#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v3f n SER 2 N 0.00 -2.77 -3.53 1.61 2.88 -1.26 -5.14 113.62 105.42 1v3f n SER 2 Ca 0.00 0.60 -0.17 0.00 -1.33 0.00 0.00 58.87 57.97 1v3f n SER 2 Cb 0.00 2.74 -0.06 0.00 -0.75 0.00 0.00 64.21 66.14 1v3f n SER 2 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1v3f s SER 3 N -2.00 -0.61 0.00 -3.46 0.15 -1.26 -4.98 113.70 101.54 1v3f s SER 3 Ca 0.00 0.66 0.00 0.00 0.70 0.00 0.00 55.95 57.31 1v3f s SER 3 Cb 0.00 0.50 0.00 0.00 -1.71 0.00 0.00 66.02 64.81 1v3f s SER 3 CO 0.00 -0.57 0.00 0.61 1.20 0.00 0.00 173.24 174.48 1v3f n GLY 4 N 0.86 1.28 2.79 9.45 0.00 -1.26 -4.69 105.19 113.61 1v3f n GLY 4 Ca -0.18 -0.77 -0.38 0.00 0.00 0.00 0.00 46.02 44.69 1v3f n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1v3f n SER 5 N 0.65 7.37 -2.38 1.61 3.41 -1.26 -4.79 113.62 118.22 1v3f n SER 5 Ca 0.00 -3.69 -0.20 0.00 -0.26 0.00 0.00 58.87 54.72 1v3f n SER 5 Cb 0.00 -1.12 -0.13 0.00 -0.26 0.00 0.00 64.21 62.70 1v3f n SER 5 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1v3f n SER 6 N -0.15 6.23 0.04 4.04 2.88 -1.26 -3.69 113.62 121.70 1v3f n SER 6 Ca 0.52 -2.56 0.00 0.00 -1.33 0.00 0.00 58.87 55.51 1v3f n SER 6 Cb 0.28 -1.44 0.00 0.00 -0.75 0.00 0.00 64.21 62.30 1v3f n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1v3f n GLY 7 N 2.66 -0.93 0.50 0.46 0.00 -1.26 -4.94 105.19 101.67 1v3f n GLY 7 Ca 0.53 0.31 0.42 0.00 0.00 0.00 0.00 46.02 47.27 1v3f n GLY 7 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1v3f n LEU 8 N -2.68 0.19 -0.09 0.99 4.77 -1.24 0.19 117.00 119.13 1v3f n LEU 8 Ca 0.00 1.35 -0.06 0.00 -0.03 0.00 0.00 56.01 57.27 1v3f n LEU 8 Cb 0.00 -0.67 0.00 0.00 -2.33 0.00 0.00 43.42 40.43 1v3f n LEU 8 CO 0.00 -1.46 0.76 -0.74 -1.33 0.00 0.00 177.39 174.62 1v3f h HIS 9 N 0.00 -0.34 0.00 -1.77 2.76 -1.93 0.73 115.15 114.60 1v3f h HIS 9 Ca 0.89 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 59.09 1v3f h HIS 9 Cb 2.94 0.20 -0.00 0.00 1.55 0.00 0.00 27.41 32.10 1v3f h HIS 9 CO -0.01 -0.21 -0.04 0.07 -1.30 0.00 0.00 177.93 176.44 1v3f h ARG 10 N -0.08 0.00 0.15 5.26 -0.00 0.17 -0.69 114.38 119.19 1v3f h ARG 10 Ca 0.17 0.00 -0.21 0.00 -0.00 0.00 0.00 59.98 59.94 1v3f h ARG 10 Cb 0.34 0.00 0.02 0.00 -0.00 0.00 0.00 29.97 30.33 1v3f h ARG 10 CO -0.39 0.04 -0.92 0.82 -0.00 0.00 0.00 179.97 179.53 1v3f h ILE 11 N 0.00 1.47 -0.33 0.08 2.04 0.30 -3.00 117.51 118.07 1v3f h ILE 11 Ca -0.00 -2.54 -0.01 0.00 1.00 0.00 0.00 64.86 63.31 1v3f h ILE 11 Cb 0.21 3.14 -0.02 0.00 -0.74 0.00 0.00 36.82 39.42 1v3f h ILE 11 CO 0.00 0.73 0.18 0.58 0.00 0.00 0.00 178.15 179.64 1v3f h VAL 12 N -0.26 1.13 -0.45 1.67 2.07 0.91 -0.78 116.25 120.54 1v3f h VAL 12 Ca -0.16 -0.35 0.09 0.00 0.82 0.00 0.00 66.70 67.10 1v3f h VAL 12 Cb 1.72 0.77 -0.07 0.00 -1.52 0.00 0.00 31.29 32.18 1v3f h VAL 12 CO 0.17 0.14 -0.00 0.44 0.02 0.00 0.00 177.57 178.33 1v3f h ASP 13 N 0.41 -0.20 -0.22 0.57 3.32 -1.25 0.85 116.42 119.90 1v3f h ASP 13 Ca 0.12 0.11 0.03 0.00 0.02 0.00 0.00 57.03 57.30 1v3f h ASP 13 Cb 0.06 0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.77 1v3f h ASP 13 CO -0.02 -0.06 0.05 0.50 -1.72 0.00 0.00 179.24 177.99 1v3f h LYS 14 N 0.11 0.13 -0.08 3.56 3.64 -1.30 -1.05 116.57 121.57 1v3f h LYS 14 Ca 0.23 -0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.57 1v3f h LYS 14 Cb 0.33 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.11 1v3f h LYS 14 CO -0.38 0.09 -0.08 0.52 -2.27 0.00 0.00 179.45 177.33 1v3f h MET 15 N 0.14 0.12 0.00 1.90 2.86 0.33 -0.42 114.93 119.85 1v3f h MET 15 Ca 0.10 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.72 1v3f h MET 15 Cb 0.09 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.73 1v3f h MET 15 CO -0.13 0.21 0.00 0.45 1.06 0.00 0.00 176.91 178.50 1v3f h HIS 16 N 0.12 0.00 -3.29 -0.22 3.86 0.20 -3.33 115.15 112.49 1v3f h HIS 16 Ca 0.03 0.00 -0.51 0.00 -1.16 0.00 0.00 60.37 58.73 1v3f h HIS 16 Cb 0.22 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.69 1v3f h HIS 16 CO 0.00 0.00 -0.07 0.34 0.86 0.00 0.00 177.93 179.06 1v3f s ASP 17 N -5.09 6.43 -0.01 2.45 -1.08 -0.17 -5.00 116.67 114.21 1v3f s ASP 17 Ca -0.04 0.79 0.12 0.00 -0.52 0.00 0.00 52.55 52.90 1v3f s ASP 17 Cb 0.12 -2.18 -0.16 0.00 -1.46 0.00 0.00 42.92 39.24 1v3f s ASP 17 CO 0.40 -0.27 0.36 1.07 0.52 0.00 0.00 175.17 177.25 1v3f n THR 18 N -1.19 0.00 0.00 1.71 5.66 -1.26 -2.79 114.28 116.41 1v3f n THR 18 Ca -0.01 -0.25 0.00 0.00 -3.05 0.00 0.00 64.05 60.74 1v3f n THR 18 Cb 0.54 0.55 0.00 0.00 -1.55 0.00 0.00 70.33 69.87 1v3f n THR 18 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 1v3f n SER 19 N -1.65 0.00 0.01 1.09 7.64 -1.26 -4.45 113.62 115.00 1v3f n SER 19 Ca -0.00 0.42 0.11 0.00 1.01 0.00 0.00 58.87 60.41 1v3f n SER 19 Cb 0.26 -0.38 0.11 0.00 -1.01 0.00 0.00 64.21 63.19 1v3f n SER 19 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1v3f n THR 20 N -1.64 0.06 0.00 0.44 -2.24 -1.26 -4.90 114.28 104.73 1v3f n THR 20 Ca 0.00 -0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.71 1v3f n THR 20 Cb 0.00 0.38 0.00 0.00 -2.10 0.00 0.00 70.33 68.61 1v3f n THR 20 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1v3f n GLY 21 N 1.46 0.15 3.65 3.38 0.00 -1.22 -4.94 105.19 107.67 1v3f n GLY 21 Ca 0.04 -1.53 -0.23 0.00 0.00 0.00 0.00 46.02 44.29 1v3f n GLY 21 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1v3f n ILE 22 N -0.01 0.00 -3.33 -0.61 3.06 -1.12 -4.82 119.36 112.53 1v3f n ILE 22 Ca 0.00 -1.32 -0.13 0.00 -2.50 0.00 0.00 62.75 58.80 1v3f n ILE 22 Cb 0.00 -1.10 -0.06 0.00 0.54 0.00 0.00 39.64 39.02 1v3f n ILE 22 CO 0.00 0.00 0.00 -0.13 -2.50 0.00 0.00 176.55 173.92 1v3f s ARG 23 N -5.18 0.62 -1.09 9.51 0.52 -1.26 -4.36 118.95 117.71 1v3f s ARG 23 Ca 0.65 -0.59 -0.07 0.00 -0.52 0.00 0.00 55.73 55.20 1v3f s ARG 23 Cb -0.03 -0.53 -0.08 0.00 0.52 0.00 0.00 34.95 34.82 1v3f s ARG 23 CO 0.44 -1.16 2.52 -0.35 0.02 0.00 0.00 175.30 176.76 1v3f n PRO 24 N 4.49 2.64 -0.75 3.54 -0.04 -1.26 -4.79 135.00 138.83 1v3f n PRO 24 Ca 0.09 -1.66 -0.30 0.00 -0.04 0.00 0.00 63.50 61.59 1v3f n PRO 24 Cb 0.48 -2.52 0.18 0.00 -0.04 0.00 0.00 33.50 31.60 1v3f n PRO 24 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1v3f s SER 25 N 2.81 2.62 -0.07 3.54 1.04 -1.26 -2.73 113.70 119.65 1v3f s SER 25 Ca 0.52 1.94 -0.18 0.00 0.48 0.00 0.00 55.95 58.72 1v3f s SER 25 Cb 0.15 -2.47 -0.13 0.00 0.10 0.00 0.00 66.02 63.66 1v3f s SER 25 CO -0.04 -3.25 0.67 1.55 0.98 0.00 0.00 173.24 173.15 1v3f h PRO 26 N -1.97 -0.18 -6.48 4.02 0.13 -1.83 -3.38 132.00 122.31 1v3f h PRO 26 Ca -0.48 0.01 -0.30 0.00 -0.87 0.00 0.00 66.00 64.36 1v3f h PRO 26 Cb 1.28 0.04 0.02 0.00 0.13 0.00 0.00 31.00 32.47 1v3f h PRO 26 CO 0.45 0.22 -1.16 0.09 -0.23 0.00 0.00 178.00 177.38 1v3f n ASN 27 N -4.88 -5.79 -4.05 1.44 4.13 -1.26 -4.45 115.26 100.40 1v3f n ASN 27 Ca -0.07 -0.02 -0.57 0.00 1.68 0.00 0.00 54.58 55.60 1v3f n ASN 27 Cb 0.24 -1.76 -0.11 0.00 -1.54 0.00 0.00 39.78 36.61 1v3f n ASN 27 CO 0.00 0.00 0.00 0.23 0.28 0.00 0.00 177.26 177.77 1v3f n MET 28 N 0.11 0.00 -3.06 3.52 2.81 -1.26 -4.81 117.12 114.42 1v3f n MET 28 Ca -0.06 0.00 -0.45 0.00 -1.81 0.00 0.00 57.70 55.38 1v3f n MET 28 Cb 0.64 -1.42 -0.01 0.00 -0.71 0.00 0.00 33.22 31.72 1v3f n MET 28 CO 0.00 0.00 0.00 -2.00 1.51 0.00 0.00 175.97 175.48 1v3f s GLU 29 N 5.46 3.83 -1.38 0.03 2.12 -1.25 -4.59 118.70 122.91 1v3f s GLU 29 Ca 1.12 -2.34 -0.16 0.00 0.36 0.00 0.00 54.97 53.96 1v3f s GLU 29 Cb -1.42 -4.82 0.02 0.00 0.26 0.00 0.00 34.13 28.17 1v3f s GLU 29 CO 0.64 -1.61 0.34 0.00 -0.54 0.00 0.00 175.26 174.09 1v3f n GLN 30 N 5.28 -0.75 -0.98 4.30 10.64 -1.26 -3.83 117.38 130.78 1v3f n GLN 30 Ca 0.26 0.10 0.00 0.00 -1.83 0.00 0.00 57.00 55.53 1v3f n GLN 30 Cb 0.45 -3.16 0.00 0.00 -0.86 0.00 0.00 30.24 26.67 1v3f n GLN 30 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1v3f n GLY 31 N -2.32 -0.67 0.00 2.61 0.00 -1.26 -5.12 105.19 98.42 1v3f n GLY 31 Ca -0.23 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.46 1v3f n GLY 31 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1v3f n SER 32 N -0.24 0.00 0.00 1.61 7.64 -1.25 -5.08 113.62 116.30 1v3f n SER 32 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1v3f n SER 32 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1v3f n SER 32 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1v3f n THR 33 N -0.37 0.00 -3.95 0.44 -1.04 -1.26 -3.81 114.28 104.28 1v3f n THR 33 Ca 0.00 0.00 -0.31 0.00 -2.04 0.00 0.00 64.05 61.70 1v3f n THR 33 Cb 0.00 -0.11 0.01 0.00 -1.82 0.00 0.00 70.33 68.41 1v3f n THR 33 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1v3f n TYR 34 N -1.98 -2.15 0.00 -1.42 4.01 -1.26 -4.54 117.16 109.83 1v3f n TYR 34 Ca 0.00 0.86 0.00 0.00 -0.16 0.00 0.00 57.90 58.60 1v3f n TYR 34 Cb 0.00 -3.68 0.00 0.00 -0.31 0.00 0.00 39.34 35.35 1v3f n TYR 34 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 1v3f n LYS 35 N -4.56 0.00 -3.85 -0.72 5.02 -1.26 -2.74 118.16 110.05 1v3f n LYS 35 Ca 0.05 0.00 -0.34 0.00 -2.02 0.00 0.00 58.31 56.00 1v3f n LYS 35 Cb 0.52 0.00 -0.12 0.00 -0.02 0.00 0.00 35.03 35.40 1v3f n LYS 35 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1v3f s LYS 36 N 0.00 1.93 -0.04 1.97 1.02 -1.26 -4.43 119.74 118.92 1v3f s LYS 36 Ca 0.00 -1.98 -0.03 0.00 0.02 0.00 0.00 55.97 53.98 1v3f s LYS 36 Cb 0.00 -3.48 0.02 0.00 -0.52 0.00 0.00 37.83 33.85 1v3f s LYS 36 CO 0.00 -1.05 0.09 0.95 -0.92 0.00 0.00 175.35 174.42 1v3f s THR 37 N 0.82 -0.02 -0.17 2.17 -4.23 -1.10 -4.72 115.64 108.39 1v3f s THR 37 Ca 0.11 0.07 -0.06 0.00 -1.18 0.00 0.00 61.69 60.63 1v3f s THR 37 Cb -0.22 -0.15 -0.03 0.00 1.34 0.00 0.00 72.50 73.44 1v3f s THR 37 CO -0.05 0.03 0.02 0.72 -0.54 0.00 0.00 174.62 174.80 1v3f s PHE 38 N 0.42 3.14 0.42 3.99 -0.12 -0.88 -4.02 117.98 120.94 1v3f s PHE 38 Ca -0.03 -0.12 -0.23 0.00 -0.05 0.00 0.00 56.93 56.50 1v3f s PHE 38 Cb -0.05 -2.03 -0.11 0.00 -0.63 0.00 0.00 43.02 40.20 1v3f s PHE 38 CO -0.02 0.05 0.76 1.28 -0.05 0.00 0.00 175.22 177.25 1v3f n LEU 39 N 3.58 1.24 -0.30 -1.99 4.77 -1.26 -2.51 117.00 120.54 1v3f n LEU 39 Ca -0.17 0.96 0.04 0.00 -0.03 0.00 0.00 56.01 56.82 1v3f n LEU 39 Cb 0.52 -1.22 0.24 0.00 -2.33 0.00 0.00 43.42 40.63 1v3f n LEU 39 CO 0.34 -2.24 1.25 1.23 -1.33 0.00 0.00 177.39 176.64 1v3f h GLY 40 N 1.11 1.31 1.34 -0.72 0.00 0.18 -0.82 103.07 105.47 1v3f h GLY 40 Ca -0.42 -0.41 -0.09 0.00 0.00 0.00 0.00 47.33 46.41 1v3f h GLY 40 CO 0.54 0.30 -0.09 0.23 0.00 0.00 0.00 176.54 177.52 1v3f h SER 41 N 1.02 0.78 -0.72 0.19 0.87 -1.35 -2.17 113.55 112.17 1v3f h SER 41 Ca 0.39 -0.23 0.08 0.00 -1.23 0.00 0.00 61.79 60.80 1v3f h SER 41 Cb 0.20 -0.21 -0.06 0.00 -0.44 0.00 0.00 62.40 61.88 1v3f h SER 41 CO -0.14 0.90 0.39 -1.28 -0.53 0.00 0.00 176.83 176.17 1v3f h SER 42 N 0.72 0.56 0.51 6.23 0.87 -1.41 0.29 113.55 121.33 1v3f h SER 42 Ca 0.12 0.04 -0.03 0.00 -1.23 0.00 0.00 61.79 60.70 1v3f h SER 42 Cb 0.57 -0.06 0.01 0.00 -0.44 0.00 0.00 62.40 62.47 1v3f h SER 42 CO 0.04 0.34 -0.25 0.25 -0.53 0.00 0.00 176.83 176.68 1v3f h LEU 43 N 0.69 -0.59 -0.20 2.23 5.85 -1.17 0.24 115.31 122.36 1v3f h LEU 43 Ca 0.34 -0.06 0.03 0.00 0.84 0.00 0.00 57.88 59.03 1v3f h LEU 43 Cb 0.28 0.15 -0.06 0.00 0.37 0.00 0.00 40.66 41.39 1v3f h LEU 43 CO -0.22 -0.25 -0.49 0.58 -0.34 0.00 0.00 178.44 177.72 1v3f h VAL 44 N -0.94 0.00 -0.81 1.05 2.07 -1.00 1.59 116.25 118.21 1v3f h VAL 44 Ca -0.07 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.59 1v3f h VAL 44 Cb 0.61 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.29 1v3f h VAL 44 CO 0.12 0.00 0.40 -0.78 0.02 0.00 0.00 177.57 177.33 1v3f h ASP 45 N -0.46 0.47 0.21 0.57 3.58 -0.46 0.95 116.42 121.28 1v3f h ASP 45 Ca 0.04 0.09 -0.01 0.00 0.42 0.00 0.00 57.03 57.57 1v3f h ASP 45 Cb 0.57 0.02 0.00 0.00 1.72 0.00 0.00 39.33 41.64 1v3f h ASP 45 CO -0.44 0.21 -0.10 -0.25 -2.88 0.00 0.00 179.24 175.78 1v3f h TRP 46 N 0.59 -0.27 -0.87 0.28 7.01 0.21 0.73 115.95 123.63 1v3f h TRP 46 Ca 0.43 -0.01 0.21 0.00 2.11 0.00 0.00 58.89 61.64 1v3f h TRP 46 Cb 0.60 0.09 -0.16 0.00 -2.10 0.00 0.00 29.16 27.58 1v3f h TRP 46 CO -0.11 -0.17 -0.07 1.28 -2.79 0.00 0.00 178.44 176.58 1v3f n LEU 47 N -2.79 -0.18 0.41 0.65 4.77 0.52 0.21 117.00 120.59 1v3f n LEU 47 Ca -0.04 1.48 -0.18 0.00 -0.03 0.00 0.00 56.01 57.25 1v3f n LEU 47 Cb 0.11 -0.50 -0.09 0.00 -2.33 0.00 0.00 43.42 40.61 1v3f n LEU 47 CO 0.08 -1.47 0.53 0.40 -1.33 0.00 0.00 177.39 175.61 1v3f h ILE 48 N 0.00 0.16 -0.67 -0.08 2.04 -0.52 0.37 117.51 118.82 1v3f h ILE 48 Ca 0.48 -0.13 0.18 0.00 1.00 0.00 0.00 64.86 66.40 1v3f h ILE 48 Cb 0.91 0.19 -0.03 0.00 -0.74 0.00 0.00 36.82 37.15 1v3f h ILE 48 CO -0.85 0.01 0.47 -1.28 0.00 0.00 0.00 178.15 176.51 1v3f h SER 49 N -1.15 0.07 0.90 1.72 0.87 0.66 1.39 113.55 118.01 1v3f h SER 49 Ca -0.11 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.46 1v3f h SER 49 Cb 0.81 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.76 1v3f h SER 49 CO 0.17 0.04 0.00 -1.20 -0.53 0.00 0.00 176.83 175.31 1v3f n SER 50 N -4.37 0.49 0.00 6.23 7.64 0.57 -4.86 113.62 119.32 1v3f n SER 50 Ca 0.13 0.59 0.00 0.00 1.01 0.00 0.00 58.87 60.60 1v3f n SER 50 Cb 0.69 -0.70 0.00 0.00 -1.01 0.00 0.00 64.21 63.18 1v3f n SER 50 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1v3f n ASN 51 N -2.00 -2.74 0.05 6.43 5.15 0.47 -4.92 115.26 117.70 1v3f n ASN 51 Ca 0.04 0.00 0.04 0.00 -0.60 0.00 0.00 54.58 54.06 1v3f n ASN 51 Cb 0.28 -0.46 -0.06 0.00 -0.53 0.00 0.00 39.78 39.01 1v3f n ASN 51 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 1v3f n PHE 52 N -2.94 0.94 -4.23 1.20 3.72 0.12 -4.93 117.46 111.35 1v3f n PHE 52 Ca 0.00 0.30 -0.15 0.00 -0.05 0.00 0.00 57.45 57.55 1v3f n PHE 52 Cb 0.01 -1.03 -0.10 0.00 -0.94 0.00 0.00 39.48 37.42 1v3f n PHE 52 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1v3f s ALA 53 N -3.09 1.39 -0.22 4.37 0.00 -1.12 -4.89 121.76 118.19 1v3f s ALA 53 Ca -0.02 -1.41 0.10 0.00 0.00 0.00 0.00 51.96 50.63 1v3f s ALA 53 Cb 0.09 0.03 -0.21 0.00 0.00 0.00 0.00 23.12 23.03 1v3f s ALA 53 CO 0.81 -0.06 -0.03 0.00 0.00 0.00 0.00 175.76 176.47 1v3f n ALA 54 N 0.03 1.45 -2.26 0.00 0.00 -1.26 -4.46 120.51 114.00 1v3f n ALA 54 Ca -0.12 -1.19 -0.08 0.00 0.00 0.00 0.00 53.44 52.05 1v3f n ALA 54 Cb 0.60 -0.19 -0.09 0.00 0.00 0.00 0.00 19.45 19.77 1v3f n ALA 54 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1v3f s SER 55 N -6.02 0.38 0.46 0.00 0.15 -1.26 -5.01 113.70 102.41 1v3f s SER 55 Ca -0.21 -0.88 0.39 0.00 0.70 0.00 0.00 55.95 55.95 1v3f s SER 55 Cb 0.07 0.23 1.50 0.00 -1.71 0.00 0.00 66.02 66.12 1v3f s SER 55 CO 0.73 -0.61 1.45 0.54 1.20 0.00 0.00 173.24 176.54 1v3f n ARG 56 N 0.16 -0.02 0.04 5.44 3.00 -1.26 -0.16 116.66 123.86 1v3f n ARG 56 Ca -0.15 1.09 -0.01 0.00 -0.01 0.00 0.00 57.85 58.76 1v3f n ARG 56 Cb 0.61 -2.32 -0.01 0.00 0.00 0.00 0.00 32.46 30.75 1v3f n ARG 56 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.63 178.88 1v3f h LEU 57 N 0.00 -0.08 -1.68 0.55 7.12 -1.97 1.23 115.31 120.48 1v3f h LEU 57 Ca 0.85 0.00 0.49 0.00 0.13 0.00 0.00 57.88 59.35 1v3f h LEU 57 Cb 3.09 0.02 -0.11 0.00 -0.53 0.00 0.00 40.66 43.13 1v3f h LEU 57 CO -0.22 -0.05 1.09 -0.33 -0.13 0.00 0.00 178.44 178.80 1v3f h GLU 58 N -0.10 0.03 0.09 1.25 5.08 -0.95 1.55 114.58 121.54 1v3f h GLU 58 Ca -0.01 -0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.20 1v3f h GLU 58 Cb 0.07 -0.01 0.02 0.00 0.50 0.00 0.00 28.75 29.33 1v3f h GLU 58 CO 0.02 0.02 -0.65 0.00 -1.00 0.00 0.00 179.01 177.40 1v3f h ALA 59 N 1.35 -0.05 -0.65 3.43 0.00 -1.05 -1.53 119.26 120.76 1v3f h ALA 59 Ca 0.86 -0.64 0.11 0.00 0.00 0.00 0.00 54.91 55.25 1v3f h ALA 59 Cb 3.09 0.07 -0.08 0.00 0.00 0.00 0.00 17.79 20.87 1v3f h ALA 59 CO -0.23 0.31 0.22 0.28 0.00 0.00 0.00 179.25 179.83 1v3f h VAL 60 N -0.41 0.70 -0.21 0.00 2.07 1.18 0.39 116.25 119.96 1v3f h VAL 60 Ca -0.11 -0.13 -0.08 0.00 0.82 0.00 0.00 66.70 67.20 1v3f h VAL 60 Cb 1.47 0.29 -0.00 0.00 -1.52 0.00 0.00 31.29 31.53 1v3f h VAL 60 CO 0.12 0.07 -0.20 0.74 0.02 0.00 0.00 177.57 178.32 1v3f h THR 61 N 0.38 1.33 -0.92 2.57 2.02 -0.75 -2.07 112.91 115.47 1v3f h THR 61 Ca 0.34 -1.36 0.12 0.00 0.77 0.00 0.00 66.41 66.28 1v3f h THR 61 Cb 0.48 1.75 -0.08 0.00 -1.74 0.00 0.00 68.15 68.56 1v3f h THR 61 CO -0.37 0.42 0.54 -0.07 0.37 0.00 0.00 175.52 176.42 1v3f h LEU 62 N 0.18 0.77 0.69 2.58 3.38 -0.15 0.58 115.31 123.33 1v3f h LEU 62 Ca 0.03 0.06 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 1v3f h LEU 62 Cb 0.75 -0.09 0.01 0.00 0.09 0.00 0.00 40.66 41.42 1v3f h LEU 62 CO 0.05 0.39 -0.33 0.00 0.09 0.00 0.00 178.44 178.64 1v3f h ALA 63 N 1.52 -0.93 -0.91 1.53 0.00 -0.15 -1.58 119.26 118.75 1v3f h ALA 63 Ca 0.47 -0.22 0.18 0.00 0.00 0.00 0.00 54.91 55.34 1v3f h ALA 63 Cb 0.51 0.36 -0.07 0.00 0.00 0.00 0.00 17.79 18.59 1v3f h ALA 63 CO -0.29 -0.93 0.59 0.66 0.00 0.00 0.00 179.25 179.28 1v3f h SER 64 N -1.11 0.54 0.30 0.00 4.64 -0.70 -1.04 113.55 116.18 1v3f h SER 64 Ca -0.09 0.05 -0.01 0.00 -0.47 0.00 0.00 61.79 61.26 1v3f h SER 64 Cb 0.74 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.78 1v3f h SER 64 CO 0.16 0.23 -0.14 0.24 -0.87 0.00 0.00 176.83 176.45 1v3f h MET 65 N 0.55 -0.38 -0.67 4.77 2.07 0.42 -2.00 114.93 119.68 1v3f h MET 65 Ca 0.47 0.03 0.14 0.00 -2.07 0.00 0.00 59.70 58.27 1v3f h MET 65 Cb 0.98 0.09 -0.10 0.00 -1.87 0.00 0.00 31.60 30.69 1v3f h MET 65 CO -0.21 -0.25 0.13 -0.07 1.07 0.00 0.00 176.91 177.57 1v3f h LEU 66 N -0.40 -0.05 -0.91 1.22 3.38 -0.19 0.23 115.31 118.59 1v3f h LEU 66 Ca -0.04 0.14 0.10 0.00 0.09 0.00 0.00 57.88 58.16 1v3f h LEU 66 Cb 0.31 0.20 -0.08 0.00 0.09 0.00 0.00 40.66 41.18 1v3f h LEU 66 CO 0.07 -0.04 0.55 0.24 0.09 0.00 0.00 178.44 179.35 1v3f h MET 67 N 0.24 0.90 0.29 1.13 2.86 -1.07 0.13 114.93 119.41 1v3f h MET 67 Ca 0.37 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.96 1v3f h MET 67 Cb 0.60 -0.20 -0.02 0.00 0.06 0.00 0.00 31.60 32.03 1v3f h MET 67 CO -0.48 0.60 -0.31 0.93 1.06 0.00 0.00 176.91 178.70 1v3f h GLU 68 N 0.93 -0.61 0.00 1.72 4.39 0.18 0.71 114.58 121.90 1v3f h GLU 68 Ca 0.43 0.04 0.00 0.00 0.34 0.00 0.00 59.36 60.18 1v3f h GLU 68 Cb 0.36 0.14 0.00 0.00 -0.10 0.00 0.00 28.75 29.15 1v3f h GLU 68 CO -0.24 -0.41 0.05 0.39 -1.16 0.00 0.00 179.01 177.65 1v3f n GLU 69 N -5.42 0.13 -1.43 2.33 4.71 -0.87 -4.77 120.64 115.32 1v3f n GLU 69 Ca -0.09 0.63 0.00 0.00 -0.01 0.00 0.00 57.16 57.69 1v3f n GLU 69 Cb 0.33 -1.99 0.00 0.00 -1.01 0.00 0.00 31.44 28.77 1v3f n GLU 69 CO 0.00 0.00 0.00 -1.71 0.09 0.00 0.00 177.13 175.51 1v3f n ASN 70 N -2.23 -1.12 -0.02 1.62 5.15 0.24 -4.99 115.26 113.90 1v3f n ASN 70 Ca -0.01 0.00 0.08 0.00 -0.60 0.00 0.00 54.58 54.05 1v3f n ASN 70 Cb 0.09 -0.29 -0.17 0.00 -0.53 0.00 0.00 39.78 38.88 1v3f n ASN 70 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 1v3f n PHE 71 N -1.54 0.00 -4.01 1.20 3.72 0.40 -4.37 117.46 112.86 1v3f n PHE 71 Ca 0.00 0.00 -0.11 0.00 -0.05 0.00 0.00 57.45 57.29 1v3f n PHE 71 Cb 0.29 -0.55 -0.04 0.00 -0.94 0.00 0.00 39.48 38.24 1v3f n PHE 71 CO 0.00 0.00 0.00 -0.48 -0.05 0.00 0.00 176.76 176.23 1v3f s LEU 72 N -4.61 0.55 0.08 4.37 2.34 -1.25 -1.39 118.68 118.77 1v3f s LEU 72 Ca -0.08 -1.17 -0.17 0.00 0.06 0.00 0.00 54.13 52.77 1v3f s LEU 72 Cb 0.13 1.77 0.03 0.00 -0.56 0.00 0.00 46.19 47.56 1v3f s LEU 72 CO 0.88 -1.26 0.39 0.00 -1.06 0.00 0.00 176.35 175.30 1v3f s ARG 73 N -3.45 0.96 -0.15 1.48 3.03 0.24 -4.31 118.95 116.76 1v3f s ARG 73 Ca 0.25 -0.52 -0.29 0.00 2.03 0.00 0.00 55.73 57.19 1v3f s ARG 73 Cb -0.01 0.43 -0.02 0.00 -1.03 0.00 0.00 34.95 34.32 1v3f s ARG 73 CO 0.14 -0.35 1.27 -1.25 -1.13 0.00 0.00 175.30 173.97 1v3f s PRO 74 N -3.02 4.25 -0.03 3.89 0.04 -1.26 -1.72 135.00 137.14 1v3f s PRO 74 Ca -0.02 1.68 -0.18 0.00 0.04 0.00 0.00 61.00 62.53 1v3f s PRO 74 Cb 0.00 -3.74 -0.05 0.00 0.04 0.00 0.00 34.50 30.75 1v3f s PRO 74 CO -0.06 -0.67 0.49 0.08 0.04 0.00 0.00 177.00 176.87 1v3f s VAL 75 N 3.33 5.02 0.00 -0.36 1.01 -1.19 -4.47 120.40 123.73 1v3f s VAL 75 Ca 0.55 1.01 0.00 0.00 0.00 0.00 0.00 61.98 63.54 1v3f s VAL 75 Cb -0.22 -3.81 0.00 0.00 0.00 0.00 0.00 36.38 32.34 1v3f s VAL 75 CO 0.16 0.46 0.00 0.61 0.00 0.00 0.00 175.10 176.33 1v3f n GLY 76 N 2.41 0.72 3.76 4.51 0.00 -1.26 -4.34 105.19 111.00 1v3f n GLY 76 Ca -0.10 -0.73 -0.30 0.00 0.00 0.00 0.00 46.02 44.90 1v3f n GLY 76 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1v3f s VAL 77 N 0.00 1.85 -1.31 1.61 -7.23 -1.26 -2.55 120.40 111.51 1v3f s VAL 77 Ca 0.00 0.00 -0.01 0.00 -1.81 0.00 0.00 61.98 60.16 1v3f s VAL 77 Cb 0.00 -2.74 0.00 0.00 0.56 0.00 0.00 36.38 34.21 1v3f s VAL 77 CO 0.00 0.00 0.19 0.54 -0.31 0.00 0.00 175.10 175.52 1v3f n ARG 78 N -4.15 -2.29 0.00 4.82 5.12 -1.26 -4.48 116.66 114.42 1v3f n ARG 78 Ca 0.12 0.75 0.00 0.00 -1.93 0.00 0.00 57.85 56.79 1v3f n ARG 78 Cb 0.59 -5.16 0.00 0.00 -1.16 0.00 0.00 32.46 26.74 1v3f n ARG 78 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57 1v3f n SER 79 N -1.26 0.00 -1.89 0.55 3.41 -1.26 -3.82 113.62 109.35 1v3f n SER 79 Ca -0.15 0.00 -0.11 0.00 -0.26 0.00 0.00 58.87 58.35 1v3f n SER 79 Cb 0.62 0.01 -0.05 0.00 -0.26 0.00 0.00 64.21 64.53 1v3f n SER 79 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1v3f n MET 80 N -0.86 1.69 0.00 4.33 2.81 -1.06 -4.64 117.12 119.39 1v3f n MET 80 Ca 0.00 -1.01 0.00 0.00 -1.81 0.00 0.00 57.70 54.88 1v3f n MET 80 Cb 0.00 -1.61 0.00 0.00 -0.71 0.00 0.00 33.22 30.90 1v3f n MET 80 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1v3f n GLY 81 N 1.45 -0.33 0.11 3.03 0.00 -1.26 -4.81 105.19 103.38 1v3f n GLY 81 Ca 0.27 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.15 1v3f n GLY 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1v3f n ALA 82 N -3.00 1.40 -1.69 4.61 0.00 -1.26 -5.10 120.51 115.47 1v3f n ALA 82 Ca 0.00 -1.07 0.00 0.00 0.00 0.00 0.00 53.44 52.37 1v3f n ALA 82 Cb 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 19.45 19.11 1v3f n ALA 82 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1v3f n ILE 83 N -3.06 -4.76 -0.23 0.00 -0.00 -1.26 -4.18 119.36 105.88 1v3f n ILE 83 Ca -0.34 2.22 0.31 0.00 -0.00 0.00 0.00 62.75 64.94 1v3f n ILE 83 Cb 1.07 -3.19 0.59 0.00 -0.00 0.00 0.00 39.64 38.11 1v3f n ILE 83 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.55 176.63 1v3f h ARG 84 N 1.27 0.00 -4.95 0.38 0.11 -1.87 -3.43 114.38 105.90 1v3f h ARG 84 Ca 0.00 0.00 -0.14 0.00 0.10 0.00 0.00 59.98 59.94 1v3f h ARG 84 Cb 0.31 0.00 -0.09 0.00 1.11 0.00 0.00 29.97 31.30 1v3f h ARG 84 CO 0.00 0.00 -0.20 0.45 0.10 0.00 0.00 179.97 180.32 1v3f n SER 85 N -3.53 -1.03 -0.70 0.08 2.88 -1.26 -0.18 113.62 109.88 1v3f n SER 85 Ca 0.23 0.03 0.00 0.00 -1.33 0.00 0.00 58.87 57.81 1v3f n SER 85 Cb 1.38 -0.98 0.00 0.00 -0.75 0.00 0.00 64.21 63.87 1v3f n SER 85 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1v3f n GLY 86 N -0.57 0.80 2.16 0.46 0.00 -1.26 -5.11 105.19 101.68 1v3f n GLY 86 Ca 0.03 -0.47 -0.05 0.00 0.00 0.00 0.00 46.02 45.52 1v3f n GLY 86 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1v3f n ASP 87 N -0.70 -1.32 -1.72 1.61 2.03 0.75 -5.02 116.55 112.18 1v3f n ASP 87 Ca 0.00 -1.93 0.08 0.00 0.52 0.00 0.00 54.79 53.47 1v3f n ASP 87 Cb 0.26 2.20 0.38 0.00 -0.72 0.00 0.00 41.12 43.23 1v3f n ASP 87 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 1v3f n LEU 88 N 0.00 5.26 -4.65 -2.67 -0.00 -1.26 -4.81 117.00 108.86 1v3f n LEU 88 Ca -0.05 -2.74 -0.40 0.00 -0.00 0.00 0.00 56.01 52.81 1v3f n LEU 88 Cb 0.34 -0.63 0.02 0.00 -0.00 0.00 0.00 43.42 43.15 1v3f n LEU 88 CO 0.16 0.71 0.72 0.00 -0.00 0.00 0.00 177.39 178.98 1v3f n ALA 89 N 0.77 0.69 -2.87 1.96 0.00 -1.26 -4.92 120.51 114.88 1v3f n ALA 89 Ca 0.27 0.20 -0.35 0.00 0.00 0.00 0.00 53.44 53.56 1v3f n ALA 89 Cb 1.06 -2.17 -0.01 0.00 0.00 0.00 0.00 19.45 18.32 1v3f n ALA 89 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1v3f n GLU 90 N -0.14 4.23 -3.08 0.00 1.02 -1.26 -4.69 120.64 116.72 1v3f n GLU 90 Ca 0.09 -4.73 -0.41 0.00 -0.02 0.00 0.00 57.16 52.09 1v3f n GLU 90 Cb 0.41 -2.37 -0.06 0.00 -0.02 0.00 0.00 31.44 29.40 1v3f n GLU 90 CO 0.00 0.00 0.00 1.14 1.18 0.00 0.00 177.13 179.45 1v3f s GLN 91 N -3.66 4.04 -0.28 3.49 1.03 -1.26 -4.96 119.66 118.05 1v3f s GLN 91 Ca 0.42 0.51 -0.28 0.00 0.04 0.00 0.00 55.36 56.05 1v3f s GLN 91 Cb 0.20 -3.68 0.19 0.00 0.03 0.00 0.00 33.01 29.75 1v3f s GLN 91 CO -0.10 -0.49 1.35 0.12 -2.54 0.00 0.00 175.29 173.63 1v3f s PHE 92 N 2.60 -0.08 0.37 9.60 2.19 -1.26 -4.69 117.98 126.71 1v3f s PHE 92 Ca 0.27 0.16 0.08 0.00 0.33 0.00 0.00 56.93 57.78 1v3f s PHE 92 Cb -0.15 0.48 -0.06 0.00 -1.31 0.00 0.00 43.02 41.98 1v3f s PHE 92 CO 0.10 -0.06 0.03 -0.51 1.83 0.00 0.00 175.22 176.60 1v3f s LEU 93 N -0.65 2.96 -0.51 6.12 1.43 -1.26 -5.03 118.68 121.73 1v3f s LEU 93 Ca 0.07 -1.10 0.07 0.00 -1.03 0.00 0.00 54.13 52.14 1v3f s LEU 93 Cb -0.02 -1.24 0.24 0.00 0.03 0.00 0.00 46.19 45.20 1v3f s LEU 93 CO -0.10 -0.33 0.61 -0.67 0.23 0.00 0.00 176.35 176.09 1v3f n ASP 94 N -0.99 1.81 -1.84 2.29 2.03 -1.26 -4.49 116.55 114.10 1v3f n ASP 94 Ca -0.04 -3.02 -0.06 0.00 0.52 0.00 0.00 54.79 52.19 1v3f n ASP 94 Cb 0.64 -0.65 -0.02 0.00 -0.72 0.00 0.00 41.12 40.36 1v3f n ASP 94 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 1v3f n ASP 95 N 1.27 0.32 -1.59 1.67 8.00 -1.26 -4.56 116.55 120.39 1v3f n ASP 95 Ca 0.25 -1.61 0.08 0.00 0.71 0.00 0.00 54.79 54.22 1v3f n ASP 95 Cb 0.47 0.39 0.34 0.00 -0.02 0.00 0.00 41.12 42.30 1v3f n ASP 95 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1v3f n SER 96 N -2.33 4.73 -0.00 -2.24 3.41 -1.26 -1.13 113.62 114.80 1v3f n SER 96 Ca 0.01 -2.58 -0.01 0.00 -0.26 0.00 0.00 58.87 56.03 1v3f n SER 96 Cb 0.17 -0.60 -0.00 0.00 -0.26 0.00 0.00 64.21 63.52 1v3f n SER 96 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1v3f n THR 97 N 0.83 0.04 -1.97 6.66 -2.24 -1.26 -4.89 114.28 111.45 1v3f n THR 97 Ca 0.24 -0.02 -0.25 0.00 -2.27 0.00 0.00 64.05 61.75 1v3f n THR 97 Cb 0.93 -0.56 -0.06 0.00 -2.10 0.00 0.00 70.33 68.54 1v3f n THR 97 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1v3f s ALA 98 N -2.02 1.52 0.96 6.98 0.00 -1.25 -4.83 121.76 123.13 1v3f s ALA 98 Ca -0.01 -1.76 -0.13 0.00 0.00 0.00 0.00 51.96 50.06 1v3f s ALA 98 Cb 0.00 -4.63 0.17 0.00 0.00 0.00 0.00 23.12 18.66 1v3f s ALA 98 CO 0.02 -5.33 1.15 -0.51 0.00 0.00 0.00 175.76 171.08 1v3f s LEU 99 N 11.66 1.87 -0.27 0.00 2.01 -1.26 0.17 118.68 132.86 1v3f s LEU 99 Ca 0.72 0.88 -0.25 0.00 0.01 0.00 0.00 54.13 55.49 1v3f s LEU 99 Cb -0.04 -3.09 0.11 0.00 0.01 0.00 0.00 46.19 43.17 1v3f s LEU 99 CO 0.09 -2.82 0.94 -0.31 1.01 0.00 0.00 176.35 175.25 1v3f s TYR 100 N -3.27 -0.56 0.29 0.29 2.02 -1.04 -3.19 117.35 111.88 1v3f s TYR 100 Ca 0.66 1.36 0.06 0.00 -0.37 0.00 0.00 57.07 58.77 1v3f s TYR 100 Cb -0.14 0.34 -0.06 0.00 -0.40 0.00 0.00 41.96 41.70 1v3f s TYR 100 CO 0.54 -0.28 -0.03 -0.08 -1.57 0.00 0.00 175.55 174.13 1v3f s THR 101 N 0.21 1.50 0.13 -0.71 -1.32 -0.70 -2.07 115.64 112.68 1v3f s THR 101 Ca 0.02 -2.09 -0.30 0.00 -1.21 0.00 0.00 61.69 58.11 1v3f s THR 101 Cb -0.05 -2.51 -0.06 0.00 -1.51 0.00 0.00 72.50 68.37 1v3f s THR 101 CO -0.04 -0.24 0.98 -0.36 -2.21 0.00 0.00 174.62 172.75 1v3f s PHE 102 N -3.10 3.80 0.76 9.09 0.08 -1.26 0.80 117.98 128.15 1v3f s PHE 102 Ca 0.31 1.78 -0.12 0.00 0.12 0.00 0.00 56.93 59.02 1v3f s PHE 102 Cb 0.05 -3.08 0.05 0.00 -0.57 0.00 0.00 43.02 39.47 1v3f s PHE 102 CO 0.12 0.12 1.11 0.00 -0.10 0.00 0.00 175.22 176.47 1v3f s ALA 103 N -0.10 2.58 -0.27 5.36 0.00 -0.49 -4.76 121.76 124.08 1v3f s ALA 103 Ca 0.47 -0.35 -0.07 0.00 0.00 0.00 0.00 51.96 52.01 1v3f s ALA 103 Cb -0.24 -3.04 -0.01 0.00 0.00 0.00 0.00 23.12 19.83 1v3f s ALA 103 CO 0.31 -1.48 0.06 -1.21 0.00 0.00 0.00 175.76 173.44 1v3f s GLU 104 N -5.32 3.33 0.00 0.00 2.02 -1.26 -4.76 118.70 112.71 1v3f s GLU 104 Ca 0.60 -0.69 0.00 0.00 0.02 0.00 0.00 54.97 54.90 1v3f s GLU 104 Cb -0.12 -3.30 0.00 0.00 0.10 0.00 0.00 34.13 30.80 1v3f s GLU 104 CO 0.52 -0.32 0.00 0.43 0.02 0.00 0.00 175.26 175.91 1v3f n SER 105 N 4.88 0.00 -3.64 -0.19 7.64 -1.26 -5.08 113.62 115.97 1v3f n SER 105 Ca -0.16 0.00 -0.02 0.00 1.01 0.00 0.00 58.87 59.70 1v3f n SER 105 Cb 0.50 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.65 1v3f n SER 105 CO 0.00 0.00 0.00 -0.72 -3.01 0.00 0.00 175.04 171.31 1v3f s TYR 106 N 0.00 -0.04 -1.11 1.43 1.13 -1.26 -5.03 117.35 112.47 1v3f s TYR 106 Ca 0.00 0.07 -0.26 0.00 -1.41 0.00 0.00 57.07 55.48 1v3f s TYR 106 Cb 0.00 0.49 -0.19 0.00 -1.10 0.00 0.00 41.96 41.17 1v3f s TYR 106 CO 0.00 -0.03 2.07 -1.59 -2.51 0.00 0.00 175.55 173.49 1v3f s LYS 107 N -0.86 1.54 0.00 -3.49 -2.85 -1.26 -3.82 119.74 109.00 1v3f s LYS 107 Ca 0.09 -0.63 0.00 0.00 -1.00 0.00 0.00 55.97 54.43 1v3f s LYS 107 Cb -0.02 -5.05 0.00 0.00 -2.06 0.00 0.00 37.83 30.70 1v3f s LYS 107 CO -0.09 -5.09 0.00 1.17 0.10 0.00 0.00 175.35 171.44 1v3f n LYS 108 N 8.21 0.00 -3.39 1.78 4.81 -1.26 -5.16 118.16 123.15 1v3f n LYS 108 Ca 0.42 0.00 -0.32 0.00 -0.87 0.00 0.00 58.31 57.55 1v3f n LYS 108 Cb 0.47 0.00 -0.05 0.00 0.02 0.00 0.00 35.03 35.47 1v3f n LYS 108 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 1v3f s LYS 109 N 0.00 3.79 -0.10 1.64 1.02 -1.25 -4.99 119.74 119.85 1v3f s LYS 109 Ca 0.00 0.26 0.09 0.00 0.02 0.00 0.00 55.97 56.34 1v3f s LYS 109 Cb 0.00 -2.64 -0.13 0.00 -0.52 0.00 0.00 37.83 34.55 1v3f s LYS 109 CO 0.00 0.30 0.04 1.55 -0.92 0.00 0.00 175.35 176.32 1v3f n VAL 110 N -0.24 0.68 -2.92 3.17 3.14 -1.26 -5.07 118.33 115.84 1v3f n VAL 110 Ca 0.00 -0.42 -0.08 0.00 -2.96 0.00 0.00 64.34 60.88 1v3f n VAL 110 Cb 0.53 -0.71 0.01 0.00 -1.06 0.00 0.00 33.84 32.60 1v3f n VAL 110 CO 0.00 0.00 0.00 -0.24 -6.46 0.00 0.00 176.83 170.13 1v3f n SER 111 N -2.36 -5.49 -3.81 6.55 2.88 -1.26 -4.92 113.62 105.20 1v3f n SER 111 Ca -0.16 0.24 -0.29 0.00 -1.33 0.00 0.00 58.87 57.32 1v3f n SER 111 Cb 0.82 -1.37 -0.13 0.00 -0.75 0.00 0.00 64.21 62.78 1v3f n SER 111 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1v3f s SER 112 N -0.96 3.94 0.51 -3.46 0.15 -1.26 -5.10 113.70 107.52 1v3f s SER 112 Ca 0.08 -2.94 -0.07 0.00 0.70 0.00 0.00 55.95 53.72 1v3f s SER 112 Cb -0.01 -1.30 -0.04 0.00 -1.71 0.00 0.00 66.02 62.96 1v3f s SER 112 CO 0.17 -0.23 0.85 -0.75 1.20 0.00 0.00 173.24 174.48 1v3f s LYS 113 N -0.11 3.57 -0.28 5.44 2.20 -1.26 -5.08 119.74 124.22 1v3f s LYS 113 Ca 0.19 0.36 -0.01 0.00 -0.36 0.00 0.00 55.97 56.15 1v3f s LYS 113 Cb -0.21 -2.30 0.13 0.00 -1.51 0.00 0.00 37.83 33.94 1v3f s LYS 113 CO -0.03 -0.29 0.31 -2.00 -0.36 0.00 0.00 175.35 172.98 1v3f s GLU 114 N -4.82 0.33 0.15 4.03 2.12 -1.26 -5.13 118.70 114.12 1v3f s GLU 114 Ca 0.50 0.01 -0.32 0.00 0.36 0.00 0.00 54.97 55.51 1v3f s GLU 114 Cb -0.10 -0.64 -0.17 0.00 0.26 0.00 0.00 34.13 33.47 1v3f s GLU 114 CO 0.47 -0.95 0.85 0.45 -0.54 0.00 0.00 175.26 175.53 1v3f n SER 115 N 5.32 -0.11 -3.15 -1.70 2.88 -1.26 -4.96 113.62 110.64 1v3f n SER 115 Ca -0.02 1.14 0.05 0.00 -1.33 0.00 0.00 58.87 58.71 1v3f n SER 115 Cb 0.48 -1.03 -0.00 0.00 -0.75 0.00 0.00 64.21 62.90 1v3f n SER 115 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1v3f s GLY 116 N -0.48 -1.12 1.06 0.46 0.00 -1.26 -5.17 107.32 100.81 1v3f s GLY 116 Ca 0.72 1.48 -0.17 0.00 0.00 0.00 0.00 44.72 46.75 1v3f s GLY 116 CO 0.56 3.81 1.21 2.56 0.00 0.00 0.00 173.10 181.24 1v3f s PRO 117 N 2.88 -0.12 0.44 2.90 0.04 -1.26 -5.07 135.00 134.81 1v3f s PRO 117 Ca 0.16 -0.19 0.03 0.00 0.04 0.00 0.00 61.00 61.04 1v3f s PRO 117 Cb -0.08 -1.74 0.00 0.00 0.04 0.00 0.00 34.50 32.73 1v3f s PRO 117 CO -0.24 -2.96 0.64 -1.12 0.04 0.00 0.00 177.00 173.36 1v3f s SER 118 N -4.37 5.74 -0.00 6.66 0.01 -1.26 -5.12 113.70 115.36 1v3f s SER 118 Ca 0.72 0.06 0.02 0.00 1.31 0.00 0.00 55.95 58.06 1v3f s SER 118 Cb -0.07 -1.26 -0.01 0.00 0.21 0.00 0.00 66.02 64.89 1v3f s SER 118 CO 0.54 -0.73 -0.08 -0.55 0.41 0.00 0.00 173.24 172.83 1v3f s SER 119 N -4.26 0.94 0.00 2.44 0.15 -1.26 -5.36 113.70 106.35 1v3f s SER 119 Ca 0.50 -0.16 0.14 0.00 0.70 0.00 0.00 55.95 57.12 1v3f s SER 119 Cb -0.10 -0.10 0.11 0.00 -1.71 0.00 0.00 66.02 64.22 1v3f s SER 119 CO 0.36 0.09 0.94 0.61 1.20 0.00 0.00 173.24 176.43