0.00 0.00 0.00 0.34 -2.02 0.00 0.00 177.69 176.01 1f5f s ASP 50 N -0.82 6.57 0.22 -0.99 -1.08 -1.26 -4.89 116.67 114.42 1f5f s ASP 50 Ca 0.07 0.64 0.21 0.00 -0.52 0.00 0.00 52.55 52.95 1f5f s ASP 50 Cb 0.06 -2.34 0.92 0.00 -1.46 0.00 0.00 42.92 40.09 1f5f s ASP 50 CO 0.13 -0.42 1.63 -0.81 0.52 0.00 0.00 175.17 176.22 1f5f n PRO 51 N 5.80 0.15 -3.79 4.34 -0.04 -1.26 -4.76 135.00 135.43 1f5f n PRO 51 Ca -0.00 0.45 -0.13 0.00 -0.04 0.00 0.00 63.50 63.78 1f5f n PRO 51 Cb 0.49 -1.82 -0.12 0.00 -0.04 0.00 0.00 33.50 32.00 1f5f n PRO 51 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 1f5f s GLU 52 N -3.30 0.22 0.00 0.54 2.12 -1.26 -0.45 118.70 116.57 1f5f s GLU 52 Ca 0.03 0.30 0.00 0.00 0.36 0.00 0.00 54.97 55.66 1f5f s GLU 52 Cb 0.08 0.08 0.00 0.00 0.26 0.00 0.00 34.13 34.55 1f5f s GLU 52 CO 0.32 -0.05 0.00 0.41 -0.54 0.00 0.00 175.26 175.40 1f5f n GLY 53 N 3.14 -0.08 3.79 -1.50 0.00 -0.80 -4.42 105.19 105.32 1f5f n GLY 53 Ca -0.14 -1.22 -0.38 0.00 0.00 0.00 0.00 46.02 44.28 1f5f n GLY 53 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1f5f s VAL 54 N -2.00 5.12 -0.22 1.61 1.01 0.19 -0.85 120.40 125.26 1f5f s VAL 54 Ca 0.00 0.81 -0.19 0.00 0.00 0.00 0.00 61.98 62.60 1f5f s VAL 54 Cb 0.00 -3.72 -0.18 0.00 0.00 0.00 0.00 36.38 32.48 1f5f s VAL 54 CO 0.00 0.49 0.10 -0.38 0.00 0.00 0.00 175.10 175.31 1f5f n ILE 55 N 2.52 1.54 -3.49 2.22 5.41 0.41 -4.08 119.36 123.88 1f5f n ILE 55 Ca -0.12 -0.12 -0.15 0.00 1.00 0.00 0.00 62.75 63.36 1f5f n ILE 55 Cb 0.52 -2.00 -0.04 0.00 -0.71 0.00 0.00 39.64 37.41 1f5f n ILE 55 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 176.55 177.27 1f5f s PHE 56 N -2.40 -0.56 0.08 1.39 -0.12 -0.88 -0.78 117.98 114.71 1f5f s PHE 56 Ca -0.31 0.68 0.09 0.00 -0.05 0.00 0.00 56.93 57.33 1f5f s PHE 56 Cb 0.08 0.46 -0.03 0.00 -0.63 0.00 0.00 43.02 42.89 1f5f s PHE 56 CO 0.58 -0.71 -0.23 -0.47 -0.05 0.00 0.00 175.22 174.34 1f5f s TYR 57 N -2.47 1.96 0.00 3.49 5.04 0.33 -1.09 117.35 124.60 1f5f s TYR 57 Ca -0.05 -0.40 -0.03 0.00 -2.44 0.00 0.00 57.07 54.15 1f5f s TYR 57 Cb -0.01 -1.11 -0.01 0.00 0.35 0.00 0.00 41.96 41.19 1f5f s TYR 57 CO -0.02 0.18 0.05 0.20 -1.34 0.00 0.00 175.55 174.63 1f5f s GLY 58 N -1.60 0.10 0.11 8.97 0.00 0.30 -0.20 107.32 115.00 1f5f s GLY 58 Ca 0.09 -0.22 -0.13 0.00 0.00 0.00 0.00 44.72 44.46 1f5f s GLY 58 CO 0.03 -0.30 0.30 0.51 0.00 0.00 0.00 173.10 173.65 1f5f s ASP 59 N -1.02 -0.07 0.00 1.64 1.47 -0.06 -0.18 116.67 118.45 1f5f s ASP 59 Ca -0.11 -0.48 0.00 0.00 1.18 0.00 0.00 52.55 53.14 1f5f s ASP 59 Cb -0.07 0.41 0.00 0.00 -0.34 0.00 0.00 42.92 42.93 1f5f s ASP 59 CO 0.00 -0.80 0.00 0.35 0.68 0.00 0.00 175.17 175.40 1f5f n THR 60 N -0.15 0.00 -3.56 2.11 -2.24 -0.17 -0.41 114.28 109.86 1f5f n THR 60 Ca -0.15 -0.40 -0.01 0.00 -2.27 0.00 0.00 64.05 61.21 1f5f n THR 60 Cb 0.63 0.96 -0.06 0.00 -2.10 0.00 0.00 70.33 69.77 1f5f n THR 60 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1f5f s ASN 61 N -0.92 -0.59 0.36 3.42 3.84 -1.08 -4.76 114.94 115.20 1f5f s ASN 61 Ca 0.00 0.89 0.19 0.00 0.21 0.00 0.00 52.86 54.15 1f5f s ASN 61 Cb 0.00 1.44 0.52 0.00 -0.55 0.00 0.00 41.25 42.65 1f5f s ASN 61 CO 0.00 -0.13 1.65 1.55 -2.79 0.00 0.00 177.10 177.38 1f5f h PRO 62 N 6.72 0.00 0.14 0.43 0.13 -1.94 -1.40 132.00 136.07 1f5f h PRO 62 Ca -0.23 0.00 -0.30 0.00 -0.87 0.00 0.00 66.00 64.60 1f5f h PRO 62 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1f5f h PRO 62 CO 0.15 0.37 -1.52 -0.22 -0.23 0.00 0.00 178.00 176.54 1f5f h LYS 63 N 0.00 0.29 0.02 0.86 3.64 -1.97 -3.44 116.57 115.97 1f5f h LYS 63 Ca -0.00 -0.49 -0.39 0.00 -1.27 0.00 0.00 60.65 58.49 1f5f h LYS 63 Cb 1.03 0.18 -0.06 0.00 -0.41 0.00 0.00 32.23 32.98 1f5f h LYS 63 CO 0.05 1.24 -2.29 -0.25 -2.27 0.00 0.00 179.45 175.92 1f5f n ASP 64 N -3.82 1.99 -3.55 4.20 8.00 -1.21 -4.86 116.55 117.29 1f5f n ASP 64 Ca -0.25 0.12 -0.29 0.00 0.71 0.00 0.00 54.79 55.08 1f5f n ASP 64 Cb 0.95 -0.67 -0.14 0.00 -0.02 0.00 0.00 41.12 41.24 1f5f n ASP 64 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1f5f s ASP 65 N -6.94 3.48 0.07 -2.24 1.11 -0.53 -3.88 116.67 107.74 1f5f s ASP 65 Ca -0.33 -1.58 -0.01 0.00 0.18 0.00 0.00 52.55 50.80 1f5f s ASP 65 Cb 0.10 -0.45 -0.04 0.00 1.07 0.00 0.00 42.92 43.60 1f5f s ASP 65 CO 0.59 -0.40 0.01 -1.66 1.18 0.00 0.00 175.17 174.89 1f5f s TRP 66 N 1.75 0.59 -0.02 4.23 1.48 0.61 -1.00 118.94 126.57 1f5f s TRP 66 Ca 0.11 -1.09 -0.02 0.00 -1.06 0.00 0.00 56.10 54.04 1f5f s TRP 66 Cb -0.18 -0.39 0.01 0.00 -1.16 0.00 0.00 33.47 31.74 1f5f s TRP 66 CO -0.26 -0.43 0.07 0.12 -4.06 0.00 0.00 176.95 172.39 1f5f s PHE 67 N -3.95 -0.07 -0.01 1.66 5.36 0.75 -1.22 117.98 120.51 1f5f s PHE 67 Ca 0.12 0.17 0.02 0.00 -0.96 0.00 0.00 56.93 56.27 1f5f s PHE 67 Cb 0.08 0.02 -0.00 0.00 -0.34 0.00 0.00 43.02 42.78 1f5f s PHE 67 CO -0.07 -0.04 -0.07 1.41 -1.46 0.00 0.00 175.22 174.99 1f5f s MET 68 N 0.00 0.61 -0.22 10.12 -2.45 0.11 -0.54 119.30 126.93 1f5f s MET 68 Ca -0.00 -0.24 -0.03 0.00 -1.25 0.00 0.00 55.69 54.17 1f5f s MET 68 Cb -0.01 -0.59 0.00 0.00 1.25 0.00 0.00 34.83 35.48 1f5f s MET 68 CO 0.00 0.13 -0.06 -1.17 1.05 0.00 0.00 175.02 174.96 1f5f s LEU 69 N -0.04 2.87 0.00 4.11 2.96 -0.25 -1.25 118.68 127.08 1f5f s LEU 69 Ca 0.01 -0.53 0.00 0.00 -0.22 0.00 0.00 54.13 53.39 1f5f s LEU 69 Cb -0.04 -1.69 -0.00 0.00 0.50 0.00 0.00 46.19 44.95 1f5f s LEU 69 CO -0.00 -0.04 0.14 0.61 -1.32 0.00 0.00 176.35 175.73 1f5f n GLY 70 N 4.75 3.02 3.63 7.98 0.00 0.16 -0.45 105.19 124.29 1f5f n GLY 70 Ca -0.18 -1.52 -0.35 0.00 0.00 0.00 0.00 46.02 43.97 1f5f n GLY 70 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1f5f s LEU 71 N 0.00 3.47 -0.04 0.99 1.43 -0.03 -0.77 118.68 123.74 1f5f s LEU 71 Ca 0.10 0.07 -0.01 0.00 -1.03 0.00 0.00 54.13 53.26 1f5f s LEU 71 Cb -0.00 -1.80 0.03 0.00 0.03 0.00 0.00 46.19 44.45 1f5f s LEU 71 CO 0.07 0.33 0.04 -0.60 0.23 0.00 0.00 176.35 176.42 1f5f s ARG 72 N -0.58 0.07 -1.60 1.70 3.52 -0.26 -1.89 118.95 119.90 1f5f s ARG 72 Ca 0.09 0.25 -0.03 0.00 -0.13 0.00 0.00 55.73 55.92 1f5f s ARG 72 Cb -0.12 -0.49 0.01 0.00 -1.56 0.00 0.00 34.95 32.78 1f5f s ARG 72 CO 0.02 -0.25 0.34 -0.25 -0.81 0.00 0.00 175.30 174.35 1f5f n ASP 73 N 4.82 -5.80 0.00 -2.12 8.00 -0.99 -1.56 116.55 118.89 1f5f n ASP 73 Ca -0.14 -0.16 0.00 0.00 0.71 0.00 0.00 54.79 55.20 1f5f n ASP 73 Cb 0.50 -4.76 0.00 0.00 -0.02 0.00 0.00 41.12 36.85 1f5f n ASP 73 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1f5f n GLY 74 N -1.28 2.79 3.60 0.44 0.00 0.40 -4.93 105.19 106.21 1f5f n GLY 74 Ca -0.16 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.56 1f5f n GLY 74 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1f5f s ARG 75 N -0.22 2.24 0.27 1.61 0.52 -0.60 0.15 118.95 122.91 1f5f s ARG 75 Ca 0.00 -0.96 -0.28 0.00 -0.52 0.00 0.00 55.73 53.96 1f5f s ARG 75 Cb 0.00 -2.36 -0.14 0.00 0.52 0.00 0.00 34.95 32.96 1f5f s ARG 75 CO 0.00 0.52 0.96 -2.30 0.02 0.00 0.00 175.30 174.50 1f5f n PRO 76 N 0.75 1.18 -4.33 3.54 -0.02 -1.20 -1.10 135.00 133.83 1f5f n PRO 76 Ca -0.13 0.41 -0.20 0.00 -2.02 0.00 0.00 63.50 61.57 1f5f n PRO 76 Cb 0.52 -1.75 -0.15 0.00 -0.02 0.00 0.00 33.50 32.10 1f5f n PRO 76 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 1f5f s GLU 77 N -1.41 0.86 -0.07 -0.52 2.12 0.05 -2.13 118.70 117.60 1f5f s GLU 77 Ca 0.60 -0.26 0.04 0.00 0.36 0.00 0.00 54.97 55.71 1f5f s GLU 77 Cb -0.74 -0.82 -0.02 0.00 0.26 0.00 0.00 34.13 32.82 1f5f s GLU 77 CO 0.59 0.09 -0.19 0.42 -0.54 0.00 0.00 175.26 175.63 1f5f s ILE 78 N 0.24 2.60 -0.05 -3.70 1.01 0.75 -0.66 121.20 121.39 1f5f s ILE 78 Ca -0.04 -0.87 0.04 0.00 0.00 0.00 0.00 60.65 59.79 1f5f s ILE 78 Cb -0.08 -2.01 -0.02 0.00 0.01 0.00 0.00 42.46 40.36 1f5f s ILE 78 CO 0.00 0.57 -0.16 -1.10 0.00 0.00 0.00 174.94 174.25 1f5f s GLN 79 N -0.21 2.53 -0.07 2.79 -0.21 -0.38 -0.74 119.66 123.38 1f5f s GLN 79 Ca -0.01 -0.73 -0.06 0.00 0.02 0.00 0.00 55.36 54.59 1f5f s GLN 79 Cb -0.13 -2.36 0.02 0.00 1.00 0.00 0.00 33.01 31.54 1f5f s GLN 79 CO 0.03 0.58 0.17 -1.17 -2.12 0.00 0.00 175.29 172.78 1f5f s LEU 80 N -0.62 1.25 -0.08 2.90 0.20 0.03 0.06 118.68 122.43 1f5f s LEU 80 Ca 0.09 0.35 -0.03 0.00 0.69 0.00 0.00 54.13 55.23 1f5f s LEU 80 Cb -0.11 0.57 0.04 0.00 -0.43 0.00 0.00 46.19 46.26 1f5f s LEU 80 CO 0.01 -0.07 0.13 -2.28 -0.29 0.00 0.00 176.35 173.84 1f5f s HIS 81 N 0.25 -0.10 0.01 5.38 2.46 -0.35 -1.16 115.29 121.78 1f5f s HIS 81 Ca -0.01 0.46 -0.00 0.00 0.47 0.00 0.00 55.06 55.98 1f5f s HIS 81 Cb -0.03 -0.35 0.00 0.00 -0.13 0.00 0.00 32.58 32.08 1f5f s HIS 81 CO -0.01 -0.26 0.01 0.27 -2.47 0.00 0.00 174.74 172.28 1f5f n ASN 82 N 5.32 -0.04 0.27 9.88 0.23 -0.24 -0.29 115.26 130.39 1f5f n ASN 82 Ca -0.04 -1.03 0.15 0.00 -0.53 0.00 0.00 54.58 53.12 1f5f n ASN 82 Cb 0.50 0.07 0.75 0.00 -2.08 0.00 0.00 39.78 39.02 1f5f n ASN 82 CO 0.00 0.00 0.00 0.45 -0.93 0.00 0.00 177.26 176.78 1f5f h HIS 83 N 1.02 0.00 0.00 -2.53 3.86 -1.92 -3.20 115.15 112.37 1f5f h HIS 83 Ca -0.01 0.00 -0.30 0.00 -1.16 0.00 0.00 60.37 58.90 1f5f h HIS 83 Cb 0.02 0.00 -0.06 0.00 1.06 0.00 0.00 27.41 28.44 1f5f h HIS 83 CO 0.00 0.09 -2.26 0.91 0.86 0.00 0.00 177.93 177.54 1f5f n TRP 84 N -3.42 0.00 -3.62 2.45 8.01 -1.26 -5.05 117.44 114.55 1f5f n TRP 84 Ca -0.01 0.00 -0.13 0.00 -1.31 0.00 0.00 57.50 56.05 1f5f n TRP 84 Cb 0.25 -0.88 -0.07 0.00 -2.01 0.00 0.00 31.31 28.61 1f5f n TRP 84 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1f5f s ALA 85 N -2.57 -1.82 -0.14 6.99 0.00 -1.21 -4.91 121.76 118.09 1f5f s ALA 85 Ca -0.09 1.95 -0.01 0.00 0.00 0.00 0.00 51.96 53.80 1f5f s ALA 85 Cb 0.07 -1.16 0.04 0.00 0.00 0.00 0.00 23.12 22.07 1f5f s ALA 85 CO 0.79 -0.32 -0.01 -0.65 0.00 0.00 0.00 175.76 175.56 1f5f s GLN 86 N 0.23 0.98 0.04 0.00 1.11 -1.26 -1.07 119.66 119.68 1f5f s GLN 86 Ca 0.00 -0.28 -0.22 0.00 0.01 0.00 0.00 55.36 54.86 1f5f s GLN 86 Cb -0.05 -1.70 0.05 0.00 -1.01 0.00 0.00 33.01 30.31 1f5f s GLN 86 CO -0.00 -0.44 0.51 -0.48 0.01 0.00 0.00 175.29 174.89 1f5f s LEU 87 N 1.80 -0.03 -0.21 2.90 0.05 -0.31 -4.99 118.68 117.89 1f5f s LEU 87 Ca 0.02 0.18 -0.01 0.00 0.05 0.00 0.00 54.13 54.36 1f5f s LEU 87 Cb -0.15 2.09 0.06 0.00 -2.05 0.00 0.00 46.19 46.14 1f5f s LEU 87 CO -0.07 -0.70 -0.00 -0.89 -0.55 0.00 0.00 176.35 174.14 1f5f s THR 88 N -2.38 0.93 -0.03 5.48 2.01 -1.26 -0.79 115.64 119.61 1f5f s THR 88 Ca -0.06 -0.83 0.02 0.00 0.31 0.00 0.00 61.69 61.13 1f5f s THR 88 Cb -0.01 -1.35 0.00 0.00 0.01 0.00 0.00 72.50 71.16 1f5f s THR 88 CO -0.01 -0.17 -0.09 -0.69 -0.69 0.00 0.00 174.62 172.97 1f5f s VAL 89 N 1.67 0.78 -0.04 3.82 1.01 0.08 -4.99 120.40 122.74 1f5f s VAL 89 Ca -0.03 -0.35 0.01 0.00 0.00 0.00 0.00 61.98 61.61 1f5f s VAL 89 Cb -0.18 -0.70 -0.03 0.00 0.00 0.00 0.00 36.38 35.47 1f5f s VAL 89 CO -0.07 0.25 -0.04 -0.83 0.00 0.00 0.00 175.10 174.41 1f5f s GLY 90 N 0.26 1.79 0.10 4.51 0.00 -1.26 -0.18 107.32 112.53 1f5f s GLY 90 Ca -0.04 -0.92 -0.25 0.00 0.00 0.00 0.00 44.72 43.51 1f5f s GLY 90 CO 0.01 -0.74 0.73 0.00 0.00 0.00 0.00 173.10 173.10 1f5f s ALA 91 N -0.94 -1.68 0.00 3.20 0.00 -0.91 -5.00 121.76 116.43 1f5f s ALA 91 Ca 0.15 0.67 0.00 0.00 0.00 0.00 0.00 51.96 52.79 1f5f s ALA 91 Cb -0.11 0.69 0.00 0.00 0.00 0.00 0.00 23.12 23.70 1f5f s ALA 91 CO 0.05 -0.75 0.00 0.41 0.00 0.00 0.00 175.76 175.47 1f5f n GLY 92 N -0.33 -0.65 3.89 0.00 0.00 -1.26 -3.21 105.19 103.63 1f5f n GLY 92 Ca -0.13 -1.74 -0.29 0.00 0.00 0.00 0.00 46.02 43.85 1f5f n GLY 92 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1f5f s PRO 93 N -1.28 2.76 0.35 1.61 0.04 -1.26 -4.71 135.00 132.51 1f5f s PRO 93 Ca 0.00 0.36 -0.29 0.00 0.04 0.00 0.00 61.00 61.11 1f5f s PRO 93 Cb 0.00 -2.05 -0.11 0.00 0.04 0.00 0.00 34.50 32.39 1f5f s PRO 93 CO 0.00 -1.05 1.41 1.03 0.04 0.00 0.00 177.00 178.43 1f5f s ARG 94 N -5.34 4.22 0.00 4.56 0.52 -1.26 -4.30 118.95 117.35 1f5f s ARG 94 Ca 0.58 2.41 0.10 0.00 -0.52 0.00 0.00 55.73 58.30 1f5f s ARG 94 Cb -0.11 -3.02 0.14 0.00 0.52 0.00 0.00 34.95 32.47 1f5f s ARG 94 CO 0.51 -0.39 0.94 1.28 0.02 0.00 0.00 175.30 177.65 1f5f n LEU 95 N 0.80 2.13 -2.25 2.53 4.77 0.12 -4.79 117.00 120.32 1f5f n LEU 95 Ca 0.01 -1.26 -0.30 0.00 -0.03 0.00 0.00 56.01 54.44 1f5f n LEU 95 Cb 0.40 -0.06 0.11 0.00 -2.33 0.00 0.00 43.42 41.55 1f5f n LEU 95 CO 0.62 0.45 1.38 -0.90 -1.33 0.00 0.00 177.39 177.60 1f5f n ASP 96 N 0.56 6.23 -1.16 -1.43 5.75 -1.25 -4.38 116.55 120.87 1f5f n ASP 96 Ca 0.07 -3.66 0.10 0.00 -0.01 0.00 0.00 54.79 51.29 1f5f n ASP 96 Cb 0.30 -0.93 0.28 0.00 -1.03 0.00 0.00 41.12 39.74 1f5f n ASP 96 CO 0.00 0.00 0.00 -0.90 -0.11 0.00 0.00 177.20 176.19 1f5f n ASP 97 N -0.91 3.35 -1.23 -1.12 5.68 -1.20 -4.43 116.55 116.70 1f5f n ASP 97 Ca 0.59 -2.00 -0.16 0.00 -0.50 0.00 0.00 54.79 52.72 1f5f n ASP 97 Cb 1.00 -0.42 -0.07 0.00 -1.14 0.00 0.00 41.12 40.49 1f5f n ASP 97 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1f5f n GLY 98 N 1.49 1.60 3.72 6.12 0.00 0.06 -4.99 105.19 113.19 1f5f n GLY 98 Ca 0.21 -0.20 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 1f5f n GLY 98 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1f5f s ARG 99 N -3.33 2.64 0.18 1.61 0.52 -1.26 -4.76 118.95 114.55 1f5f s ARG 99 Ca 0.00 -0.84 -0.30 0.00 -0.52 0.00 0.00 55.73 54.07 1f5f s ARG 99 Cb 0.00 -2.57 -0.08 0.00 0.52 0.00 0.00 34.95 32.81 1f5f s ARG 99 CO 0.00 0.53 1.32 -1.58 0.02 0.00 0.00 175.30 175.59 1f5f s TRP 100 N -1.42 3.25 -0.01 -0.53 0.52 -1.26 -4.44 118.94 115.05 1f5f s TRP 100 Ca 0.27 1.17 0.06 0.00 0.02 0.00 0.00 56.10 57.62 1f5f s TRP 100 Cb -0.11 -3.62 -0.01 0.00 -1.15 0.00 0.00 33.47 28.58 1f5f s TRP 100 CO 0.20 -1.97 -0.18 -1.01 0.02 0.00 0.00 176.95 174.00 1f5f s HIS 101 N 0.33 1.63 -0.13 -1.98 3.76 -0.18 -4.97 115.29 113.76 1f5f s HIS 101 Ca 0.58 -0.31 -0.22 0.00 -0.15 0.00 0.00 55.06 54.97 1f5f s HIS 101 Cb -0.36 -1.05 -0.03 0.00 1.11 0.00 0.00 32.58 32.24 1f5f s HIS 101 CO 0.36 -0.03 0.65 -0.65 -0.85 0.00 0.00 174.74 174.22 1f5f s GLN 102 N -0.43 4.33 -0.03 1.40 1.11 -1.26 -1.62 119.66 123.16 1f5f s GLN 102 Ca 0.07 0.72 0.05 0.00 0.01 0.00 0.00 55.36 56.21 1f5f s GLN 102 Cb -0.07 -3.50 -0.01 0.00 -1.01 0.00 0.00 33.01 28.42 1f5f s GLN 102 CO -0.01 -0.06 -0.17 0.08 0.01 0.00 0.00 175.29 175.14 1f5f s VAL 103 N 1.29 1.39 -0.04 1.09 1.01 -0.42 -0.31 120.40 124.41 1f5f s VAL 103 Ca 0.32 -0.72 0.01 0.00 0.00 0.00 0.00 61.98 61.60 1f5f s VAL 103 Cb -0.16 -1.18 0.02 0.00 0.00 0.00 0.00 36.38 35.06 1f5f s VAL 103 CO 0.13 0.40 -0.04 -1.61 0.00 0.00 0.00 175.10 173.98 1f5f s GLU 104 N -0.14 0.68 -0.17 2.72 2.02 -0.48 -1.18 118.70 122.14 1f5f s GLU 104 Ca 0.01 -0.08 0.01 0.00 0.02 0.00 0.00 54.97 54.93 1f5f s GLU 104 Cb -0.09 -0.72 0.02 0.00 0.10 0.00 0.00 34.13 33.43 1f5f s GLU 104 CO 0.01 -0.07 -0.19 0.08 0.02 0.00 0.00 175.26 175.11 1f5f s VAL 105 N 0.82 2.16 0.04 2.63 1.01 0.01 -1.20 120.40 125.87 1f5f s VAL 105 Ca -0.10 -0.92 0.05 0.00 0.00 0.00 0.00 61.98 61.01 1f5f s VAL 105 Cb -0.13 -1.90 -0.02 0.00 0.00 0.00 0.00 36.38 34.33 1f5f s VAL 105 CO -0.00 0.53 -0.16 -0.54 0.00 0.00 0.00 175.10 174.94 1f5f s LYS 106 N 1.17 1.05 -0.20 2.72 1.02 -0.38 -1.08 119.74 124.04 1f5f s LYS 106 Ca 0.02 -0.80 -0.14 0.00 0.02 0.00 0.00 55.97 55.07 1f5f s LYS 106 Cb -0.14 -1.08 -0.04 0.00 -0.52 0.00 0.00 37.83 36.05 1f5f s LYS 106 CO -0.09 0.27 0.32 1.41 -0.92 0.00 0.00 175.35 176.34 1f5f s MET 107 N -1.13 4.18 -0.33 1.68 -2.45 0.03 -0.43 119.30 120.85 1f5f s MET 107 Ca 0.03 0.08 -0.00 0.00 -1.25 0.00 0.00 55.69 54.55 1f5f s MET 107 Cb -0.08 -3.51 0.11 0.00 1.25 0.00 0.00 34.83 32.60 1f5f s MET 107 CO 0.01 0.06 0.12 -1.21 1.05 0.00 0.00 175.02 175.05 1f5f s GLU 108 N 1.03 0.79 6.99 4.11 0.41 -0.68 -4.86 118.70 126.49 1f5f s GLU 108 Ca 0.16 -1.21 0.00 0.00 -0.41 0.00 0.00 54.97 53.51 1f5f s GLU 108 Cb -0.14 -2.02 0.00 0.00 -1.78 0.00 0.00 34.13 30.19 1f5f s GLU 108 CO 0.06 -1.02 0.00 0.41 -0.49 0.00 0.00 175.26 174.22 1f5f n GLY 109 N 4.64 2.58 1.32 -1.39 0.00 -1.26 -1.05 105.19 110.02 1f5f n GLY 109 Ca -0.00 0.09 0.08 0.00 0.00 0.00 0.00 46.02 46.19 1f5f n GLY 109 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1f5f n ASP 110 N 10.21 4.45 -4.84 1.61 3.85 -1.26 -4.87 116.55 125.70 1f5f n ASP 110 Ca 0.00 -2.63 -0.21 0.00 -0.71 0.00 0.00 54.79 51.23 1f5f n ASP 110 Cb 0.00 -0.54 -0.04 0.00 -1.35 0.00 0.00 41.12 39.19 1f5f n ASP 110 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 177.20 175.75 1f5f s SER 111 N -1.18 5.31 -0.16 -1.12 0.01 -0.22 -0.99 113.70 115.35 1f5f s SER 111 Ca 0.45 -0.45 0.02 0.00 1.31 0.00 0.00 55.95 57.28 1f5f s SER 111 Cb 0.32 -1.07 0.02 0.00 0.21 0.00 0.00 66.02 65.49 1f5f s SER 111 CO 0.17 -0.26 -0.21 -0.69 0.41 0.00 0.00 173.24 172.67 1f5f s VAL 112 N -2.27 2.04 -0.08 3.43 1.01 0.40 -1.69 120.40 123.24 1f5f s VAL 112 Ca 0.38 -0.94 -0.04 0.00 0.00 0.00 0.00 61.98 61.38 1f5f s VAL 112 Cb -0.06 -1.83 -0.04 0.00 0.00 0.00 0.00 36.38 34.45 1f5f s VAL 112 CO 0.26 0.54 0.10 -0.76 0.00 0.00 0.00 175.10 175.23 1f5f s LEU 113 N 1.11 4.08 -0.14 3.92 1.02 0.43 -0.34 118.68 128.76 1f5f s LEU 113 Ca 0.00 0.32 0.02 0.00 0.02 0.00 0.00 54.13 54.48 1f5f s LEU 113 Cb -0.14 -2.08 0.02 0.00 0.02 0.00 0.00 46.19 44.01 1f5f s LEU 113 CO -0.09 0.37 -0.18 -0.22 0.02 0.00 0.00 176.35 176.25 1f5f s LEU 114 N -1.18 1.91 -0.03 1.79 2.96 0.33 -1.24 118.68 123.22 1f5f s LEU 114 Ca 0.17 -0.54 0.05 0.00 -0.22 0.00 0.00 54.13 53.60 1f5f s LEU 114 Cb -0.12 -1.29 -0.03 0.00 0.50 0.00 0.00 46.19 45.25 1f5f s LEU 114 CO 0.06 0.02 -0.18 -1.61 -1.32 0.00 0.00 176.35 173.32 1f5f s GLU 115 N 1.08 2.31 -0.09 1.98 2.02 -0.34 -0.58 118.70 125.09 1f5f s GLU 115 Ca -0.02 -0.81 0.01 0.00 0.02 0.00 0.00 54.97 54.16 1f5f s GLU 115 Cb -0.14 -2.24 0.02 0.00 0.10 0.00 0.00 34.13 31.86 1f5f s GLU 115 CO -0.05 0.59 -0.10 0.08 0.02 0.00 0.00 175.26 175.80 1f5f s VAL 116 N -0.72 1.09 -1.36 2.63 1.01 0.51 -1.38 120.40 122.17 1f5f s VAL 116 Ca 0.11 -0.39 -0.10 0.00 0.00 0.00 0.00 61.98 61.60 1f5f s VAL 116 Cb -0.10 -1.05 0.08 0.00 0.00 0.00 0.00 36.38 35.31 1f5f s VAL 116 CO 0.01 0.36 0.57 0.47 0.00 0.00 0.00 175.10 176.51 1f5f n ASP 117 N 4.35 -3.92 0.00 3.32 8.00 0.58 0.27 116.55 129.16 1f5f n ASP 117 Ca -0.18 -0.48 0.00 0.00 0.71 0.00 0.00 54.79 54.84 1f5f n ASP 117 Cb 0.51 -3.22 0.00 0.00 -0.02 0.00 0.00 41.12 38.39 1f5f n ASP 117 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1f5f n GLY 118 N -1.26 1.41 3.53 0.44 0.00 -1.26 -5.01 105.19 103.04 1f5f n GLY 118 Ca -0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1f5f n GLY 118 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1f5f s GLU 119 N -0.47 3.23 0.16 1.61 -1.05 0.14 -5.06 118.70 117.26 1f5f s GLU 119 Ca 0.00 -0.54 -0.32 0.00 -0.15 0.00 0.00 54.97 53.96 1f5f s GLU 119 Cb 0.00 -2.75 -0.11 0.00 -0.44 0.00 0.00 34.13 30.83 1f5f s GLU 119 CO 0.00 0.43 1.80 -1.91 0.95 0.00 0.00 175.26 176.53 1f5f n GLU 120 N 2.93 2.80 -0.00 -4.83 2.13 -1.26 -0.36 120.64 122.04 1f5f n GLU 120 Ca -0.18 1.01 0.01 0.00 0.66 0.00 0.00 57.16 58.67 1f5f n GLU 120 Cb 0.53 -2.89 -0.02 0.00 0.27 0.00 0.00 31.44 29.33 1f5f n GLU 120 CO 0.00 0.00 0.00 1.33 -0.41 0.00 0.00 177.13 178.05 1f5f n VAL 121 N 4.42 0.00 -3.64 6.31 0.24 0.25 -4.91 118.33 120.99 1f5f n VAL 121 Ca 0.17 -0.35 -0.11 0.00 -2.04 0.00 0.00 64.34 62.01 1f5f n VAL 121 Cb 0.36 0.87 -0.07 0.00 -1.47 0.00 0.00 33.84 33.53 1f5f n VAL 121 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 1f5f s LEU 122 N -2.37 -0.74 -0.16 1.34 2.96 -1.15 -4.42 118.68 114.13 1f5f s LEU 122 Ca 0.00 1.42 -0.02 0.00 -0.22 0.00 0.00 54.13 55.32 1f5f s LEU 122 Cb 0.02 2.34 0.05 0.00 0.50 0.00 0.00 46.19 49.09 1f5f s LEU 122 CO 0.10 -0.24 0.00 -0.60 -1.32 0.00 0.00 176.35 174.29 1f5f s ARG 123 N 0.92 0.89 -0.50 1.98 3.52 -1.26 -0.51 118.95 123.99 1f5f s ARG 123 Ca -0.04 -0.34 -0.19 0.00 -0.13 0.00 0.00 55.73 55.02 1f5f s ARG 123 Cb -0.05 -1.83 0.05 0.00 -1.56 0.00 0.00 34.95 31.56 1f5f s ARG 123 CO -0.08 -0.50 0.61 -0.51 -0.81 0.00 0.00 175.30 174.01 1f5f s LEU 124 N 1.81 4.95 0.33 -0.88 1.43 0.54 -4.94 118.68 121.92 1f5f s LEU 124 Ca 0.01 -0.88 -0.11 0.00 -1.03 0.00 0.00 54.13 52.12 1f5f s LEU 124 Cb -0.15 -2.45 -0.07 0.00 0.03 0.00 0.00 46.19 43.54 1f5f s LEU 124 CO -0.07 -0.87 0.69 -0.13 0.23 0.00 0.00 176.35 176.20 1f5f s ARG 125 N 2.59 3.85 -1.26 1.70 0.52 -1.26 -0.45 118.95 124.64 1f5f s ARG 125 Ca 0.15 0.46 -0.07 0.00 -0.52 0.00 0.00 55.73 55.74 1f5f s ARG 125 Cb -0.19 -2.48 0.01 0.00 0.52 0.00 0.00 34.95 32.81 1f5f s ARG 125 CO 0.12 0.13 1.09 1.04 0.02 0.00 0.00 175.30 177.71 1f5f n GLN 126 N -0.68 -7.35 0.00 3.54 6.02 -1.13 -4.89 117.38 112.90 1f5f n GLN 126 Ca 0.02 0.78 0.03 0.00 -0.01 0.00 0.00 57.00 57.81 1f5f n GLN 126 Cb 0.53 -5.67 -0.03 0.00 1.02 0.00 0.00 30.24 26.10 1f5f n GLN 126 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.06 177.38 1f5f n VAL 127 N -4.75 0.00 -4.24 5.09 0.24 -0.16 -4.73 118.33 109.78 1f5f n VAL 127 Ca -0.02 -0.38 -0.19 0.00 -2.04 0.00 0.00 64.34 61.71 1f5f n VAL 127 Cb 0.57 1.01 -0.16 0.00 -1.47 0.00 0.00 33.84 33.79 1f5f n VAL 127 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1f5f s SER 128 N -1.43 0.93 0.66 -1.34 0.15 -0.63 -4.53 113.70 107.52 1f5f s SER 128 Ca 0.02 -0.14 0.02 0.00 0.70 0.00 0.00 55.95 56.56 1f5f s SER 128 Cb 0.04 -0.30 0.12 0.00 -1.71 0.00 0.00 66.02 64.17 1f5f s SER 128 CO 0.21 0.02 0.86 0.61 1.20 0.00 0.00 173.24 176.14 1f5f n GLY 129 N 3.50 0.94 3.53 9.45 0.00 -1.26 -4.49 105.19 116.87 1f5f n GLY 129 Ca -0.20 -2.07 -0.47 0.00 0.00 0.00 0.00 46.02 43.28 1f5f n GLY 129 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1f5f n PRO 130 N -2.55 0.88 -2.32 1.61 -0.02 -1.26 -5.05 135.00 126.29 1f5f n PRO 130 Ca 0.15 0.31 -0.41 0.00 -2.02 0.00 0.00 63.50 61.52 1f5f n PRO 130 Cb 0.53 -1.62 -0.03 0.00 -0.02 0.00 0.00 33.50 32.37 1f5f n PRO 130 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1f5f s LEU 131 N 1.17 3.40 -0.27 2.45 0.20 -1.26 -5.24 118.68 119.13 1f5f s LEU 131 Ca 0.65 0.38 -0.05 0.00 0.69 0.00 0.00 54.13 55.80 1f5f s LEU 131 Cb -0.83 -3.04 0.01 0.00 -0.43 0.00 0.00 46.19 41.90 1f5f s LEU 131 CO 0.57 -1.78 0.32 1.41 -0.29 0.00 0.00 176.35 176.58 1f5f n HIS 136 N 9.97 -1.68 0.18 5.38 -0.00 -1.26 -4.80 115.22 123.01 1f5f n HIS 136 Ca 0.14 0.66 0.03 0.00 -0.00 0.00 0.00 57.72 58.55 1f5f n HIS 136 Cb 0.49 -2.82 0.35 0.00 -0.00 0.00 0.00 29.99 28.01 1f5f n HIS 136 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 1f5f h PRO 137 N 0.73 0.00 -4.99 -0.41 0.11 -1.96 -3.44 132.00 122.04 1f5f h PRO 137 Ca 0.00 0.00 -0.43 0.00 0.11 0.00 0.00 66.00 65.68 1f5f h PRO 137 Cb 0.68 0.00 -0.28 0.00 0.11 0.00 0.00 31.00 31.51 1f5f h PRO 137 CO 0.12 0.39 -0.79 0.42 -0.21 0.00 0.00 178.00 177.93 1f5f s ILE 138 N -4.09 0.89 -0.11 4.15 1.01 -1.26 -0.99 121.20 120.80 1f5f s ILE 138 Ca -0.02 -0.55 -0.01 0.00 0.00 0.00 0.00 60.65 60.07 1f5f s ILE 138 Cb 0.14 -0.76 -0.02 0.00 0.01 0.00 0.00 42.46 41.83 1f5f s ILE 138 CO 0.72 0.20 -0.08 -0.32 0.00 0.00 0.00 174.94 175.46 1f5f s MET 139 N -0.40 3.23 -0.06 2.79 -2.45 -0.35 -4.38 119.30 117.69 1f5f s MET 139 Ca 0.04 -0.59 -0.00 0.00 -1.25 0.00 0.00 55.69 53.88 1f5f s MET 139 Cb -0.05 -2.69 -0.03 0.00 1.25 0.00 0.00 34.83 33.31 1f5f s MET 139 CO -0.00 0.38 -0.02 1.03 1.05 0.00 0.00 175.02 177.46 1f5f s ARG 140 N -0.06 2.86 -0.17 4.11 0.52 0.46 -0.16 118.95 126.50 1f5f s ARG 140 Ca -0.00 -0.50 0.01 0.00 -0.52 0.00 0.00 55.73 54.71 1f5f s ARG 140 Cb -0.13 -2.70 0.01 0.00 0.52 0.00 0.00 34.95 32.65 1f5f s ARG 140 CO 0.03 0.67 -0.19 0.42 0.02 0.00 0.00 175.30 176.25 1f5f s ILE 141 N -0.92 2.25 -0.12 1.52 -1.09 0.27 -0.89 121.20 122.22 1f5f s ILE 141 Ca 0.15 -0.89 0.01 0.00 -2.23 0.00 0.00 60.65 57.68 1f5f s ILE 141 Cb -0.11 -1.94 -0.01 0.00 -1.58 0.00 0.00 42.46 38.82 1f5f s ILE 141 CO 0.04 0.53 -0.15 0.00 -1.23 0.00 0.00 174.94 174.13 1f5f s ALA 142 N 1.09 2.54 -0.19 9.38 0.00 0.72 -0.14 121.76 135.17 1f5f s ALA 142 Ca -0.00 -0.91 -0.08 0.00 0.00 0.00 0.00 51.96 50.97 1f5f s ALA 142 Cb -0.14 -1.13 -0.04 0.00 0.00 0.00 0.00 23.12 21.81 1f5f s ALA 142 CO -0.07 0.28 0.09 -0.51 0.00 0.00 0.00 175.76 175.54 1f5f s LEU 143 N 0.28 3.97 -1.09 0.00 1.43 -0.32 -0.51 118.68 122.44 1f5f s LEU 143 Ca -0.11 0.14 0.00 0.00 -1.03 0.00 0.00 54.13 53.13 1f5f s LEU 143 Cb -0.16 -2.01 0.00 0.00 0.03 0.00 0.00 46.19 44.05 1f5f s LEU 143 CO 0.06 0.18 0.00 0.61 0.23 0.00 0.00 176.35 177.43 1f5f n GLY 144 N 3.49 1.16 0.00 -3.19 0.00 0.04 -0.78 105.19 105.91 1f5f n GLY 144 Ca -0.16 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.39 1f5f n GLY 144 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1f5f n GLY 145 N -1.53 0.01 3.93 -0.02 0.00 -1.26 -4.39 105.19 101.93 1f5f n GLY 145 Ca -0.10 -0.96 -0.19 0.00 0.00 0.00 0.00 46.02 44.76 1f5f n GLY 145 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1f5f s LEU 146 N 0.00 3.63 -0.25 0.99 1.43 -1.26 -4.08 118.68 119.13 1f5f s LEU 146 Ca 0.00 -0.49 0.13 0.00 -1.03 0.00 0.00 54.13 52.74 1f5f s LEU 146 Cb 0.00 -2.39 0.63 0.00 0.03 0.00 0.00 46.19 44.46 1f5f s LEU 146 CO 0.00 -0.57 1.59 0.18 0.23 0.00 0.00 176.35 177.78 1f5f n LEU 147 N -1.61 4.86 -3.71 1.79 4.77 -1.26 -4.59 117.00 117.26 1f5f n LEU 147 Ca 0.03 -3.18 -0.10 0.00 -0.03 0.00 0.00 56.01 52.72 1f5f n LEU 147 Cb 0.60 -0.64 -0.06 0.00 -2.33 0.00 0.00 43.42 40.99 1f5f n LEU 147 CO 0.41 0.80 0.07 0.72 -1.33 0.00 0.00 177.39 178.06 1f5f s PHE 148 N -2.94 -0.09 0.52 -1.77 -0.00 -1.26 -5.01 117.98 107.44 1f5f s PHE 148 Ca 0.48 -0.26 -0.22 0.00 -0.00 0.00 0.00 56.93 56.93 1f5f s PHE 148 Cb 0.39 0.15 -0.06 0.00 -0.00 0.00 0.00 43.02 43.50 1f5f s PHE 148 CO 0.10 -0.64 1.34 -2.30 -0.00 0.00 0.00 175.22 173.72 1f5f n PRO 149 N -0.14 1.75 0.19 1.99 -0.02 -1.26 -4.89 135.00 132.62 1f5f n PRO 149 Ca -0.16 0.64 0.05 0.00 -2.02 0.00 0.00 63.50 62.01 1f5f n PRO 149 Cb 0.63 -2.54 0.51 0.00 -0.02 0.00 0.00 33.50 32.07 1f5f n PRO 149 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1f5f h ALA 150 N 1.57 1.74 -0.58 3.55 0.00 -1.97 -1.52 119.26 122.04 1f5f h ALA 150 Ca -0.50 -0.11 0.17 0.00 0.00 0.00 0.00 54.91 54.46 1f5f h ALA 150 Cb 1.30 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.02 1f5f h ALA 150 CO 0.58 0.20 0.53 0.66 0.00 0.00 0.00 179.25 181.21 1f5f h SER 151 N 0.11 0.00 0.91 0.00 4.64 -1.90 -1.87 113.55 115.44 1f5f h SER 151 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 1f5f h SER 151 Cb 0.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.29 1f5f h SER 151 CO 0.01 0.00 -0.31 0.59 -0.87 0.00 0.00 176.83 176.25 1f5f n ASN 152 N -3.89 0.48 -4.40 4.97 3.02 -0.57 -4.84 115.26 110.02 1f5f n ASN 152 Ca 0.11 0.20 -0.33 0.00 -0.03 0.00 0.00 54.58 54.54 1f5f n ASN 152 Cb 0.76 -0.17 0.14 0.00 -0.61 0.00 0.00 39.78 39.90 1f5f n ASN 152 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1f5f n LEU 153 N -1.81 -0.54 -0.22 3.41 4.77 -0.70 -4.92 117.00 117.00 1f5f n LEU 153 Ca 0.05 0.22 -0.04 0.00 -0.03 0.00 0.00 56.01 56.21 1f5f n LEU 153 Cb 0.38 -1.17 0.06 0.00 -2.33 0.00 0.00 43.42 40.36 1f5f n LEU 153 CO 0.32 -3.44 1.11 0.03 -1.33 0.00 0.00 177.39 174.09 1f5f h ARG 154 N -1.72 0.74 -3.40 3.23 3.08 -1.90 -3.37 114.38 111.03 1f5f h ARG 154 Ca -0.46 -0.04 -0.55 0.00 0.07 0.00 0.00 59.98 58.99 1f5f h ARG 154 Cb 1.30 -0.17 -0.40 0.00 0.08 0.00 0.00 29.97 30.78 1f5f h ARG 154 CO 0.36 0.49 -0.76 -1.17 -1.07 0.00 0.00 179.97 177.81 1f5f s LEU 155 N -10.19 1.54 0.57 3.04 2.96 -1.26 -5.13 118.68 110.21 1f5f s LEU 155 Ca -0.13 -1.29 -0.19 0.00 -0.22 0.00 0.00 54.13 52.30 1f5f s LEU 155 Cb 0.14 -0.67 -0.06 0.00 0.50 0.00 0.00 46.19 46.10 1f5f s LEU 155 CO 0.76 -0.38 0.99 -2.65 -1.32 0.00 0.00 176.35 173.74 1f5f n PRO 156 N 5.00 1.01 -4.09 0.98 -0.02 -1.26 -5.03 135.00 131.58 1f5f n PRO 156 Ca -0.05 0.38 -0.10 0.00 -2.02 0.00 0.00 63.50 61.72 1f5f n PRO 156 Cb 0.44 -2.17 -0.09 0.00 -0.02 0.00 0.00 33.50 31.66 1f5f n PRO 156 CO 0.00 0.00 0.00 -0.48 1.98 0.00 0.00 175.50 177.00 1f5f s LEU 157 N -1.85 1.52 -0.32 2.45 0.05 -1.26 -5.10 118.68 114.16 1f5f s LEU 157 Ca 0.74 -1.10 -0.23 0.00 0.05 0.00 0.00 54.13 53.59 1f5f s LEU 157 Cb -0.44 0.58 0.00 0.00 -2.05 0.00 0.00 46.19 44.28 1f5f s LEU 157 CO 0.49 -0.78 0.75 -0.69 -0.55 0.00 0.00 176.35 175.57 1f5f s VAL 158 N -4.02 4.81 0.42 1.48 1.01 -1.26 -4.87 120.40 117.97 1f5f s VAL 158 Ca 0.22 1.03 0.18 0.00 0.00 0.00 0.00 61.98 63.40 1f5f s VAL 158 Cb 0.06 -4.13 0.20 0.00 0.00 0.00 0.00 36.38 32.51 1f5f s VAL 158 CO 0.01 -0.27 1.98 1.55 0.00 0.00 0.00 175.10 178.37 1f5f h PRO 159 N 8.23 0.00 -6.46 2.72 0.13 -1.91 -3.33 132.00 131.37 1f5f h PRO 159 Ca -0.25 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.35 1f5f h PRO 159 Cb 1.10 0.00 0.03 0.00 0.13 0.00 0.00 31.00 32.26 1f5f h PRO 159 CO 0.87 0.20 1.16 0.00 -0.23 0.00 0.00 178.00 180.00 1f5f s ALA 160 N -4.41 3.71 -0.31 -0.56 0.00 -1.25 -0.64 121.76 118.29 1f5f s ALA 160 Ca -0.03 1.42 0.01 0.00 0.00 0.00 0.00 51.96 53.35 1f5f s ALA 160 Cb 0.15 -3.79 0.07 0.00 0.00 0.00 0.00 23.12 19.54 1f5f s ALA 160 CO 0.67 -1.35 -0.00 -1.17 0.00 0.00 0.00 175.76 173.91 1f5f s LEU 161 N 3.33 4.09 -0.93 0.00 2.96 -1.26 -4.33 118.68 122.53 1f5f s LEU 161 Ca 0.84 -1.60 -0.24 0.00 -0.22 0.00 0.00 54.13 52.91 1f5f s LEU 161 Cb -0.45 -1.65 0.05 0.00 0.50 0.00 0.00 46.19 44.64 1f5f s LEU 161 CO 0.38 -0.29 1.37 -1.81 -1.32 0.00 0.00 176.35 174.67 1f5f s ASP 162 N 1.19 6.42 0.35 3.68 1.01 -1.26 -3.84 116.67 124.22 1f5f s ASP 162 Ca -0.01 -1.25 -0.11 0.00 0.71 0.00 0.00 52.55 51.89 1f5f s ASP 162 Cb -0.20 -2.55 0.04 0.00 1.01 0.00 0.00 42.92 41.23 1f5f s ASP 162 CO -0.04 -1.55 0.66 0.61 0.21 0.00 0.00 175.17 175.06 1f5f n GLY 163 N 6.37 1.32 3.63 0.21 0.00 -1.26 -4.18 105.19 111.27 1f5f n GLY 163 Ca 0.24 -1.32 -0.24 0.00 0.00 0.00 0.00 46.02 44.70 1f5f n GLY 163 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1f5f s LEU 165 N -3.37 1.73 0.22 0.00 2.96 0.57 -2.00 118.68 118.78 1f5f s LEU 165 Ca 0.29 -0.09 -0.11 0.00 -0.22 0.00 0.00 54.13 54.01 1f5f s LEU 165 Cb -0.07 -0.29 -0.01 0.00 0.50 0.00 0.00 46.19 46.32 1f5f s LEU 165 CO 0.18 0.01 0.40 0.00 -1.32 0.00 0.00 176.35 175.63 1f5f s ARG 166 N 0.28 1.42 -1.50 1.98 1.70 -0.66 -0.39 118.95 121.78 1f5f s ARG 166 Ca -0.03 -1.25 -0.10 0.00 -0.47 0.00 0.00 55.73 53.88 1f5f s ARG 166 Cb -0.07 0.43 0.07 0.00 -0.57 0.00 0.00 34.95 34.81 1f5f s ARG 166 CO -0.00 -0.57 0.80 0.54 -1.08 0.00 0.00 175.30 174.99 1f5f n ARG 167 N -0.33 -4.63 -3.64 3.89 1.74 -1.26 -0.52 116.66 111.90 1f5f n ARG 167 Ca -0.03 0.53 -0.36 0.00 -0.77 0.00 0.00 57.85 57.22 1f5f n ARG 167 Cb 0.63 -5.20 -0.06 0.00 -1.02 0.00 0.00 32.46 26.81 1f5f n ARG 167 CO 0.00 0.00 0.00 0.16 -1.52 0.00 0.00 177.63 176.27 1f5f s ASP 168 N -3.69 6.62 -0.08 0.55 3.84 -1.26 -4.13 116.67 118.52 1f5f s ASP 168 Ca 0.44 0.74 -0.03 0.00 -0.00 0.00 0.00 52.55 53.70 1f5f s ASP 168 Cb -0.23 -2.16 0.04 0.00 -1.38 0.00 0.00 42.92 39.20 1f5f s ASP 168 CO 0.85 0.28 0.13 -0.55 -0.00 0.00 0.00 175.17 175.88 1f5f s SER 169 N -1.41 0.92 -0.36 2.11 0.15 0.05 -5.00 113.70 110.16 1f5f s SER 169 Ca 0.26 0.22 -0.05 0.00 0.70 0.00 0.00 55.95 57.08 1f5f s SER 169 Cb -0.14 0.14 0.07 0.00 -1.71 0.00 0.00 66.02 64.37 1f5f s SER 169 CO 0.14 -0.25 0.13 0.26 1.20 0.00 0.00 173.24 174.72 1f5f s TRP 170 N 2.25 3.35 0.00 3.44 0.52 -1.26 -1.25 118.94 125.99 1f5f s TRP 170 Ca 0.04 -1.81 0.00 0.00 0.02 0.00 0.00 56.10 54.35 1f5f s TRP 170 Cb -0.12 -2.59 0.00 0.00 -1.15 0.00 0.00 33.47 29.61 1f5f s TRP 170 CO -0.05 -0.83 0.00 1.28 0.02 0.00 0.00 176.95 177.37 1f5f n LEU 171 N 4.73 0.00 -4.19 2.99 4.77 -0.64 -4.08 117.00 120.58 1f5f n LEU 171 Ca -0.10 0.00 -0.37 0.00 -0.03 0.00 0.00 56.01 55.51 1f5f n LEU 171 Cb 0.43 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.41 1f5f n LEU 171 CO 0.32 0.00 -0.20 -0.62 -1.33 0.00 0.00 177.39 175.56 1f5f s ASP 172 N -4.00 5.30 0.51 -1.43 -1.08 -1.22 -4.78 116.67 109.97 1f5f s ASP 172 Ca 0.00 -1.60 0.23 0.00 -0.52 0.00 0.00 52.55 50.65 1f5f s ASP 172 Cb 0.00 -1.85 1.32 0.00 -1.46 0.00 0.00 42.92 40.93 1f5f s ASP 172 CO 0.00 -0.45 1.99 0.50 0.52 0.00 0.00 175.17 177.73 1f5f h LYS 173 N 8.16 0.08 0.00 4.34 3.64 -1.95 0.21 116.57 131.04 1f5f h LYS 173 Ca -0.19 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.18 1f5f h LYS 173 Cb 1.06 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.87 1f5f h LYS 173 CO 0.67 0.05 -0.03 1.96 -2.27 0.00 0.00 179.45 179.83 1f5f h GLN 174 N 0.08 0.00 -0.43 1.90 1.08 -1.95 -1.08 115.11 114.72 1f5f h GLN 174 Ca 0.26 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.46 1f5f h GLN 174 Cb 0.91 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.34 1f5f h GLN 174 CO -0.02 0.03 0.00 0.00 -0.95 0.00 0.00 178.83 177.89 1f5f n ALA 175 N -2.16 2.40 -2.43 3.87 0.00 0.71 -4.93 120.51 117.97 1f5f n ALA 175 Ca -0.02 -1.04 -0.43 0.00 0.00 0.00 0.00 53.44 51.95 1f5f n ALA 175 Cb 0.16 -0.83 -0.02 0.00 0.00 0.00 0.00 19.45 18.75 1f5f n ALA 175 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1f5f s GLU 176 N -1.36 4.18 0.08 0.00 2.12 -0.41 -1.05 118.70 122.25 1f5f s GLU 176 Ca 0.39 1.58 -0.01 0.00 0.36 0.00 0.00 54.97 57.29 1f5f s GLU 176 Cb 0.22 -3.78 -0.27 0.00 0.26 0.00 0.00 34.13 30.56 1f5f s GLU 176 CO 0.30 -0.77 1.14 0.82 -0.54 0.00 0.00 175.26 176.21 1f5f h ILE 177 N 5.57 1.50 -2.00 -3.70 2.04 -1.12 -3.47 117.51 116.33 1f5f h ILE 177 Ca -0.26 -3.11 0.20 0.00 1.00 0.00 0.00 64.86 62.69 1f5f h ILE 177 Cb 1.10 2.90 -0.12 0.00 -0.74 0.00 0.00 36.82 39.95 1f5f h ILE 177 CO 0.98 0.90 0.61 -0.94 0.00 0.00 0.00 178.15 179.70 1f5f s SER 178 N -7.02 -0.20 -0.04 1.72 1.04 -1.20 -5.00 113.70 103.01 1f5f s SER 178 Ca -0.03 -0.17 -0.02 0.00 0.48 0.00 0.00 55.95 56.20 1f5f s SER 178 Cb 0.08 0.34 0.02 0.00 0.10 0.00 0.00 66.02 66.56 1f5f s SER 178 CO 0.87 -0.59 0.09 0.00 0.98 0.00 0.00 173.24 174.58 1f5f s ALA 179 N -2.92 -0.15 -0.05 5.32 0.00 -1.26 -0.45 121.76 122.25 1f5f s ALA 179 Ca 0.10 0.40 0.05 0.00 0.00 0.00 0.00 51.96 52.51 1f5f s ALA 179 Cb 0.00 -0.27 -0.00 0.00 0.00 0.00 0.00 23.12 22.85 1f5f s ALA 179 CO -0.03 -0.10 -0.20 -1.12 0.00 0.00 0.00 175.76 174.31 1f5f s SER 180 N 0.68 2.52 -0.22 0.00 0.01 0.73 -4.98 113.70 112.44 1f5f s SER 180 Ca -0.05 -0.42 0.01 0.00 1.31 0.00 0.00 55.95 56.80 1f5f s SER 180 Cb -0.07 -0.74 0.03 0.00 0.21 0.00 0.00 66.02 65.45 1f5f s SER 180 CO -0.03 0.18 -0.14 0.00 0.41 0.00 0.00 173.24 173.67 1f5f s ALA 181 N 0.01 2.50 0.18 1.44 0.00 -1.26 -0.53 121.76 124.10 1f5f s ALA 181 Ca -0.05 -1.46 -0.13 0.00 0.00 0.00 0.00 51.96 50.32 1f5f s ALA 181 Cb -0.13 -1.44 0.09 0.00 0.00 0.00 0.00 23.12 21.64 1f5f s ALA 181 CO 0.03 -0.75 1.85 -1.35 0.00 0.00 0.00 175.76 175.55 1f5f h PRO 182 N 7.90 0.79 0.00 0.00 0.11 -1.85 -3.46 132.00 135.48 1f5f h PRO 182 Ca -0.34 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.72 1f5f h PRO 182 Cb 1.10 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.03 1f5f h PRO 182 CO 0.56 0.52 0.00 2.41 -0.21 0.00 0.00 178.00 181.29 1f5f n THR 183 N -4.67 0.00 -3.36 -1.15 -1.04 -1.26 -5.12 114.28 97.68 1f5f n THR 183 Ca 0.04 0.00 -0.39 0.00 -2.04 0.00 0.00 64.05 61.66 1f5f n THR 183 Cb 0.02 0.00 -0.09 0.00 -1.82 0.00 0.00 70.33 68.45 1f5f n THR 183 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 1f5f s SER 184 N 1.00 6.30 -0.29 8.00 0.01 -1.26 -5.02 113.70 122.43 1f5f s SER 184 Ca 0.00 0.35 -0.28 0.00 1.31 0.00 0.00 55.95 57.32 1f5f s SER 184 Cb 0.00 -2.22 -0.02 0.00 0.21 0.00 0.00 66.02 63.98 1f5f s SER 184 CO 0.00 -0.19 1.81 -0.76 0.41 0.00 0.00 173.24 174.51 1f5f s LEU 185 N 2.05 3.57 0.36 2.44 1.43 -1.26 -4.95 118.68 122.32 1f5f s LEU 185 Ca 0.16 1.43 -0.05 0.00 -1.03 0.00 0.00 54.13 54.65 1f5f s LEU 185 Cb -0.16 -3.53 -0.05 0.00 0.03 0.00 0.00 46.19 42.49 1f5f s LEU 185 CO 0.10 -1.65 0.64 -0.13 0.23 0.00 0.00 176.35 175.54 1f5f s ARG 186 N 5.54 3.61 0.54 1.70 0.52 -1.26 -4.97 118.95 124.63 1f5f s ARG 186 Ca 0.81 0.06 -0.10 0.00 -0.52 0.00 0.00 55.73 55.97 1f5f s ARG 186 Cb -0.24 -2.55 -0.05 0.00 0.52 0.00 0.00 34.95 32.63 1f5f s ARG 186 CO 0.33 0.07 0.93 -1.54 0.02 0.00 0.00 175.30 175.11 1f5f s SER 187 N -3.53 6.34 0.00 0.23 1.04 -1.26 -1.41 113.70 115.10 1f5f s SER 187 Ca 0.45 1.28 0.00 0.00 0.48 0.00 0.00 55.95 58.16 1f5f s SER 187 Cb -0.10 -2.40 0.00 0.00 0.10 0.00 0.00 66.02 63.62 1f5f s SER 187 CO 0.34 -0.69 0.49 0.00 0.98 0.00 0.00 173.24 174.36