#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3f2v n LYS 3 N 0.00 -0.28 -3.24 0.54 2.85 -1.26 -4.36 118.16 112.41 3f2v n LYS 3 Ca 0.00 -2.68 -0.38 0.00 -1.05 0.00 0.00 58.31 54.19 3f2v n LYS 3 Cb 0.00 -0.77 -0.06 0.00 -0.65 0.00 0.00 35.03 33.56 3f2v n LYS 3 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 177.40 178.34 3f2v s THR 4 N -3.25 5.09 -0.23 0.58 2.01 -0.80 -0.04 115.64 119.00 3f2v s THR 4 Ca 0.69 1.12 -0.15 0.00 0.31 0.00 0.00 61.69 63.66 3f2v s THR 4 Cb -0.04 -3.89 -0.04 0.00 0.01 0.00 0.00 72.50 68.55 3f2v s THR 4 CO 0.46 0.34 0.34 -0.22 -0.69 0.00 0.00 174.62 174.85 3f2v s LEU 5 N 0.44 4.11 -0.32 4.42 2.96 -0.50 -1.30 118.68 128.49 3f2v s LEU 5 Ca 0.30 0.37 -0.08 0.00 -0.22 0.00 0.00 54.13 54.49 3f2v s LEU 5 Cb -0.16 -2.41 0.01 0.00 0.50 0.00 0.00 46.19 44.13 3f2v s LEU 5 CO 0.14 -0.08 0.12 -0.63 -1.32 0.00 0.00 176.35 174.58 3f2v s ILE 6 N 1.50 4.19 -0.63 6.68 1.09 0.04 -1.25 121.20 132.82 3f2v s ILE 6 Ca 0.15 -0.74 -0.21 0.00 -1.10 0.00 0.00 60.65 58.76 3f2v s ILE 6 Cb -0.15 -3.22 0.08 0.00 -1.06 0.00 0.00 42.46 38.11 3f2v s ILE 6 CO 0.08 -0.02 0.85 -0.63 -0.10 0.00 0.00 174.94 175.12 3f2v s ILE 7 N 1.52 4.53 -0.31 2.92 -1.09 0.69 -0.09 121.20 129.37 3f2v s ILE 7 Ca 0.02 -0.58 -0.15 0.00 -2.23 0.00 0.00 60.65 57.71 3f2v s ILE 7 Cb -0.18 -4.59 -0.02 0.00 -1.58 0.00 0.00 42.46 36.08 3f2v s ILE 7 CO 0.04 -1.30 0.36 -0.22 -1.23 0.00 0.00 174.94 172.59 3f2v s LEU 8 N 3.50 4.24 -0.32 2.97 2.96 -0.10 -1.09 118.68 130.83 3f2v s LEU 8 Ca 0.18 0.00 0.02 0.00 -0.22 0.00 0.00 54.13 54.12 3f2v s LEU 8 Cb -0.20 -2.37 0.09 0.00 0.50 0.00 0.00 46.19 44.21 3f2v s LEU 8 CO 0.09 -0.27 0.02 0.00 -1.32 0.00 0.00 176.35 174.88 3f2v s ALA 9 N 2.05 2.84 -0.11 5.97 0.00 -0.34 -1.56 121.76 130.61 3f2v s ALA 9 Ca 0.13 -2.26 -0.04 0.00 0.00 0.00 0.00 51.96 49.80 3f2v s ALA 9 Cb -0.16 -1.92 0.06 0.00 0.00 0.00 0.00 23.12 21.09 3f2v s ALA 9 CO 0.11 -1.53 0.16 -1.58 0.00 0.00 0.00 175.76 172.92 3f2v s HIS 10 N 1.02 -0.15 0.65 0.00 5.04 -1.26 -4.17 115.29 116.43 3f2v s HIS 10 Ca 0.04 0.43 0.42 0.00 -1.54 0.00 0.00 55.06 54.41 3f2v s HIS 10 Cb -0.20 -0.33 2.32 0.00 0.04 0.00 0.00 32.58 34.41 3f2v s HIS 10 CO -0.06 -0.35 2.36 -1.00 -2.34 0.00 0.00 174.74 173.35 3f2v h PRO 11 N 8.37 0.00 -0.83 2.88 0.13 -2.00 -3.33 132.00 137.22 3f2v h PRO 11 Ca -0.14 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.68 3f2v h PRO 11 Cb 1.13 0.00 -0.22 0.00 0.13 0.00 0.00 31.00 32.04 3f2v h PRO 11 CO 0.18 0.00 -0.66 -1.71 -0.23 0.00 0.00 178.00 175.58 3f2v n ASN 12 N -3.23 -2.17 0.23 1.44 4.05 -1.26 -5.00 115.26 109.31 3f2v n ASN 12 Ca -0.03 -3.02 0.16 0.00 0.45 0.00 0.00 54.58 52.14 3f2v n ASN 12 Cb 0.07 1.10 0.70 0.00 1.23 0.00 0.00 39.78 42.88 3f2v n ASN 12 CO 0.00 0.00 0.00 -0.29 -3.05 0.00 0.00 177.26 173.92 3f2v h ILE 13 N 3.34 0.00 -0.50 -1.44 2.10 -1.96 -2.75 117.51 116.30 3f2v h ILE 13 Ca -0.03 -0.27 -0.12 0.00 1.08 0.00 0.00 64.86 65.52 3f2v h ILE 13 Cb 1.00 1.12 -0.02 0.00 -1.09 0.00 0.00 36.82 37.84 3f2v h ILE 13 CO 0.30 0.00 -0.16 0.77 -1.08 0.00 0.00 178.15 177.97 3f2v h SER 14 N 0.00 0.98 -0.09 2.19 4.64 -1.94 -1.86 113.55 117.47 3f2v h SER 14 Ca 0.00 -0.35 0.00 0.00 -0.47 0.00 0.00 61.79 60.97 3f2v h SER 14 Cb 0.32 -0.27 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 3f2v h SER 14 CO 0.00 1.13 0.00 0.00 -0.87 0.00 0.00 176.83 177.09 3f2v n GLN 15 N -4.13 1.42 -3.01 4.77 1.13 -1.04 -4.86 117.38 111.66 3f2v n GLN 15 Ca 0.01 -0.63 -0.33 0.00 -1.94 0.00 0.00 57.00 54.11 3f2v n GLN 15 Cb 0.43 -1.37 -0.06 0.00 0.11 0.00 0.00 30.24 29.35 3f2v n GLN 15 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 3f2v s SER 16 N -1.62 6.89 -0.05 1.08 0.15 -0.70 -4.99 113.70 114.45 3f2v s SER 16 Ca 0.32 1.46 -0.02 0.00 0.70 0.00 0.00 55.95 58.41 3f2v s SER 16 Cb 0.16 -2.44 -0.02 0.00 -1.71 0.00 0.00 66.02 62.00 3f2v s SER 16 CO 0.25 -0.23 -0.06 1.07 1.20 0.00 0.00 173.24 175.47 3f2v n THR 17 N -0.31 0.27 0.15 6.45 5.66 -1.26 -4.47 114.28 120.78 3f2v n THR 17 Ca 0.04 -0.07 -0.10 0.00 -3.05 0.00 0.00 64.05 60.87 3f2v n THR 17 Cb 0.53 -1.48 -0.06 0.00 -1.55 0.00 0.00 70.33 67.77 3f2v n THR 17 CO 0.00 0.00 0.00 0.58 -3.05 0.00 0.00 175.07 172.60 3f2v h VAL 18 N -0.16 0.33 -0.04 1.08 2.07 -1.97 -2.52 116.25 115.05 3f2v h VAL 18 Ca -0.12 -0.75 -0.05 0.00 0.82 0.00 0.00 66.70 66.60 3f2v h VAL 18 Cb 1.12 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 31.42 3f2v h VAL 18 CO -0.07 0.08 -0.21 0.45 0.02 0.00 0.00 177.57 177.84 3f2v h HIS 19 N -1.03 0.06 -0.42 1.57 -0.00 -1.94 0.30 115.15 113.69 3f2v h HIS 19 Ca -0.05 -0.01 -0.09 0.00 -0.00 0.00 0.00 60.37 60.23 3f2v h HIS 19 Cb 0.48 -0.02 -0.01 0.00 -0.00 0.00 0.00 27.41 27.86 3f2v h HIS 19 CO 0.03 0.27 -0.09 -0.22 -0.00 0.00 0.00 177.93 177.91 3f2v h LYS 20 N 0.05 0.80 -0.49 2.45 3.64 -1.78 0.12 116.57 121.36 3f2v h LYS 20 Ca 0.01 -0.30 -0.11 0.00 -1.27 0.00 0.00 60.65 58.97 3f2v h LYS 20 Cb 0.40 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.16 3f2v h LYS 20 CO 0.03 0.92 -0.13 0.45 -2.27 0.00 0.00 179.45 178.45 3f2v h HIS 21 N 0.62 1.07 -0.19 1.91 3.86 -0.93 -1.52 115.15 119.97 3f2v h HIS 21 Ca 0.11 -0.24 -0.00 0.00 -1.16 0.00 0.00 60.37 59.08 3f2v h HIS 21 Cb 0.62 -0.26 -0.01 0.00 1.06 0.00 0.00 27.41 28.82 3f2v h HIS 21 CO 0.05 1.03 0.10 -1.49 0.86 0.00 0.00 177.93 178.48 3f2v h TRP 22 N 0.81 0.26 -0.36 2.45 4.06 -0.78 -1.61 115.95 120.78 3f2v h TRP 22 Ca 0.12 -0.01 0.02 0.00 2.06 0.00 0.00 58.89 61.08 3f2v h TRP 22 Cb 0.69 -0.08 -0.02 0.00 -1.00 0.00 0.00 29.16 28.75 3f2v h TRP 22 CO 0.05 0.24 0.20 1.03 -3.56 0.00 0.00 178.44 176.41 3f2v h SER 23 N 0.20 0.33 -0.48 -3.49 0.87 -0.69 -1.88 113.55 108.40 3f2v h SER 23 Ca 0.07 0.00 0.01 0.00 -1.23 0.00 0.00 61.79 60.64 3f2v h SER 23 Cb 0.07 -0.06 -0.03 0.00 -0.44 0.00 0.00 62.40 61.94 3f2v h SER 23 CO -0.01 0.24 0.30 0.44 -0.53 0.00 0.00 176.83 177.27 3f2v h ASP 24 N 0.42 0.51 -0.68 6.23 3.45 -1.13 -1.46 116.42 123.75 3f2v h ASP 24 Ca 0.14 -0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.60 3f2v h ASP 24 Cb 0.01 -0.11 -0.03 0.00 -0.56 0.00 0.00 39.33 38.63 3f2v h ASP 24 CO -0.07 0.36 0.44 0.00 -1.57 0.00 0.00 179.24 178.40 3f2v h ALA 25 N 1.20 0.86 -0.32 3.45 0.00 -0.98 -2.91 119.26 120.56 3f2v h ALA 25 Ca 0.19 -0.06 -0.13 0.00 0.00 0.00 0.00 54.91 54.91 3f2v h ALA 25 Cb -0.02 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 3f2v h ALA 25 CO -0.07 0.30 -0.35 0.28 0.00 0.00 0.00 179.25 179.42 3f2v h VAL 26 N 0.92 1.28 0.00 0.00 2.07 -1.09 -2.78 116.25 116.65 3f2v h VAL 26 Ca 0.25 -1.50 0.00 0.00 0.82 0.00 0.00 66.70 66.27 3f2v h VAL 26 Cb -0.09 1.41 0.00 0.00 -1.52 0.00 0.00 31.29 31.09 3f2v h VAL 26 CO -0.05 0.49 0.00 0.54 0.02 0.00 0.00 177.57 178.56 3f2v n ARG 27 N -4.06 0.33 0.01 1.57 1.74 -0.57 -1.51 116.66 114.16 3f2v n ARG 27 Ca -0.01 0.03 0.13 0.00 -0.77 0.00 0.00 57.85 57.23 3f2v n ARG 27 Cb 0.50 -1.50 0.44 0.00 -1.02 0.00 0.00 32.46 30.87 3f2v n ARG 27 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 3f2v n GLN 28 N -1.05 0.03 -3.22 5.56 6.02 -1.05 -4.19 117.38 119.48 3f2v n GLN 28 Ca 0.08 0.02 -0.24 0.00 -0.01 0.00 0.00 57.00 56.85 3f2v n GLN 28 Cb 0.05 -1.53 -0.06 0.00 1.02 0.00 0.00 30.24 29.72 3f2v n GLN 28 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 3f2v n HIS 29 N -1.57 0.57 0.38 1.08 8.25 -0.57 -4.94 115.22 118.42 3f2v n HIS 29 Ca 0.06 -3.72 0.12 0.00 -0.26 0.00 0.00 57.72 53.92 3f2v n HIS 29 Cb 0.35 -0.40 0.49 0.00 1.12 0.00 0.00 29.99 31.54 3f2v n HIS 29 CO 0.00 0.00 0.00 -2.37 0.64 0.00 0.00 176.34 174.61 3f2v n THR 30 N 1.06 0.86 1.52 1.59 5.66 -1.26 -1.76 114.28 121.94 3f2v n THR 30 Ca 0.24 0.27 0.14 0.00 -3.05 0.00 0.00 64.05 61.64 3f2v n THR 30 Cb 0.53 -1.19 0.65 0.00 -1.55 0.00 0.00 70.33 68.76 3f2v n THR 30 CO 0.00 0.00 0.00 -0.90 -3.05 0.00 0.00 175.07 171.12 3f2v n ASP 31 N -2.20 0.59 0.00 1.09 5.75 -1.26 -3.95 116.55 116.57 3f2v n ASP 31 Ca 0.02 -0.82 0.00 0.00 -0.01 0.00 0.00 54.79 53.98 3f2v n ASP 31 Cb 0.21 -0.04 0.00 0.00 -1.03 0.00 0.00 41.12 40.26 3f2v n ASP 31 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 3f2v n ARG 32 N -0.76 3.59 -4.10 0.11 1.74 -0.78 -4.86 116.66 111.60 3f2v n ARG 32 Ca 0.17 0.00 -0.10 0.00 -0.77 0.00 0.00 57.85 57.15 3f2v n ARG 32 Cb 0.26 -0.97 -0.10 0.00 -1.02 0.00 0.00 32.46 30.63 3f2v n ARG 32 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 3f2v s PHE 33 N -1.93 0.66 -0.23 -1.55 0.40 -0.72 -1.90 117.98 112.71 3f2v s PHE 33 Ca 0.00 -0.81 0.00 0.00 -0.60 0.00 0.00 56.93 55.52 3f2v s PHE 33 Cb 0.00 -0.42 0.06 0.00 0.51 0.00 0.00 43.02 43.17 3f2v s PHE 33 CO 0.00 -0.20 -0.04 0.99 0.70 0.00 0.00 175.22 176.67 3f2v s THR 34 N -2.93 1.35 -0.35 0.64 2.01 -0.42 -4.26 115.64 111.68 3f2v s THR 34 Ca 0.02 -1.10 -0.27 0.00 0.31 0.00 0.00 61.69 60.65 3f2v s THR 34 Cb 0.01 -1.66 0.01 0.00 0.01 0.00 0.00 72.50 70.87 3f2v s THR 34 CO -0.05 -0.12 0.96 -0.69 -0.69 0.00 0.00 174.62 174.04 3f2v s VAL 35 N 1.48 4.57 -0.43 3.82 1.01 -1.26 -0.78 120.40 128.80 3f2v s VAL 35 Ca -0.05 1.35 -0.04 0.00 0.00 0.00 0.00 61.98 63.24 3f2v s VAL 35 Cb -0.19 -4.35 0.12 0.00 0.00 0.00 0.00 36.38 31.96 3f2v s VAL 35 CO -0.06 -0.52 0.24 -2.28 0.00 0.00 0.00 175.10 172.48 3f2v s HIS 36 N 3.52 3.56 -0.75 5.22 2.46 0.87 -4.97 115.29 125.20 3f2v s HIS 36 Ca 0.40 -2.38 -0.24 0.00 0.47 0.00 0.00 55.06 53.31 3f2v s HIS 36 Cb -0.12 -3.26 0.06 0.00 -0.13 0.00 0.00 32.58 29.13 3f2v s HIS 36 CO 0.18 -0.97 1.15 -1.21 -2.47 0.00 0.00 174.74 171.42 3f2v s GLU 37 N 1.07 3.23 0.21 2.88 2.02 -1.26 -0.93 118.70 125.93 3f2v s GLU 37 Ca 0.09 -0.72 -0.11 0.00 0.02 0.00 0.00 54.97 54.24 3f2v s GLU 37 Cb -0.23 -4.39 0.28 0.00 0.10 0.00 0.00 34.13 29.89 3f2v s GLU 37 CO -0.04 -1.98 1.66 -0.07 0.02 0.00 0.00 175.26 174.85 3f2v h LEU 38 N 12.06 -0.32 -1.49 1.80 4.07 -1.67 0.19 115.31 129.96 3f2v h LEU 38 Ca -0.19 0.16 -0.05 0.00 0.08 0.00 0.00 57.88 57.87 3f2v h LEU 38 Cb 1.05 0.29 -0.01 0.00 1.08 0.00 0.00 40.66 43.07 3f2v h LEU 38 CO 1.24 -0.13 -0.26 1.88 -1.08 0.00 0.00 178.44 180.09 3f2v h TYR 39 N 0.10 0.00 0.19 1.13 -1.99 -1.84 0.18 116.97 114.74 3f2v h TYR 39 Ca 0.32 0.00 -0.28 0.00 2.00 0.00 0.00 58.73 60.77 3f2v h TYR 39 Cb 0.51 0.00 0.03 0.00 2.00 0.00 0.00 36.73 39.27 3f2v h TYR 39 CO -0.38 0.26 -1.21 0.00 -0.00 0.00 0.00 178.16 176.83 3f2v h ALA 40 N 1.74 -0.11 -0.05 3.88 0.00 -1.61 -3.02 119.26 120.09 3f2v h ALA 40 Ca -0.00 -0.78 -0.19 0.00 0.00 0.00 0.00 54.91 53.93 3f2v h ALA 40 Cb 0.52 0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 3f2v h ALA 40 CO 0.03 0.58 -0.79 0.28 0.00 0.00 0.00 179.25 179.36 3f2v h VAL 41 N 0.01 1.40 -2.18 0.00 2.07 -0.83 -3.37 116.25 113.35 3f2v h VAL 41 Ca -0.20 -2.25 -0.58 0.00 0.82 0.00 0.00 66.70 64.48 3f2v h VAL 41 Cb 1.94 2.21 -0.41 0.00 -1.52 0.00 0.00 31.29 33.50 3f2v h VAL 41 CO 0.23 0.67 -0.73 -1.22 0.02 0.00 0.00 177.57 176.54 3f2v n TYR 42 N -3.80 2.92 0.26 1.57 4.01 0.63 -4.92 117.16 117.84 3f2v n TYR 42 Ca -0.05 -4.00 0.16 0.00 -0.16 0.00 0.00 57.90 53.86 3f2v n TYR 42 Cb 0.74 -0.50 0.82 0.00 -0.31 0.00 0.00 39.34 40.10 3f2v n TYR 42 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 3f2v h PRO 43 N 3.65 0.00 -0.20 -0.72 0.13 -1.70 -1.19 132.00 131.97 3f2v h PRO 43 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 3f2v h PRO 43 Cb 0.67 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.80 3f2v h PRO 43 CO 0.75 0.00 0.00 1.04 -0.23 0.00 0.00 178.00 179.56 3f2v n GLN 44 N -2.62 1.78 -1.32 0.86 3.00 -1.26 -4.98 117.38 112.83 3f2v n GLN 44 Ca -0.01 -1.73 -0.08 0.00 -0.01 0.00 0.00 57.00 55.16 3f2v n GLN 44 Cb 0.09 -1.32 -0.03 0.00 0.00 0.00 0.00 30.24 28.98 3f2v n GLN 44 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3f2v n GLY 45 N 0.86 0.89 3.18 1.08 0.00 -0.45 -4.96 105.19 105.79 3f2v n GLY 45 Ca 0.12 -0.68 -0.44 0.00 0.00 0.00 0.00 46.02 45.02 3f2v n GLY 45 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3f2v n LYS 46 N -2.67 3.87 -1.75 1.61 4.01 -1.26 -5.03 118.16 116.94 3f2v n LYS 46 Ca -0.08 -4.31 -0.42 0.00 -0.51 0.00 0.00 58.31 52.99 3f2v n LYS 46 Cb 0.29 -2.64 -0.02 0.00 -0.51 0.00 0.00 35.03 32.15 3f2v n LYS 46 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 3f2v s ILE 47 N -1.29 2.05 -0.77 -0.18 1.01 -1.26 -4.94 121.20 115.82 3f2v s ILE 47 Ca 0.33 0.04 -0.17 0.00 0.00 0.00 0.00 60.65 60.85 3f2v s ILE 47 Cb -0.02 -3.02 0.15 0.00 0.01 0.00 0.00 42.46 39.58 3f2v s ILE 47 CO 0.01 0.00 0.85 -0.62 0.00 0.00 0.00 174.94 175.18 3f2v s ASP 48 N 0.80 6.51 0.15 3.58 3.68 -1.26 -4.93 116.67 125.20 3f2v s ASP 48 Ca 0.68 -2.05 -0.22 0.00 2.13 0.00 0.00 52.55 53.09 3f2v s ASP 48 Cb -0.49 -2.30 0.03 0.00 -1.45 0.00 0.00 42.92 38.71 3f2v s ASP 48 CO 0.41 -0.91 1.63 0.58 0.13 0.00 0.00 175.17 177.01 3f2v h VAL 49 N 5.51 0.40 -0.41 1.11 2.07 -1.92 -0.57 116.25 122.44 3f2v h VAL 49 Ca -0.02 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.57 3f2v h VAL 49 Cb 1.05 0.40 -0.07 0.00 -1.52 0.00 0.00 31.29 31.15 3f2v h VAL 49 CO 0.99 0.00 -0.01 0.00 0.02 0.00 0.00 177.57 178.57 3f2v h ALA 50 N 0.80 0.37 -0.62 1.67 0.00 -1.95 -0.02 119.26 119.51 3f2v h ALA 50 Ca 0.14 0.12 0.03 0.00 0.00 0.00 0.00 54.91 55.20 3f2v h ALA 50 Cb 0.45 0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.42 3f2v h ALA 50 CO -0.38 -0.40 0.38 0.00 0.00 0.00 0.00 179.25 178.85 3f2v h ALA 51 N 1.37 0.81 -0.29 0.00 0.00 -1.82 -1.17 119.26 118.16 3f2v h ALA 51 Ca 0.20 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 3f2v h ALA 51 Cb 0.29 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 3f2v h ALA 51 CO -0.35 0.12 0.08 0.93 0.00 0.00 0.00 179.25 180.03 3f2v h GLU 52 N 0.75 0.46 -0.45 0.00 4.39 -0.21 -1.48 114.58 118.04 3f2v h GLU 52 Ca 0.25 -0.11 -0.02 0.00 0.34 0.00 0.00 59.36 59.83 3f2v h GLU 52 Cb 0.03 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 28.60 3f2v h GLU 52 CO -0.11 0.53 0.20 1.96 -1.16 0.00 0.00 179.01 180.44 3f2v h GLN 53 N 0.31 0.66 -0.40 2.33 4.20 -0.86 -2.12 115.11 119.23 3f2v h GLN 53 Ca 0.09 -0.11 -0.04 0.00 0.06 0.00 0.00 58.65 58.66 3f2v h GLN 53 Cb 0.27 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 27.92 3f2v h GLN 53 CO -0.00 0.58 0.08 0.87 -0.67 0.00 0.00 178.83 179.68 3f2v h LYS 54 N 0.58 0.59 -0.54 1.46 1.57 -1.14 -1.08 116.57 118.02 3f2v h LYS 54 Ca 0.15 -0.11 -0.03 0.00 -1.87 0.00 0.00 60.65 58.80 3f2v h LYS 54 Cb 0.15 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.34 3f2v h LYS 54 CO -0.02 0.56 0.22 1.25 -0.57 0.00 0.00 179.45 180.89 3f2v h LEU 55 N 0.58 0.74 -0.48 2.94 5.85 -0.82 -1.22 115.31 122.89 3f2v h LEU 55 Ca 0.13 -0.16 -0.06 0.00 0.84 0.00 0.00 57.88 58.63 3f2v h LEU 55 Cb 0.25 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.07 3f2v h LEU 55 CO -0.00 0.70 0.05 0.40 -0.34 0.00 0.00 178.44 179.25 3f2v h ILE 56 N 0.73 1.25 -0.30 4.05 2.04 -0.87 -2.83 117.51 121.57 3f2v h ILE 56 Ca 0.18 -0.96 -0.03 0.00 1.00 0.00 0.00 64.86 65.05 3f2v h ILE 56 Cb 0.19 0.95 -0.02 0.00 -0.74 0.00 0.00 36.82 37.20 3f2v h ILE 56 CO -0.02 0.34 0.07 -0.33 0.00 0.00 0.00 178.15 178.21 3f2v h GLU 57 N 0.67 0.44 -0.00 2.37 5.08 -0.91 -2.13 114.58 120.10 3f2v h GLU 57 Ca 0.14 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 3f2v h GLU 57 Cb 0.43 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.60 3f2v h GLU 57 CO 0.01 0.41 -0.02 0.25 -1.00 0.00 0.00 179.01 178.67 3f2v n THR 58 N -4.36 0.00 -4.36 1.13 -2.24 -0.49 -4.84 114.28 99.11 3f2v n THR 58 Ca 0.01 -0.01 -0.30 0.00 -2.27 0.00 0.00 64.05 61.49 3f2v n THR 58 Cb 0.17 -0.43 -0.05 0.00 -2.10 0.00 0.00 70.33 67.93 3f2v n THR 58 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 3f2v s HIS 59 N -2.46 1.86 0.00 4.78 3.76 -0.80 -4.63 115.29 117.79 3f2v s HIS 59 Ca 0.32 -0.87 0.00 0.00 -0.15 0.00 0.00 55.06 54.36 3f2v s HIS 59 Cb 0.21 -1.76 0.00 0.00 1.11 0.00 0.00 32.58 32.13 3f2v s HIS 59 CO 0.45 -0.04 0.00 -3.47 -0.85 0.00 0.00 174.74 170.83 3f2v n ASP 60 N -1.45 0.00 -4.75 1.40 4.64 0.94 -4.87 116.55 112.45 3f2v n ASP 60 Ca -0.10 0.00 -0.35 0.00 -1.38 0.00 0.00 54.79 52.95 3f2v n ASP 60 Cb 0.66 0.00 0.04 0.00 -1.04 0.00 0.00 41.12 40.78 3f2v n ASP 60 CO 0.00 0.00 0.00 -0.44 -0.82 0.00 0.00 177.20 175.94 3f2v s SER 61 N -0.50 5.12 -0.09 1.67 0.01 -1.26 -4.68 113.70 113.98 3f2v s SER 61 Ca 0.00 2.33 0.04 0.00 1.31 0.00 0.00 55.95 59.63 3f2v s SER 61 Cb 0.00 -2.59 0.00 0.00 0.21 0.00 0.00 66.02 63.64 3f2v s SER 61 CO 0.00 -1.64 -0.21 -0.22 0.41 0.00 0.00 173.24 171.58 3f2v s LEU 62 N -4.24 1.99 -0.02 2.44 2.96 0.60 -1.40 118.68 121.00 3f2v s LEU 62 Ca 0.76 -0.49 0.05 0.00 -0.22 0.00 0.00 54.13 54.23 3f2v s LEU 62 Cb -0.29 -1.26 -0.01 0.00 0.50 0.00 0.00 46.19 45.13 3f2v s LEU 62 CO 0.35 0.14 -0.18 -0.69 -1.32 0.00 0.00 176.35 174.65 3f2v s VAL 63 N 0.35 1.44 -0.31 1.68 1.01 -0.38 -1.98 120.40 122.22 3f2v s VAL 63 Ca -0.16 -0.77 -0.03 0.00 0.00 0.00 0.00 61.98 61.02 3f2v s VAL 63 Cb -0.17 -1.21 0.04 0.00 0.00 0.00 0.00 36.38 35.04 3f2v s VAL 63 CO 0.07 0.41 0.03 0.26 0.00 0.00 0.00 175.10 175.87 3f2v s TRP 64 N -0.30 3.24 -0.23 5.22 0.51 -0.56 -0.22 118.94 126.59 3f2v s TRP 64 Ca 0.04 -1.65 -0.06 0.00 -2.12 0.00 0.00 56.10 52.31 3f2v s TRP 64 Cb -0.08 -2.16 -0.03 0.00 -0.81 0.00 0.00 33.47 30.39 3f2v s TRP 64 CO 0.00 -0.76 0.04 -1.14 -0.51 0.00 0.00 176.95 174.58 3f2v s GLN 65 N 1.32 3.63 0.05 4.98 0.74 -0.25 -1.11 119.66 129.01 3f2v s GLN 65 Ca -0.03 -0.50 -0.27 0.00 0.05 0.00 0.00 55.36 54.61 3f2v s GLN 65 Cb -0.19 -3.22 0.09 0.00 1.10 0.00 0.00 33.01 30.79 3f2v s GLN 65 CO 0.00 -0.12 0.78 -0.59 -0.55 0.00 0.00 175.29 174.81 3f2v s PHE 66 N 1.39 -0.43 0.35 1.67 -0.71 -0.59 -1.20 117.98 118.46 3f2v s PHE 66 Ca 0.05 0.29 -0.21 0.00 -1.04 0.00 0.00 56.93 56.02 3f2v s PHE 66 Cb -0.15 0.54 -0.10 0.00 -1.21 0.00 0.00 43.02 42.11 3f2v s PHE 66 CO 0.02 -0.66 0.88 -1.25 -1.34 0.00 0.00 175.22 172.87 3f2v s PRO 67 N -3.26 4.31 -0.39 1.99 0.04 -1.26 -2.99 135.00 133.44 3f2v s PRO 67 Ca 0.03 1.07 -0.26 0.00 0.04 0.00 0.00 61.00 61.88 3f2v s PRO 67 Cb -0.01 -2.53 0.02 0.00 0.04 0.00 0.00 34.50 32.02 3f2v s PRO 67 CO -0.10 0.17 0.95 0.42 0.04 0.00 0.00 177.00 178.48 3f2v s ILE 68 N -1.86 4.53 -0.22 0.56 -1.09 -0.06 -4.41 121.20 118.65 3f2v s ILE 68 Ca 0.54 1.13 -0.03 0.00 -2.23 0.00 0.00 60.65 60.06 3f2v s ILE 68 Cb -0.13 -4.38 -0.01 0.00 -1.58 0.00 0.00 42.46 36.36 3f2v s ILE 68 CO 0.18 -0.63 -0.05 -0.31 -1.23 0.00 0.00 174.94 172.90 3f2v s TYR 69 N 3.62 2.94 -1.37 3.97 2.02 -0.21 -4.63 117.35 123.69 3f2v s TYR 69 Ca 0.39 -0.97 -0.01 0.00 -0.37 0.00 0.00 57.07 56.11 3f2v s TYR 69 Cb -0.11 -2.09 0.01 0.00 -0.40 0.00 0.00 41.96 39.37 3f2v s TYR 69 CO 0.21 -0.55 0.59 0.91 -1.57 0.00 0.00 175.55 175.14 3f2v n TRP 70 N 4.75 -1.81 -2.84 2.71 5.03 -1.26 -1.56 117.44 122.46 3f2v n TRP 70 Ca -0.18 0.80 -0.19 0.00 3.03 0.00 0.00 57.50 60.95 3f2v n TRP 70 Cb 0.51 -4.06 0.01 0.00 -1.03 0.00 0.00 31.31 26.73 3f2v n TRP 70 CO 0.00 0.00 0.00 1.19 -0.03 0.00 0.00 177.69 178.85 3f2v n PHE 71 N -4.35 -1.60 -3.31 -5.99 3.72 -1.26 -4.89 117.46 99.77 3f2v n PHE 71 Ca -0.28 0.27 -0.01 0.00 -0.05 0.00 0.00 57.45 57.38 3f2v n PHE 71 Cb 0.67 -3.53 0.00 0.00 -0.94 0.00 0.00 39.48 35.68 3f2v n PHE 71 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 3f2v n ASN 72 N -2.18 -0.18 -5.01 4.37 2.85 -0.60 -4.85 115.26 109.66 3f2v n ASN 72 Ca -0.12 -1.17 -0.18 0.00 -0.11 0.00 0.00 54.58 53.01 3f2v n ASN 72 Cb 0.61 0.31 0.02 0.00 1.24 0.00 0.00 39.78 41.96 3f2v n ASN 72 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3f2v s PRO 74 N -4.39 3.03 0.27 0.00 0.02 -1.26 -4.72 135.00 127.95 3f2v s PRO 74 Ca 0.56 1.38 -0.01 0.00 0.02 0.00 0.00 61.00 62.95 3f2v s PRO 74 Cb -0.09 -1.98 0.52 0.00 0.02 0.00 0.00 34.50 32.96 3f2v s PRO 74 CO 0.34 -1.06 1.80 -1.00 -0.33 0.00 0.00 177.00 176.75 3f2v h PRO 75 N 0.35 0.80 0.00 5.54 0.13 -1.98 -2.15 132.00 134.69 3f2v h PRO 75 Ca -0.47 -0.05 -0.03 0.00 -0.87 0.00 0.00 66.00 64.58 3f2v h PRO 75 Cb 1.24 -0.18 -0.00 0.00 0.13 0.00 0.00 31.00 32.19 3f2v h PRO 75 CO 0.55 0.53 -0.13 1.25 -0.23 0.00 0.00 178.00 179.97 3f2v h LEU 76 N 0.82 0.00 -0.22 1.56 5.85 -1.99 0.01 115.31 121.35 3f2v h LEU 76 Ca 0.47 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 59.04 3f2v h LEU 76 Cb 0.53 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.56 3f2v h LEU 76 CO -0.29 0.13 -0.41 0.25 -0.34 0.00 0.00 178.44 177.78 3f2v h LEU 77 N 0.00 0.75 -0.98 2.25 5.85 -1.77 0.27 115.31 121.68 3f2v h LEU 77 Ca -0.00 -0.54 -0.01 0.00 0.84 0.00 0.00 57.88 58.17 3f2v h LEU 77 Cb 0.24 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 41.01 3f2v h LEU 77 CO 0.02 1.15 0.51 0.50 -0.34 0.00 0.00 178.44 180.28 3f2v h LYS 78 N 0.38 1.22 -0.46 1.25 1.63 -1.22 -0.10 116.57 119.27 3f2v h LYS 78 Ca 0.01 -0.13 -0.08 0.00 -0.85 0.00 0.00 60.65 59.61 3f2v h LYS 78 Cb 1.01 -0.25 -0.02 0.00 -0.60 0.00 0.00 32.23 32.38 3f2v h LYS 78 CO 0.09 0.87 -0.02 0.37 -3.45 0.00 0.00 179.45 177.32 3f2v h GLN 79 N 1.23 0.82 -0.35 1.90 4.15 -0.88 -2.12 115.11 119.86 3f2v h GLN 79 Ca 0.32 -0.27 0.06 0.00 0.77 0.00 0.00 58.65 59.52 3f2v h GLN 79 Cb -0.01 -0.07 -0.05 0.00 0.21 0.00 0.00 27.48 27.56 3f2v h GLN 79 CO -0.05 0.88 0.04 2.35 -1.93 0.00 0.00 178.83 180.12 3f2v h TRP 80 N 0.66 0.07 -0.47 3.99 7.01 -0.18 0.23 115.95 127.26 3f2v h TRP 80 Ca 0.13 0.02 0.02 0.00 2.11 0.00 0.00 58.89 61.17 3f2v h TRP 80 Cb 0.53 0.02 -0.03 0.00 -2.10 0.00 0.00 29.16 27.58 3f2v h TRP 80 CO 0.04 -0.01 0.28 -0.07 -2.79 0.00 0.00 178.44 175.89 3f2v h LEU 81 N 0.16 0.45 -0.88 0.65 3.38 -0.85 0.17 115.31 118.39 3f2v h LEU 81 Ca 0.17 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.05 3f2v h LEU 81 Cb 0.21 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 3f2v h LEU 81 CO -0.24 0.32 -0.18 0.44 0.09 0.00 0.00 178.44 178.87 3f2v h ASP 82 N 0.56 0.63 0.45 -0.43 3.32 -0.80 -2.56 116.42 117.59 3f2v h ASP 82 Ca 0.19 -0.20 -0.15 0.00 0.02 0.00 0.00 57.03 56.89 3f2v h ASP 82 Cb 0.01 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.36 3f2v h ASP 82 CO -0.08 0.82 -1.67 -0.62 -1.72 0.00 0.00 179.24 175.96 3f2v n GLU 83 N -4.15 0.64 -0.03 3.56 1.02 0.02 -4.51 120.64 117.19 3f2v n GLU 83 Ca 0.00 0.08 -0.21 0.00 -0.02 0.00 0.00 57.16 57.01 3f2v n GLU 83 Cb 0.38 -1.69 -0.13 0.00 -0.02 0.00 0.00 31.44 29.97 3f2v n GLU 83 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3f2v n VAL 84 N -2.70 1.71 -2.35 2.62 0.31 0.57 -4.56 118.33 113.93 3f2v n VAL 84 Ca -0.12 -0.62 -0.43 0.00 -0.01 0.00 0.00 64.34 63.16 3f2v n VAL 84 Cb 0.81 -1.67 0.00 0.00 -0.91 0.00 0.00 33.84 32.07 3f2v n VAL 84 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 3f2v n LEU 85 N -3.46 5.94 -4.89 7.52 4.77 -0.97 -4.79 117.00 121.13 3f2v n LEU 85 Ca -0.35 -4.26 -0.29 0.00 -0.03 0.00 0.00 56.01 51.08 3f2v n LEU 85 Cb 1.03 -1.64 -0.02 0.00 -2.33 0.00 0.00 43.42 40.46 3f2v n LEU 85 CO 0.38 0.82 0.40 0.42 -1.33 0.00 0.00 177.39 178.09 3f2v s THR 86 N 2.53 4.87 0.11 -5.08 -4.23 -1.26 -4.80 115.64 107.78 3f2v s THR 86 Ca 0.46 0.37 -0.31 0.00 -1.18 0.00 0.00 61.69 61.03 3f2v s THR 86 Cb 0.07 -3.78 -0.08 0.00 1.34 0.00 0.00 72.50 70.05 3f2v s THR 86 CO -0.00 -0.61 1.44 -0.47 -0.54 0.00 0.00 174.62 174.44 3f2v s TYR 87 N -2.46 3.12 0.00 3.99 6.14 -1.26 -1.43 117.35 125.45 3f2v s TYR 87 Ca 0.49 0.84 0.00 0.00 0.64 0.00 0.00 57.07 59.03 3f2v s TYR 87 Cb -0.10 -3.74 0.00 0.00 0.42 0.00 0.00 41.96 38.53 3f2v s TYR 87 CO 0.36 -2.67 0.00 0.41 0.64 0.00 0.00 175.55 174.29 3f2v n GLY 88 N 3.59 0.20 1.40 8.97 0.00 0.13 -4.86 105.19 114.62 3f2v n GLY 88 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 3f2v n GLY 88 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 3f2v n TRP 89 N -1.93 -0.77 -0.02 1.61 -0.00 -0.87 -3.16 117.44 112.30 3f2v n TRP 89 Ca 0.00 0.14 -0.09 0.00 -0.00 0.00 0.00 57.50 57.55 3f2v n TRP 89 Cb 0.00 0.22 -0.14 0.00 -0.00 0.00 0.00 31.31 31.39 3f2v n TRP 89 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 3f2v n ALA 90 N -3.34 1.48 -2.92 5.87 0.00 -0.52 -1.29 120.51 119.80 3f2v n ALA 90 Ca 0.00 -0.78 -0.10 0.00 0.00 0.00 0.00 53.44 52.56 3f2v n ALA 90 Cb 0.07 -0.83 -0.06 0.00 0.00 0.00 0.00 19.45 18.63 3f2v n ALA 90 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 3f2v s TYR 91 N -2.59 0.63 0.00 0.00 1.13 -1.23 -4.49 117.35 110.79 3f2v s TYR 91 Ca -0.05 -0.94 0.00 0.00 -1.41 0.00 0.00 57.07 54.67 3f2v s TYR 91 Cb 0.08 -0.01 0.00 0.00 -1.10 0.00 0.00 41.96 40.93 3f2v s TYR 91 CO 0.82 -0.93 0.00 0.41 -2.51 0.00 0.00 175.55 173.34 3f2v n GLY 92 N -0.38 0.04 0.37 5.49 0.00 -1.26 0.17 105.19 109.62 3f2v n GLY 92 Ca -0.00 -1.85 -0.10 0.00 0.00 0.00 0.00 46.02 44.07 3f2v n GLY 92 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3f2v n SER 93 N -0.73 -0.92 0.03 1.61 3.41 -1.26 -1.18 113.62 114.57 3f2v n SER 93 Ca 0.00 1.60 0.13 0.00 -0.26 0.00 0.00 58.87 60.33 3f2v n SER 93 Cb 0.00 -0.22 0.32 0.00 -0.26 0.00 0.00 64.21 64.05 3f2v n SER 93 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3f2v n LYS 94 N -5.04 0.11 -2.60 4.33 4.76 -1.26 -4.78 118.16 113.68 3f2v n LYS 94 Ca 0.02 0.05 -0.41 0.00 -2.87 0.00 0.00 58.31 55.09 3f2v n LYS 94 Cb 0.23 -1.59 -0.03 0.00 -1.84 0.00 0.00 35.03 31.80 3f2v n LYS 94 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 3f2v s GLY 95 N -3.25 1.17 -0.08 0.72 0.00 -0.33 -4.60 107.32 100.95 3f2v s GLY 95 Ca 0.10 -1.92 0.12 0.00 0.00 0.00 0.00 44.72 43.02 3f2v s GLY 95 CO 0.66 2.58 1.10 0.28 0.00 0.00 0.00 173.10 177.72 3f2v n LYS 96 N 8.83 0.77 0.27 2.90 4.01 -0.98 -3.52 118.16 130.43 3f2v n LYS 96 Ca 0.18 -2.02 0.11 0.00 -0.51 0.00 0.00 58.31 56.07 3f2v n LYS 96 Cb 0.50 -1.06 0.73 0.00 -0.51 0.00 0.00 35.03 34.69 3f2v n LYS 96 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 3f2v h ALA 97 N 0.12 1.61 -0.01 7.82 0.00 -1.44 -2.46 119.26 124.90 3f2v h ALA 97 Ca -0.01 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.84 3f2v h ALA 97 Cb 1.19 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.97 3f2v h ALA 97 CO 0.01 0.08 -0.22 1.28 0.00 0.00 0.00 179.25 180.39 3f2v n LEU 98 N -4.05 1.57 -4.64 0.00 4.77 -1.26 -4.85 117.00 108.53 3f2v n LEU 98 Ca -0.03 -0.81 -0.45 0.00 -0.03 0.00 0.00 56.01 54.70 3f2v n LEU 98 Cb 0.15 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.20 3f2v n LEU 98 CO 0.31 0.30 1.64 1.17 -1.33 0.00 0.00 177.39 179.49 3f2v n LYS 99 N 0.00 2.36 -0.64 3.23 0.00 -0.93 -0.80 118.16 121.39 3f2v n LYS 99 Ca 0.06 0.82 0.00 0.00 0.00 0.00 0.00 58.31 59.19 3f2v n LYS 99 Cb 0.29 -2.92 0.00 0.00 0.00 0.00 0.00 35.03 32.40 3f2v n LYS 99 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3f2v n GLY 100 N 4.91 1.55 3.74 3.14 0.00 0.01 -4.95 105.19 113.59 3f2v n GLY 100 Ca 0.24 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.86 3f2v n GLY 100 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3f2v s ARG 101 N -0.05 4.74 0.04 1.61 3.52 0.02 -4.47 118.95 124.36 3f2v s ARG 101 Ca 0.00 1.56 -0.30 0.00 -0.13 0.00 0.00 55.73 56.85 3f2v s ARG 101 Cb 0.00 -3.30 -0.05 0.00 -1.56 0.00 0.00 34.95 30.04 3f2v s ARG 101 CO 0.00 0.32 1.19 0.15 -0.81 0.00 0.00 175.30 176.14 3f2v s LYS 102 N -0.73 4.42 -0.05 5.12 1.02 -1.26 -0.18 119.74 128.08 3f2v s LYS 102 Ca 0.45 1.73 0.02 0.00 0.02 0.00 0.00 55.97 58.19 3f2v s LYS 102 Cb -0.27 -3.40 0.01 0.00 -0.52 0.00 0.00 37.83 33.66 3f2v s LYS 102 CO 0.33 -0.28 -0.10 0.42 -0.92 0.00 0.00 175.35 174.80 3f2v s ILE 103 N 1.28 0.91 0.13 2.17 1.01 -0.93 -0.29 121.20 125.48 3f2v s ILE 103 Ca 0.58 -0.37 -0.11 0.00 0.00 0.00 0.00 60.65 60.75 3f2v s ILE 103 Cb -0.28 -0.84 0.01 0.00 0.01 0.00 0.00 42.46 41.36 3f2v s ILE 103 CO 0.28 0.30 0.29 0.00 0.00 0.00 0.00 174.94 175.81 3f2v s ALA 104 N 0.59 -0.35 0.10 9.38 0.00 -0.84 -0.90 121.76 129.75 3f2v s ALA 104 Ca -0.11 -0.57 0.07 0.00 0.00 0.00 0.00 51.96 51.36 3f2v s ALA 104 Cb -0.14 0.69 -0.04 0.00 0.00 0.00 0.00 23.12 23.63 3f2v s ALA 104 CO 0.02 -0.61 -0.11 -0.51 0.00 0.00 0.00 175.76 174.55 3f2v s LEU 105 N -2.89 3.01 -0.27 0.00 1.43 -1.26 -1.49 118.68 117.21 3f2v s LEU 105 Ca 0.09 -0.39 -0.00 0.00 -1.03 0.00 0.00 54.13 52.80 3f2v s LEU 105 Cb 0.03 -1.81 0.08 0.00 0.03 0.00 0.00 46.19 44.52 3f2v s LEU 105 CO -0.07 0.19 0.03 0.00 0.23 0.00 0.00 176.35 176.73 3f2v s ALA 106 N -1.19 1.77 0.16 4.21 0.00 -0.27 -0.48 121.76 125.95 3f2v s ALA 106 Ca 0.21 -1.50 0.06 0.00 0.00 0.00 0.00 51.96 50.73 3f2v s ALA 106 Cb -0.11 -1.52 -0.04 0.00 0.00 0.00 0.00 23.12 21.44 3f2v s ALA 106 CO 0.13 -1.42 -0.13 0.14 0.00 0.00 0.00 175.76 174.48 3f2v s VAL 107 N 1.49 1.44 0.05 0.00 -7.23 0.08 -1.54 120.40 114.69 3f2v s VAL 107 Ca 0.03 -2.03 0.09 0.00 -1.81 0.00 0.00 61.98 58.26 3f2v s VAL 107 Cb -0.18 -1.84 -0.03 0.00 0.56 0.00 0.00 36.38 34.89 3f2v s VAL 107 CO -0.13 -0.60 -0.25 -0.94 -0.31 0.00 0.00 175.10 172.87 3f2v s SER 108 N -3.03 2.96 -0.02 4.85 1.04 -1.16 -1.90 113.70 116.44 3f2v s SER 108 Ca 0.17 -0.58 0.05 0.00 0.48 0.00 0.00 55.95 56.07 3f2v s SER 108 Cb -0.01 -0.26 -0.01 0.00 0.10 0.00 0.00 66.02 65.84 3f2v s SER 108 CO 0.04 0.22 -0.18 -0.76 0.98 0.00 0.00 173.24 173.54 3f2v s LEU 109 N -1.28 2.00 -0.18 2.42 1.02 0.18 -0.88 118.68 121.96 3f2v s LEU 109 Ca 0.11 -0.33 0.04 0.00 0.02 0.00 0.00 54.13 53.97 3f2v s LEU 109 Cb -0.10 -0.93 0.37 0.00 0.02 0.00 0.00 46.19 45.55 3f2v s LEU 109 CO 0.02 0.20 1.31 0.61 0.02 0.00 0.00 176.35 178.52 3f2v n GLY 110 N 2.79 2.81 3.02 -3.19 0.00 -1.26 -0.11 105.19 109.25 3f2v n GLY 110 Ca -0.16 -0.51 -0.09 0.00 0.00 0.00 0.00 46.02 45.27 3f2v n GLY 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3f2v s ALA 111 N -1.74 0.10 0.61 4.61 0.00 -1.26 -4.87 121.76 119.22 3f2v s ALA 111 Ca 0.28 -0.61 -0.19 0.00 0.00 0.00 0.00 51.96 51.43 3f2v s ALA 111 Cb 0.23 0.17 -0.02 0.00 0.00 0.00 0.00 23.12 23.49 3f2v s ALA 111 CO 0.07 -0.21 1.28 -1.25 0.00 0.00 0.00 175.76 175.65 3f2v s PRO 112 N -1.86 2.77 0.55 0.00 0.04 -1.26 -4.50 135.00 130.74 3f2v s PRO 112 Ca -0.12 2.03 0.22 0.00 0.04 0.00 0.00 61.00 63.17 3f2v s PRO 112 Cb -0.07 -1.94 1.52 0.00 0.04 0.00 0.00 34.50 34.05 3f2v s PRO 112 CO -0.02 -1.42 2.19 0.00 0.04 0.00 0.00 177.00 177.79 3f2v h ALA 113 N 0.80 1.80 0.00 8.56 0.00 -1.97 -0.77 119.26 127.69 3f2v h ALA 113 Ca -0.51 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.40 3f2v h ALA 113 Cb 1.32 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.11 3f2v h ALA 113 CO 0.54 -0.02 -0.00 0.00 0.00 0.00 0.00 179.25 179.77 3f2v h ALA 114 N 1.99 1.02 -0.02 0.00 0.00 -2.01 -2.35 119.26 117.89 3f2v h ALA 114 Ca 0.01 -0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.71 3f2v h ALA 114 Cb 0.03 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 3f2v h ALA 114 CO -0.00 0.00 -0.86 -0.44 0.00 0.00 0.00 179.25 177.95 3f2v h ASP 115 N 0.00 0.43 -0.80 0.00 5.19 -1.49 -3.37 116.42 116.38 3f2v h ASP 115 Ca -0.00 -0.33 -0.73 0.00 -0.62 0.00 0.00 57.03 55.35 3f2v h ASP 115 Cb 0.14 -0.13 -0.09 0.00 0.18 0.00 0.00 39.33 39.43 3f2v h ASP 115 CO 0.00 1.11 2.70 -1.22 -3.12 0.00 0.00 179.24 178.71 3f2v n TYR 116 N -3.75 2.83 -3.71 4.55 4.02 -0.88 -1.12 117.16 119.09 3f2v n TYR 116 Ca -0.05 -2.89 -0.10 0.00 -0.01 0.00 0.00 57.90 54.85 3f2v n TYR 116 Cb 0.79 -2.12 -0.05 0.00 -0.02 0.00 0.00 39.34 37.93 3f2v n TYR 116 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 3f2v s ARG 117 N 0.74 1.07 0.43 -0.72 0.52 -1.17 -4.03 118.95 115.79 3f2v s ARG 117 Ca 0.51 -0.81 0.13 0.00 -0.52 0.00 0.00 55.73 55.04 3f2v s ARG 117 Cb 0.15 0.44 1.01 0.00 0.52 0.00 0.00 34.95 37.07 3f2v s ARG 117 CO -0.05 -0.41 2.00 0.00 0.02 0.00 0.00 175.30 176.85 3f2v h ALA 118 N 2.43 1.97 -0.54 2.13 0.00 -1.88 0.16 119.26 123.53 3f2v h ALA 118 Ca -0.33 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.56 3f2v h ALA 118 Cb 1.24 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.94 3f2v h ALA 118 CO 0.48 -0.09 0.00 -0.40 0.00 0.00 0.00 179.25 179.24 3f2v n ASP 119 N -4.47 4.49 -4.81 0.00 5.68 -1.26 -4.71 116.55 111.46 3f2v n ASP 119 Ca 0.08 -2.52 -0.24 0.00 -0.50 0.00 0.00 54.79 51.61 3f2v n ASP 119 Cb 0.32 -0.58 -0.05 0.00 -1.14 0.00 0.00 41.12 39.67 3f2v n ASP 119 CO 0.00 0.00 0.00 -0.83 -1.33 0.00 0.00 177.20 175.04 3f2v s GLY 120 N -0.78 2.28 0.29 6.12 0.00 0.53 -5.02 107.32 110.74 3f2v s GLY 120 Ca 0.45 -1.88 0.00 0.00 0.00 0.00 0.00 44.72 43.29 3f2v s GLY 120 CO 0.19 -1.84 1.88 0.00 0.00 0.00 0.00 173.10 173.33 3f2v h ALA 121 N 1.18 1.49 -0.07 3.20 0.00 -1.75 -2.54 119.26 120.76 3f2v h ALA 121 Ca -0.41 -0.01 -0.21 0.00 0.00 0.00 0.00 54.91 54.27 3f2v h ALA 121 Cb 1.27 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.79 3f2v h ALA 121 CO 0.63 0.34 -0.82 0.28 0.00 0.00 0.00 179.25 179.69 3f2v h VAL 122 N 1.07 1.35 0.00 0.00 2.07 -1.39 -3.47 116.25 115.87 3f2v h VAL 122 Ca 0.43 -2.17 0.00 0.00 0.82 0.00 0.00 66.70 65.78 3f2v h VAL 122 Cb 0.27 2.17 0.00 0.00 -1.52 0.00 0.00 31.29 32.21 3f2v h VAL 122 CO -0.18 0.66 0.00 0.61 0.02 0.00 0.00 177.57 178.68 3f2v n GLY 123 N 0.72 2.28 3.27 2.17 0.00 -0.96 -4.96 105.19 107.71 3f2v n GLY 123 Ca -0.06 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.77 3f2v n GLY 123 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3f2v s SER 125 N -2.56 5.16 0.29 0.00 1.04 -1.26 -3.04 113.70 113.34 3f2v s SER 125 Ca 0.11 0.74 0.01 0.00 0.48 0.00 0.00 55.95 57.28 3f2v s SER 125 Cb -0.05 -1.51 0.45 0.00 0.10 0.00 0.00 66.02 65.01 3f2v s SER 125 CO 0.04 -1.41 1.81 0.58 0.98 0.00 0.00 173.24 175.24 3f2v h VAL 126 N -0.54 1.22 -0.81 5.02 2.07 -1.97 -2.27 116.25 118.97 3f2v h VAL 126 Ca -0.45 -0.89 -0.01 0.00 0.82 0.00 0.00 66.70 66.17 3f2v h VAL 126 Cb 1.28 0.87 -0.04 0.00 -1.52 0.00 0.00 31.29 31.88 3f2v h VAL 126 CO 0.62 0.31 0.45 0.00 0.02 0.00 0.00 177.57 178.97 3f2v h ALA 127 N 1.37 1.03 -0.17 1.67 0.00 -1.96 -0.49 119.26 120.71 3f2v h ALA 127 Ca 0.14 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 3f2v h ALA 127 Cb 0.38 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 3f2v h ALA 127 CO 0.01 0.54 -0.24 0.93 0.00 0.00 0.00 179.25 180.49 3f2v h GLU 128 N 1.12 0.31 -0.22 0.00 5.08 -1.83 -2.21 114.58 116.82 3f2v h GLU 128 Ca 0.29 -0.10 -0.06 0.00 -1.00 0.00 0.00 59.36 58.48 3f2v h GLU 128 Cb 0.02 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 3f2v h GLU 128 CO -0.05 0.54 -0.09 0.28 -1.00 0.00 0.00 179.01 178.68 3f2v h VAL 129 N 0.28 1.30 -0.00 3.13 2.07 -0.78 -3.13 116.25 119.12 3f2v h VAL 129 Ca 0.04 -1.15 0.00 0.00 0.82 0.00 0.00 66.70 66.42 3f2v h VAL 129 Cb 0.58 1.60 0.00 0.00 -1.52 0.00 0.00 31.29 31.95 3f2v h VAL 129 CO 0.04 0.35 -0.00 0.18 0.02 0.00 0.00 177.57 178.16 3f2v n LEU 130 N -4.55 0.06 -0.32 2.57 4.77 -0.27 -4.33 117.00 114.92 3f2v n LEU 130 Ca -0.05 0.01 0.20 0.00 -0.03 0.00 0.00 56.01 56.14 3f2v n LEU 130 Cb 0.32 -0.02 0.40 0.00 -2.33 0.00 0.00 43.42 41.79 3f2v n LEU 130 CO 0.39 0.01 1.01 -0.09 -1.33 0.00 0.00 177.39 177.39 3f2v h ARG 131 N 0.09 0.21 -0.95 3.23 9.65 -1.35 -0.46 114.38 124.80 3f2v h ARG 131 Ca 0.00 -0.01 0.13 0.00 -1.10 0.00 0.00 59.98 58.99 3f2v h ARG 131 Cb 0.04 -0.05 -0.08 0.00 -1.39 0.00 0.00 29.97 28.50 3f2v h ARG 131 CO 0.00 0.14 0.61 -1.35 2.80 0.00 0.00 179.97 182.16 3f2v h PRO 132 N 0.21 0.85 0.05 0.20 0.11 -1.85 0.10 132.00 131.67 3f2v h PRO 132 Ca 0.66 -0.05 -0.23 0.00 0.11 0.00 0.00 66.00 66.50 3f2v h PRO 132 Cb 1.48 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 32.39 3f2v h PRO 132 CO -0.67 0.56 -1.04 0.74 -0.21 0.00 0.00 178.00 177.37 3f2v h PHE 133 N 0.88 0.27 -0.30 0.65 -1.00 -1.43 -1.81 116.94 114.20 3f2v h PHE 133 Ca 0.47 -0.18 -0.05 0.00 2.81 0.00 0.00 57.97 61.03 3f2v h PHE 133 Cb 0.57 -0.02 -0.01 0.00 3.61 0.00 0.00 35.95 40.10 3f2v h PHE 133 CO -0.00 1.09 0.01 1.49 -1.61 0.00 0.00 178.31 179.29 3f2v h GLU 134 N 0.06 0.52 -0.72 1.51 4.81 -1.08 -1.20 114.58 118.48 3f2v h GLU 134 Ca -0.07 -0.16 -0.05 0.00 -0.13 0.00 0.00 59.36 58.95 3f2v h GLU 134 Cb 1.75 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 31.05 3f2v h GLU 134 CO 0.16 0.66 0.24 -0.07 -0.73 0.00 0.00 179.01 179.26 3f2v h LEU 135 N 0.31 1.02 0.34 1.64 3.38 -0.83 -0.39 115.31 120.79 3f2v h LEU 135 Ca 0.08 -0.18 -0.02 0.00 0.09 0.00 0.00 57.88 57.86 3f2v h LEU 135 Cb 0.42 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.91 3f2v h LEU 135 CO 0.01 0.94 -0.16 0.74 0.09 0.00 0.00 178.44 180.06 3f2v h THR 136 N 1.06 0.67 -0.29 0.22 2.02 -1.11 0.97 112.91 116.45 3f2v h THR 136 Ca 0.23 -0.03 0.01 0.00 0.77 0.00 0.00 66.41 67.40 3f2v h THR 136 Cb 0.28 0.68 -0.02 0.00 -1.74 0.00 0.00 68.15 67.35 3f2v h THR 136 CO -0.01 0.01 0.17 0.00 0.37 0.00 0.00 175.52 176.05 3f2v h ALA 137 N 0.19 0.36 -0.55 6.16 0.00 -1.05 -2.56 119.26 121.81 3f2v h ALA 137 Ca -0.05 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 3f2v h ALA 137 Cb 0.36 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 3f2v h ALA 137 CO 0.08 -0.21 0.16 0.87 0.00 0.00 0.00 179.25 180.15 3f2v h LYS 138 N 0.34 0.82 -0.46 0.00 1.57 -0.96 -1.72 116.57 116.18 3f2v h LYS 138 Ca 0.12 -0.15 0.03 0.00 -1.87 0.00 0.00 60.65 58.77 3f2v h LYS 138 Cb 0.00 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.16 3f2v h LYS 138 CO -0.06 0.72 0.30 -0.92 -0.57 0.00 0.00 179.45 178.93 3f2v h TYR 139 N 0.80 0.48 -0.34 -1.35 3.20 -0.40 0.14 116.97 119.49 3f2v h TYR 139 Ca 0.18 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.06 3f2v h TYR 139 Cb 0.25 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 38.36 3f2v h TYR 139 CO 0.01 0.28 0.00 0.00 -1.64 0.00 0.00 178.16 176.82 3f2v n ASN 141 N 0.48 -5.97 -4.94 0.00 5.03 0.48 -3.56 115.26 106.78 3f2v n ASN 141 Ca 0.13 -0.31 -0.25 0.00 0.87 0.00 0.00 54.58 55.02 3f2v n ASN 141 Cb 0.46 -4.76 0.04 0.00 -1.02 0.00 0.00 39.78 34.50 3f2v n ASN 141 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3f2v s ALA 142 N -3.17 3.42 -0.98 5.41 0.00 -0.72 -0.81 121.76 124.91 3f2v s ALA 142 Ca 0.33 -0.95 -0.13 0.00 0.00 0.00 0.00 51.96 51.22 3f2v s ALA 142 Cb -0.14 -2.45 0.23 0.00 0.00 0.00 0.00 23.12 20.76 3f2v s ALA 142 CO 0.41 -0.93 0.98 0.34 0.00 0.00 0.00 175.76 176.56 3f2v s ASP 143 N -4.40 6.99 0.00 0.00 2.15 0.75 -4.64 116.67 117.53 3f2v s ASP 143 Ca 0.56 -3.01 -0.30 0.00 0.43 0.00 0.00 52.55 50.23 3f2v s ASP 143 Cb -0.11 -2.24 -0.07 0.00 -0.30 0.00 0.00 42.92 40.21 3f2v s ASP 143 CO 0.43 -0.52 1.64 -0.47 -0.17 0.00 0.00 175.17 176.08 3f2v s TYR 144 N -0.06 2.20 0.24 -5.34 5.04 -1.26 -2.19 117.35 115.98 3f2v s TYR 144 Ca 0.26 0.27 0.07 0.00 -2.44 0.00 0.00 57.07 55.23 3f2v s TYR 144 Cb -0.09 -3.92 -0.04 0.00 0.35 0.00 0.00 41.96 38.26 3f2v s TYR 144 CO -0.08 -3.80 0.17 1.03 -1.34 0.00 0.00 175.55 171.52 3f2v s ARG 145 N 3.37 2.85 0.30 4.97 1.81 -0.08 -4.93 118.95 127.23 3f2v s ARG 145 Ca 0.73 -1.08 -0.29 0.00 -1.72 0.00 0.00 55.73 53.38 3f2v s ARG 145 Cb -0.36 -2.53 -0.13 0.00 -0.45 0.00 0.00 34.95 31.49 3f2v s ARG 145 CO 0.31 0.41 1.35 -2.30 -0.68 0.00 0.00 175.30 174.38 3f2v n PRO 146 N -1.05 2.12 -1.63 3.54 -0.02 -1.26 -4.61 135.00 132.08 3f2v n PRO 146 Ca -0.08 0.75 -0.31 0.00 -2.02 0.00 0.00 63.50 61.84 3f2v n PRO 146 Cb 0.58 -2.37 0.06 0.00 -0.02 0.00 0.00 33.50 31.75 3f2v n PRO 146 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 3f2v s PRO 147 N -1.24 2.71 -0.23 0.52 0.04 -1.26 -4.72 135.00 130.81 3f2v s PRO 147 Ca 0.61 0.77 -0.09 0.00 0.04 0.00 0.00 61.00 62.33 3f2v s PRO 147 Cb -0.60 -1.98 -0.04 0.00 0.04 0.00 0.00 34.50 31.92 3f2v s PRO 147 CO 0.57 -1.21 0.12 0.12 0.04 0.00 0.00 177.00 176.63 3f2v s PHE 148 N -3.13 3.23 0.13 0.56 2.19 0.36 -4.98 117.98 116.34 3f2v s PHE 148 Ca 0.59 0.03 0.07 0.00 0.33 0.00 0.00 56.93 57.95 3f2v s PHE 148 Cb -0.13 -2.23 -0.04 0.00 -1.31 0.00 0.00 43.02 39.30 3f2v s PHE 148 CO 0.54 -0.04 -0.16 0.95 1.83 0.00 0.00 175.22 178.34 3f2v s THR 149 N 1.13 1.53 -0.16 0.12 -4.23 -1.26 -0.74 115.64 112.02 3f2v s THR 149 Ca 0.06 -1.72 -0.08 0.00 -1.18 0.00 0.00 61.69 58.78 3f2v s THR 149 Cb -0.14 -1.59 0.06 0.00 1.34 0.00 0.00 72.50 72.17 3f2v s THR 149 CO 0.04 -0.31 0.36 0.12 -0.54 0.00 0.00 174.62 174.30 3f2v s PHE 150 N -1.88 -0.55 -0.23 3.99 5.36 -0.80 -4.98 117.98 118.89 3f2v s PHE 150 Ca 0.10 1.18 -0.09 0.00 -0.96 0.00 0.00 56.93 57.15 3f2v s PHE 150 Cb -0.06 0.20 -0.05 0.00 -0.34 0.00 0.00 43.02 42.77 3f2v s PHE 150 CO 0.04 -0.33 0.13 -1.01 -1.46 0.00 0.00 175.22 172.58 3f2v s HIS 151 N 1.58 3.27 0.45 10.12 3.76 -1.26 -0.65 115.29 132.56 3f2v s HIS 151 Ca -0.08 0.10 -0.08 0.00 -0.15 0.00 0.00 55.06 54.86 3f2v s HIS 151 Cb -0.10 -2.23 -0.05 0.00 1.11 0.00 0.00 32.58 31.32 3f2v s HIS 151 CO -0.11 0.02 0.78 0.99 -0.85 0.00 0.00 174.74 175.57 3f2v s THR 152 N 1.00 4.85 0.00 1.30 2.01 0.85 -4.95 115.64 120.70 3f2v s THR 152 Ca 0.06 0.42 0.00 0.00 0.31 0.00 0.00 61.69 62.48 3f2v s THR 152 Cb -0.14 -3.80 0.00 0.00 0.01 0.00 0.00 72.50 68.57 3f2v s THR 152 CO 0.04 -0.70 0.11 -1.20 -0.69 0.00 0.00 174.62 172.18 3f2v n SER 160 N -1.81 0.22 0.10 3.53 7.64 -1.26 -4.20 113.62 117.85 3f2v n SER 160 Ca 0.02 -0.98 -0.13 0.00 1.01 0.00 0.00 58.87 58.78 3f2v n SER 160 Cb 0.54 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.67 3f2v n SER 160 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 3f2v h GLU 161 N 0.00 -0.21 -0.53 1.43 4.57 -2.05 0.67 114.58 118.46 3f2v h GLU 161 Ca 0.00 0.01 -0.07 0.00 -1.18 0.00 0.00 59.36 58.12 3f2v h GLU 161 Cb 0.38 0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 28.99 3f2v h GLU 161 CO 0.00 0.01 0.03 0.00 -1.18 0.00 0.00 179.01 177.87 3f2v h ALA 162 N 0.41 1.06 -0.69 2.92 0.00 -2.06 -1.84 119.26 119.05 3f2v h ALA 162 Ca -0.02 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.57 3f2v h ALA 162 Cb 0.31 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 3f2v h ALA 162 CO 0.04 0.59 0.23 0.00 0.00 0.00 0.00 179.25 180.11 3f2v h ALA 163 N 1.21 0.91 -0.71 0.00 0.00 -1.95 -1.75 119.26 116.97 3f2v h ALA 163 Ca 0.16 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 3f2v h ALA 163 Cb 0.44 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 3f2v h ALA 163 CO 0.02 0.58 0.23 -0.09 0.00 0.00 0.00 179.25 179.99 3f2v h ARG 164 N 1.01 1.09 -0.51 0.00 2.43 0.76 -2.22 114.38 116.94 3f2v h ARG 164 Ca 0.23 -0.22 -0.08 0.00 -0.81 0.00 0.00 59.98 59.10 3f2v h ARG 164 Cb 0.29 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.65 3f2v h ARG 164 CO -0.01 0.92 0.00 1.96 -1.51 0.00 0.00 179.97 181.33 3f2v h GLN 165 N 1.05 0.86 -0.67 0.20 4.20 -0.95 -1.86 115.11 117.95 3f2v h GLN 165 Ca 0.23 -0.24 -0.06 0.00 0.06 0.00 0.00 58.65 58.65 3f2v h GLN 165 Cb 0.28 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 27.94 3f2v h GLN 165 CO -0.01 0.86 0.20 1.49 -0.67 0.00 0.00 178.83 180.70 3f2v h GLU 166 N 0.80 1.05 -0.74 1.46 4.57 -0.80 -0.29 114.58 120.62 3f2v h GLU 166 Ca 0.15 -0.23 -0.05 0.00 -1.18 0.00 0.00 59.36 58.05 3f2v h GLU 166 Cb 0.47 -0.15 -0.03 0.00 -0.16 0.00 0.00 28.75 28.88 3f2v h GLU 166 CO 0.02 0.92 0.26 0.28 -1.18 0.00 0.00 179.01 179.30 3f2v h VAL 167 N 0.98 1.26 -0.74 0.32 2.07 -1.15 0.72 116.25 119.71 3f2v h VAL 167 Ca 0.21 -0.86 -0.05 0.00 0.82 0.00 0.00 66.70 66.83 3f2v h VAL 167 Cb 0.31 0.41 -0.03 0.00 -1.52 0.00 0.00 31.29 30.46 3f2v h VAL 167 CO -0.00 0.34 0.27 -0.33 0.02 0.00 0.00 177.57 177.87 3f2v h GLU 168 N 1.09 1.11 -0.62 1.57 5.08 -0.90 -1.14 114.58 120.76 3f2v h GLU 168 Ca 0.24 -0.20 -0.07 0.00 -1.00 0.00 0.00 59.36 58.33 3f2v h GLU 168 Cb 0.26 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 3f2v h GLU 168 CO -0.01 0.91 0.11 0.00 -1.00 0.00 0.00 179.01 179.02 3f2v h ARG 169 N 1.07 1.03 -0.71 2.33 3.08 -0.32 -2.31 114.38 118.56 3f2v h ARG 169 Ca 0.24 -0.27 -0.02 0.00 0.07 0.00 0.00 59.98 60.00 3f2v h ARG 169 Cb 0.23 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.13 3f2v h ARG 169 CO -0.02 0.95 0.35 0.66 -1.07 0.00 0.00 179.97 180.85 3f2v h SER 170 N 0.94 0.90 -0.71 7.04 4.64 -0.23 0.38 113.55 126.51 3f2v h SER 170 Ca 0.19 -0.09 -0.03 0.00 -0.47 0.00 0.00 61.79 61.39 3f2v h SER 170 Cb 0.41 -0.23 -0.03 0.00 -0.31 0.00 0.00 62.40 62.24 3f2v h SER 170 CO 0.01 0.75 0.32 0.00 -0.87 0.00 0.00 176.83 177.04 3f2v h ALA 171 N 1.39 0.92 -0.54 5.18 0.00 -0.88 0.15 119.26 125.49 3f2v h ALA 171 Ca 0.25 -0.16 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 3f2v h ALA 171 Cb 0.08 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 3f2v h ALA 171 CO -0.03 0.51 0.01 0.00 0.00 0.00 0.00 179.25 179.74 3f2v h ARG 172 N 1.00 0.94 -0.64 0.00 3.08 -0.79 -2.38 114.38 115.58 3f2v h ARG 172 Ca 0.24 -0.29 -0.04 0.00 0.07 0.00 0.00 59.98 59.96 3f2v h ARG 172 Cb 0.16 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.09 3f2v h ARG 172 CO -0.03 0.95 0.23 -0.44 -1.07 0.00 0.00 179.97 179.61 3f2v h ASP 173 N 0.82 0.88 -0.56 7.04 3.32 -0.41 -2.20 116.42 125.30 3f2v h ASP 173 Ca 0.15 -0.13 0.03 0.00 0.02 0.00 0.00 57.03 57.10 3f2v h ASP 173 Cb 0.52 -0.23 -0.04 0.00 0.22 0.00 0.00 39.33 39.80 3f2v h ASP 173 CO 0.03 0.80 0.33 0.22 -1.72 0.00 0.00 179.24 178.90 3f2v h TYR 174 N 0.93 0.61 -0.40 4.55 -0.00 -0.42 0.28 116.97 122.52 3f2v h TYR 174 Ca 0.21 0.02 0.00 0.00 -0.00 0.00 0.00 58.73 58.97 3f2v h TYR 174 Cb 0.22 -0.19 -0.02 0.00 -0.00 0.00 0.00 36.73 36.74 3f2v h TYR 174 CO 0.02 0.33 0.26 -0.07 -0.00 0.00 0.00 178.16 178.70 3f2v h LEU 175 N 0.64 0.45 -0.61 2.82 3.38 -0.99 0.19 115.31 121.19 3f2v h LEU 175 Ca 0.23 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.17 3f2v h LEU 175 Cb 0.06 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.67 3f2v h LEU 175 CO -0.12 0.33 0.32 0.00 0.09 0.00 0.00 178.44 179.06 3f2v h ALA 176 N 1.15 0.78 -0.76 1.53 0.00 -0.78 0.30 119.26 121.46 3f2v h ALA 176 Ca 0.15 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 3f2v h ALA 176 Cb -0.06 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.45 3f2v h ALA 176 CO -0.03 0.31 0.45 2.35 0.00 0.00 0.00 179.25 182.33 3f2v h TRP 177 N 0.82 1.02 -0.18 0.00 7.01 0.00 -0.73 115.95 123.90 3f2v h TRP 177 Ca 0.21 -0.01 -0.00 0.00 2.11 0.00 0.00 58.89 61.20 3f2v h TRP 177 Cb 0.07 -0.33 -0.01 0.00 -2.10 0.00 0.00 29.16 26.79 3f2v h TRP 177 CO -0.01 0.69 0.11 -0.07 -2.79 0.00 0.00 178.44 176.37 3f2v h LEU 178 N 1.05 0.22 -0.69 0.65 4.07 0.00 -1.07 115.31 119.54 3f2v h LEU 178 Ca 0.27 -0.06 -0.00 0.00 0.08 0.00 0.00 57.88 58.17 3f2v h LEU 178 Cb -0.02 -0.06 -0.03 0.00 1.08 0.00 0.00 40.66 41.63 3f2v h LEU 178 CO -0.05 0.22 0.41 0.44 -1.08 0.00 0.00 178.44 178.38 3f2v h ASP 179 N 0.20 0.82 -0.62 -0.43 3.32 -0.64 -2.09 116.42 116.98 3f2v h ASP 179 Ca 0.06 -0.06 0.04 0.00 0.02 0.00 0.00 57.03 57.10 3f2v h ASP 179 Cb 0.04 -0.21 -0.05 0.00 0.22 0.00 0.00 39.33 39.34 3f2v h ASP 179 CO -0.01 0.64 0.36 0.00 -1.72 0.00 0.00 179.24 178.51 3f2v h ALA 180 N 1.22 0.82 -0.97 3.45 0.00 -0.85 -1.17 119.26 121.77 3f2v h ALA 180 Ca 0.25 0.00 0.07 0.00 0.00 0.00 0.00 54.91 55.23 3f2v h ALA 180 Cb -0.03 -0.14 -0.07 0.00 0.00 0.00 0.00 17.79 17.55 3f2v h ALA 180 CO -0.05 0.06 0.62 1.25 0.00 0.00 0.00 179.25 181.13 3f2v h LEU 181 N 0.68 0.99 0.00 0.00 5.85 -0.74 -3.51 115.31 118.58 3f2v h LEU 181 Ca 0.27 0.01 0.00 0.00 0.84 0.00 0.00 57.88 59.00 3f2v h LEU 181 Cb 0.11 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 40.95 3f2v h LEU 181 CO -0.15 0.62 0.00 0.00 -0.34 0.00 0.00 178.44 178.58