#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 0.07 -1.92 1.61 2.88 -1.26 -5.19 113.62 109.81 1v3f n SER 2 Ca 0.00 -0.90 -0.05 0.00 -1.33 0.00 0.00 58.87 56.59 1v3f n SER 2 Cb 0.00 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 63.47 1v3f n SER 2 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1v3f n SER 3 N -2.63 -1.09 0.00 -3.46 2.88 -1.26 -5.05 113.62 103.02 1v3f n SER 3 Ca 0.00 -1.84 0.00 0.00 -1.33 0.00 0.00 58.87 55.70 1v3f n SER 3 Cb 0.00 1.84 0.00 0.00 -0.75 0.00 0.00 64.21 65.30 1v3f n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1v3f n GLY 4 N -0.28 1.81 3.18 0.46 0.00 -1.26 -5.07 105.19 104.03 1v3f n GLY 4 Ca -0.04 -2.03 -0.04 0.00 0.00 0.00 0.00 46.02 43.92 1v3f n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1v3f n SER 5 N 0.00 -6.61 -0.12 1.61 7.64 -1.26 -4.93 113.62 109.95 1v3f n SER 5 Ca 0.00 0.44 -0.24 0.00 1.01 0.00 0.00 58.87 60.08 1v3f n SER 5 Cb 0.00 -1.93 -0.11 0.00 -1.01 0.00 0.00 64.21 61.15 1v3f n SER 5 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1v3f n SER 6 N 1.10 1.97 -0.11 6.43 2.88 -1.26 -3.77 113.62 120.86 1v3f n SER 6 Ca -0.01 0.18 -0.09 0.00 -1.33 0.00 0.00 58.87 57.62 1v3f n SER 6 Cb 0.47 -0.71 -0.01 0.00 -0.75 0.00 0.00 64.21 63.21 1v3f n SER 6 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 1v3f h GLY 7 N 0.18 0.53 0.85 0.46 0.00 -2.00 -2.41 103.07 100.69 1v3f h GLY 7 Ca -0.59 -0.26 -0.03 0.00 0.00 0.00 0.00 47.33 46.45 1v3f h GLY 7 CO -0.24 0.25 -0.41 1.41 0.00 0.00 0.00 176.54 177.55 1v3f h LEU 8 N 0.43 -1.02 -1.25 3.11 3.38 -1.96 0.70 115.31 118.70 1v3f h LEU 8 Ca 0.12 0.06 0.39 0.00 0.09 0.00 0.00 57.88 58.54 1v3f h LEU 8 Cb 0.10 0.29 -0.14 0.00 0.09 0.00 0.00 40.66 41.01 1v3f h LEU 8 CO -0.02 -0.64 0.72 0.45 0.09 0.00 0.00 178.44 179.05 1v3f h HIS 9 N -1.02 0.68 -0.11 1.13 3.86 -1.63 1.10 115.15 119.16 1v3f h HIS 9 Ca -0.09 0.03 -0.07 0.00 -1.16 0.00 0.00 60.37 59.08 1v3f h HIS 9 Cb 0.82 -0.17 0.00 0.00 1.06 0.00 0.00 27.41 29.12 1v3f h HIS 9 CO -0.09 -0.21 -0.21 -0.09 0.86 0.00 0.00 177.93 178.18 1v3f h ARG 10 N 0.16 0.33 -0.01 2.45 9.65 -0.79 -2.37 114.38 123.80 1v3f h ARG 10 Ca 0.78 -0.21 0.01 0.00 -1.10 0.00 0.00 59.98 59.45 1v3f h ARG 10 Cb 2.22 0.03 -0.01 0.00 -1.39 0.00 0.00 29.97 30.82 1v3f h ARG 10 CO -0.50 0.81 -0.02 0.82 2.80 0.00 0.00 179.97 183.87 1v3f h ILE 11 N -0.10 0.94 -0.39 1.20 2.04 0.32 -2.36 117.51 119.16 1v3f h ILE 11 Ca 0.00 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.95 1v3f h ILE 11 Cb 0.80 0.94 -0.08 0.00 -0.74 0.00 0.00 36.82 37.73 1v3f h ILE 11 CO 0.05 0.00 -0.18 0.58 0.00 0.00 0.00 178.15 178.60 1v3f h VAL 12 N -0.03 0.46 -1.04 1.67 2.07 0.08 0.52 116.25 119.97 1v3f h VAL 12 Ca 0.01 0.00 0.27 0.00 0.82 0.00 0.00 66.70 67.80 1v3f h VAL 12 Cb 0.05 0.46 -0.10 0.00 -1.52 0.00 0.00 31.29 30.18 1v3f h VAL 12 CO -0.03 0.00 0.67 0.44 0.02 0.00 0.00 177.57 178.67 1v3f h ASP 13 N -0.10 0.46 0.04 0.57 3.32 -1.00 1.27 116.42 120.98 1v3f h ASP 13 Ca 0.19 0.09 -0.00 0.00 0.02 0.00 0.00 57.03 57.33 1v3f h ASP 13 Cb 0.40 0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.97 1v3f h ASP 13 CO -0.46 0.08 -0.02 0.50 -1.72 0.00 0.00 179.24 177.62 1v3f h LYS 14 N 0.40 -0.05 0.00 3.56 3.64 0.35 -3.14 116.57 121.33 1v3f h LYS 14 Ca 0.60 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.99 1v3f h LYS 14 Cb 1.51 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 33.34 1v3f h LYS 14 CO -0.31 0.53 -0.00 0.52 -2.27 0.00 0.00 179.45 177.92 1v3f h MET 15 N -0.69 0.00 0.00 1.90 2.86 0.22 0.16 114.93 119.38 1v3f h MET 15 Ca -0.01 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 1v3f h MET 15 Cb 0.61 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.27 1v3f h MET 15 CO 0.01 0.00 0.00 0.45 1.06 0.00 0.00 176.91 178.43 1v3f h HIS 16 N 0.00 0.00 -3.02 -0.22 3.86 0.15 -3.35 115.15 112.57 1v3f h HIS 16 Ca -0.00 0.00 -0.48 0.00 -1.16 0.00 0.00 60.37 58.73 1v3f h HIS 16 Cb 0.00 0.00 0.02 0.00 1.06 0.00 0.00 27.41 28.49 1v3f h HIS 16 CO 0.00 0.00 -0.09 0.34 0.86 0.00 0.00 177.93 179.04 1v3f s ASP 17 N -5.13 6.21 -0.01 2.45 -1.08 0.56 -5.01 116.67 114.65 1v3f s ASP 17 Ca -0.01 0.56 0.10 0.00 -0.52 0.00 0.00 52.55 52.69 1v3f s ASP 17 Cb 0.10 -2.02 -0.15 0.00 -1.46 0.00 0.00 42.92 39.39 1v3f s ASP 17 CO 0.44 -0.44 0.25 1.07 0.52 0.00 0.00 175.17 177.00 1v3f n THR 18 N -1.97 0.00 0.00 1.71 5.66 -1.26 -3.39 114.28 115.03 1v3f n THR 18 Ca -0.02 -0.23 -0.00 0.00 -3.05 0.00 0.00 64.05 60.74 1v3f n THR 18 Cb 0.56 0.37 -0.00 0.00 -1.55 0.00 0.00 70.33 69.71 1v3f n THR 18 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 175.07 172.30 1v3f h SER 19 N 0.00 -0.02 0.02 1.09 0.02 -1.91 -3.39 113.55 109.36 1v3f h SER 19 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1v3f h SER 19 Cb 0.43 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.97 1v3f h SER 19 CO 0.00 0.02 -0.29 0.35 -1.14 0.00 0.00 176.83 175.77 1v3f n THR 20 N -2.25 0.00 -1.33 -2.27 -2.24 -1.26 -4.94 114.28 99.99 1v3f n THR 20 Ca -0.00 -0.29 0.00 0.00 -2.27 0.00 0.00 64.05 61.48 1v3f n THR 20 Cb 0.01 1.11 0.00 0.00 -2.10 0.00 0.00 70.33 69.34 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 1.37 -0.20 3.67 3.38 0.00 -1.20 -4.88 105.19 107.33 1v3f n GLY 21 Ca 0.12 -1.79 -0.30 0.00 0.00 0.00 0.00 46.02 44.05 1v3f n GLY 21 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1v3f s ILE 22 N -0.20 1.65 -0.37 -0.61 2.07 -1.22 -4.78 121.20 117.75 1v3f s ILE 22 Ca 0.00 0.00 0.03 0.00 -1.41 0.00 0.00 60.65 59.27 1v3f s ILE 22 Cb 0.00 -2.62 0.16 0.00 0.13 0.00 0.00 42.46 40.12 1v3f s ILE 22 CO 0.00 0.00 0.39 -0.13 -1.91 0.00 0.00 174.94 173.29 1v3f s ARG 23 N -5.60 0.63 0.09 3.50 0.52 -1.26 -4.55 118.95 112.28 1v3f s ARG 23 Ca 0.73 -0.75 -0.30 0.00 -0.52 0.00 0.00 55.73 54.89 1v3f s ARG 23 Cb -0.07 -0.64 -0.06 0.00 0.52 0.00 0.00 34.95 34.70 1v3f s ARG 23 CO 0.55 -1.18 1.15 -1.25 0.02 0.00 0.00 175.30 174.59 1v3f s PRO 24 N 1.54 4.49 0.28 3.54 0.04 -1.26 -4.83 135.00 138.80 1v3f s PRO 24 Ca 0.16 1.73 0.10 0.00 0.04 0.00 0.00 61.00 63.02 1v3f s PRO 24 Cb -0.14 -3.34 -0.04 0.00 0.04 0.00 0.00 34.50 31.02 1v3f s PRO 24 CO -0.06 -0.14 -0.00 -1.12 0.04 0.00 0.00 177.00 175.71 1v3f s SER 25 N 0.72 4.47 -0.08 6.66 0.01 0.51 -4.51 113.70 121.48 1v3f s SER 25 Ca 0.55 -0.70 -0.23 0.00 1.31 0.00 0.00 55.95 56.88 1v3f s SER 25 Cb -0.29 -0.79 -0.19 0.00 0.21 0.00 0.00 66.02 64.97 1v3f s SER 25 CO 0.31 -0.03 0.86 1.55 0.41 0.00 0.00 173.24 176.34 1v3f h PRO 26 N 1.88 -0.08 -6.24 12.44 0.13 -1.80 -3.30 132.00 135.03 1v3f h PRO 26 Ca -0.44 0.01 -0.10 0.00 -0.87 0.00 0.00 66.00 64.60 1v3f h PRO 26 Cb 1.25 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.40 1v3f h PRO 26 CO 0.61 0.52 -1.03 0.09 -0.23 0.00 0.00 178.00 177.95 1v3f n ASN 27 N -4.79 -6.52 -4.63 1.44 4.13 -1.26 -3.67 115.26 99.95 1v3f n ASN 27 Ca -0.08 0.38 -0.60 0.00 1.68 0.00 0.00 54.58 55.97 1v3f n ASN 27 Cb 0.31 -2.17 -0.08 0.00 -1.54 0.00 0.00 39.78 36.30 1v3f n ASN 27 CO 0.00 0.00 0.00 0.80 0.28 0.00 0.00 177.26 178.34 1v3f n MET 28 N 0.80 0.47 -3.95 3.52 0.00 -1.26 -4.51 117.12 112.19 1v3f n MET 28 Ca -0.02 0.17 -0.27 0.00 -0.00 0.00 0.00 57.70 57.59 1v3f n MET 28 Cb 0.49 -1.74 -0.17 0.00 0.00 0.00 0.00 33.22 31.80 1v3f n MET 28 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 175.97 173.97 1v3f s GLU 29 N 1.68 1.56 -1.33 2.12 2.56 -1.23 -4.83 118.70 119.22 1v3f s GLU 29 Ca 0.95 -0.27 -0.18 0.00 0.00 0.00 0.00 54.97 55.47 1v3f s GLU 29 Cb -1.23 -1.59 0.02 0.00 2.00 0.00 0.00 34.13 33.34 1v3f s GLU 29 CO 0.64 -0.25 0.34 0.00 -0.56 0.00 0.00 175.26 175.43 1v3f n GLN 30 N 4.87 -0.56 0.00 4.30 10.64 -1.26 -2.05 117.38 133.31 1v3f n GLN 30 Ca -0.13 0.06 0.00 0.00 -1.83 0.00 0.00 57.00 55.10 1v3f n GLN 30 Cb 0.50 -2.87 0.00 0.00 -0.86 0.00 0.00 30.24 27.01 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 -2.30 1.43 3.53 2.61 0.00 -1.26 -4.83 105.19 104.36 1v3f n GLY 31 Ca -0.21 -0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.41 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 2.83 1.92 -4.64 1.61 7.64 -0.87 -4.87 113.62 117.24 1v3f n SER 32 Ca 0.00 -0.19 -0.43 0.00 1.01 0.00 0.00 58.87 59.26 1v3f n SER 32 Cb 0.00 -1.40 -0.02 0.00 -1.01 0.00 0.00 64.21 61.78 1v3f n SER 32 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1v3f s THR 33 N 10.64 4.37 -0.84 0.44 2.01 -1.26 -3.55 115.64 127.46 1v3f s THR 33 Ca 1.08 1.57 -0.23 0.00 0.31 0.00 0.00 61.69 64.42 1v3f s THR 33 Cb -0.51 -4.33 0.06 0.00 0.01 0.00 0.00 72.50 67.73 1v3f s THR 33 CO 0.35 -0.49 1.23 -0.31 -0.69 0.00 0.00 174.62 174.71 1v3f s TYR 34 N 3.89 2.60 0.35 4.92 1.51 -1.24 -4.97 117.35 124.41 1v3f s TYR 34 Ca 0.49 -0.65 -0.19 0.00 -1.01 0.00 0.00 57.07 55.71 1v3f s TYR 34 Cb -0.14 -4.51 -0.10 0.00 -0.11 0.00 0.00 41.96 37.10 1v3f s TYR 34 CO 0.18 -1.83 0.84 0.15 -1.11 0.00 0.00 175.55 173.78 1v3f s LYS 35 N 4.58 4.20 -0.75 -0.62 1.02 -1.26 -4.12 119.74 122.79 1v3f s LYS 35 Ca 0.35 0.95 -0.02 0.00 0.02 0.00 0.00 55.97 57.27 1v3f s LYS 35 Cb -0.07 -2.45 -0.02 0.00 -0.52 0.00 0.00 37.83 34.77 1v3f s LYS 35 CO 0.02 0.14 0.64 1.63 -0.92 0.00 0.00 175.35 176.85 1v3f n LYS 36 N -0.19 -2.93 -3.79 1.68 5.02 -1.26 -5.00 118.16 111.69 1v3f n LYS 36 Ca 0.04 0.57 -0.12 0.00 -2.02 0.00 0.00 58.31 56.78 1v3f n LYS 36 Cb 0.53 -4.56 -0.09 0.00 -0.02 0.00 0.00 35.03 30.89 1v3f n LYS 36 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1v3f s THR 37 N -3.25 0.07 -0.04 -0.18 -4.23 -1.24 -4.56 115.64 102.21 1v3f s THR 37 Ca 0.15 -0.60 0.02 0.00 -1.18 0.00 0.00 61.69 60.08 1v3f s THR 37 Cb -0.02 -0.67 0.01 0.00 1.34 0.00 0.00 72.50 73.15 1v3f s THR 37 CO 0.49 -0.33 -0.08 0.72 -0.54 0.00 0.00 174.62 174.88 1v3f s PHE 38 N -1.70 0.94 0.61 3.99 -0.12 -0.24 0.19 117.98 121.66 1v3f s PHE 38 Ca -0.11 -0.26 -0.18 0.00 -0.05 0.00 0.00 56.93 56.33 1v3f s PHE 38 Cb -0.04 -0.71 -0.07 0.00 -0.63 0.00 0.00 43.02 41.56 1v3f s PHE 38 CO 0.02 -0.14 0.58 1.28 -0.05 0.00 0.00 175.22 176.90 1v3f n LEU 39 N 3.55 1.17 -0.33 -1.99 4.77 -1.26 -1.47 117.00 121.44 1v3f n LEU 39 Ca -0.21 0.71 -0.02 0.00 -0.03 0.00 0.00 56.01 56.46 1v3f n LEU 39 Cb 0.53 -1.21 0.10 0.00 -2.33 0.00 0.00 43.42 40.51 1v3f n LEU 39 CO 0.24 -2.92 1.23 1.23 -1.33 0.00 0.00 177.39 175.85 1v3f h GLY 40 N 0.12 1.27 1.21 -0.72 0.00 0.21 -1.82 103.07 103.33 1v3f h GLY 40 Ca -0.46 -0.45 -0.09 0.00 0.00 0.00 0.00 47.33 46.34 1v3f h GLY 40 CO 0.46 0.40 -0.01 0.23 0.00 0.00 0.00 176.54 177.62 1v3f h SER 41 N 1.14 0.92 -0.58 0.19 0.87 -1.59 -2.48 113.55 112.03 1v3f h SER 41 Ca 0.34 -0.25 0.11 0.00 -1.23 0.00 0.00 61.79 60.76 1v3f h SER 41 Cb -0.05 -0.25 -0.09 0.00 -0.44 0.00 0.00 62.40 61.58 1v3f h SER 41 CO -0.10 0.99 0.09 0.77 -0.53 0.00 0.00 176.83 178.05 1v3f h SER 42 N 0.87 -0.07 0.75 6.23 4.64 -1.62 0.46 113.55 124.81 1v3f h SER 42 Ca 0.16 0.12 -0.04 0.00 -0.47 0.00 0.00 61.79 61.56 1v3f h SER 42 Cb 0.53 0.17 0.01 0.00 -0.31 0.00 0.00 62.40 62.80 1v3f h SER 42 CO 0.03 -0.02 -0.36 0.25 -0.87 0.00 0.00 176.83 175.86 1v3f h LEU 43 N 0.22 -0.86 -0.32 5.97 5.85 -1.25 0.31 115.31 125.23 1v3f h LEU 43 Ca 0.30 0.01 0.04 0.00 0.84 0.00 0.00 57.88 59.07 1v3f h LEU 43 Cb 0.45 0.22 -0.07 0.00 0.37 0.00 0.00 40.66 41.63 1v3f h LEU 43 CO -0.41 -0.55 -0.47 0.58 -0.34 0.00 0.00 178.44 177.25 1v3f h VAL 44 N -1.12 0.00 -0.51 1.05 2.07 -0.95 1.50 116.25 118.29 1v3f h VAL 44 Ca -0.10 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.52 1v3f h VAL 44 Cb 0.79 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.47 1v3f h VAL 44 CO 0.17 0.00 -0.07 -0.78 0.02 0.00 0.00 177.57 176.91 1v3f h ASP 45 N -0.35 -0.37 0.25 0.57 3.58 -0.09 0.15 116.42 120.15 1v3f h ASP 45 Ca 0.06 0.14 -0.01 0.00 0.42 0.00 0.00 57.03 57.64 1v3f h ASP 45 Cb 0.51 0.28 -0.01 0.00 1.72 0.00 0.00 39.33 41.82 1v3f h ASP 45 CO -0.49 -0.13 -0.26 -0.25 -2.88 0.00 0.00 179.24 175.24 1v3f h TRP 46 N 0.05 -0.72 -0.93 0.28 7.01 0.18 1.01 115.95 122.83 1v3f h TRP 46 Ca 0.25 0.01 0.22 0.00 2.11 0.00 0.00 58.89 61.48 1v3f h TRP 46 Cb 0.39 0.28 -0.18 0.00 -2.10 0.00 0.00 29.16 27.55 1v3f h TRP 46 CO -0.38 -0.34 -0.11 1.28 -2.79 0.00 0.00 178.44 176.09 1v3f n LEU 47 N -3.91 -0.23 0.33 0.65 4.77 0.49 0.22 117.00 119.32 1v3f n LEU 47 Ca -0.06 1.59 -0.16 0.00 -0.03 0.00 0.00 56.01 57.35 1v3f n LEU 47 Cb 0.23 -0.53 -0.08 0.00 -2.33 0.00 0.00 43.42 40.71 1v3f n LEU 47 CO 0.13 -1.57 0.55 0.40 -1.33 0.00 0.00 177.39 175.58 1v3f h ILE 48 N 0.00 0.31 -0.57 -0.08 2.04 0.10 0.27 117.51 119.58 1v3f h ILE 48 Ca 0.50 -0.20 0.16 0.00 1.00 0.00 0.00 64.86 66.32 1v3f h ILE 48 Cb 0.91 0.37 -0.02 0.00 -0.74 0.00 0.00 36.82 37.34 1v3f h ILE 48 CO -0.92 0.03 0.44 -1.28 0.00 0.00 0.00 178.15 176.42 1v3f h SER 49 N -1.00 0.00 1.05 1.72 0.87 0.63 1.48 113.55 118.31 1v3f h SER 49 Ca -0.09 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.47 1v3f h SER 49 Cb 0.69 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.65 1v3f h SER 49 CO 0.14 0.00 0.00 -1.20 -0.53 0.00 0.00 176.83 175.24 1v3f n SER 50 N -4.18 0.45 0.00 6.23 7.64 0.58 -4.87 113.62 119.47 1v3f n SER 50 Ca 0.11 0.56 0.00 0.00 1.01 0.00 0.00 58.87 60.55 1v3f n SER 50 Cb 0.67 -0.68 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 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 -1.95 -2.84 0.09 6.43 5.15 0.51 -4.92 115.26 117.73 1v3f n ASN 51 Ca 0.05 0.00 0.08 0.00 -0.60 0.00 0.00 54.58 54.11 1v3f n ASN 51 Cb 0.33 -0.47 -0.02 0.00 -0.53 0.00 0.00 39.78 39.08 1v3f n ASN 51 CO 0.00 0.00 0.00 -0.26 1.40 0.00 0.00 177.26 178.40 1v3f h PHE 52 N 0.00 0.00 -3.67 1.20 0.04 -0.60 -3.47 116.94 110.43 1v3f h PHE 52 Ca 0.00 0.00 -0.26 0.00 2.80 0.00 0.00 57.97 60.51 1v3f h PHE 52 Cb 0.00 0.00 -0.15 0.00 2.20 0.00 0.00 35.95 38.00 1v3f h PHE 52 CO 0.00 0.19 -0.70 0.00 -0.60 0.00 0.00 178.31 177.20 1v3f s ALA 53 N -3.22 1.18 -0.20 2.45 0.00 -1.15 -4.86 121.76 115.96 1v3f s ALA 53 Ca -0.01 -1.43 0.09 0.00 0.00 0.00 0.00 51.96 50.61 1v3f s ALA 53 Cb 0.09 0.18 -0.18 0.00 0.00 0.00 0.00 23.12 23.20 1v3f s ALA 53 CO 0.79 -0.20 -0.07 0.00 0.00 0.00 0.00 175.76 176.28 1v3f n ALA 54 N -0.12 1.53 -2.41 0.00 0.00 -1.26 -4.50 120.51 113.75 1v3f n ALA 54 Ca -0.11 -1.08 -0.08 0.00 0.00 0.00 0.00 53.44 52.17 1v3f n ALA 54 Cb 0.61 -0.08 -0.10 0.00 0.00 0.00 0.00 19.45 19.88 1v3f n ALA 54 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1v3f s SER 55 N -5.71 0.46 0.50 0.00 1.04 -1.26 -5.00 113.70 103.73 1v3f s SER 55 Ca -0.20 -0.82 0.45 0.00 0.48 0.00 0.00 55.95 55.86 1v3f s SER 55 Cb 0.07 0.15 1.58 0.00 0.10 0.00 0.00 66.02 67.92 1v3f s SER 55 CO 0.63 -0.48 1.43 0.54 0.98 0.00 0.00 173.24 176.34 1v3f n ARG 56 N 0.64 -0.00 0.12 4.02 3.00 -1.26 0.22 116.66 123.39 1v3f n ARG 56 Ca -0.17 1.01 -0.05 0.00 -0.01 0.00 0.00 57.85 58.63 1v3f n ARG 56 Cb 0.59 -2.30 -0.02 0.00 0.00 0.00 0.00 32.46 30.73 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 -0.26 -1.01 0.55 7.12 -1.98 0.41 115.31 120.14 1v3f h LEU 57 Ca 0.86 0.01 0.37 0.00 0.13 0.00 0.00 57.88 59.25 1v3f h LEU 57 Cb 3.41 0.07 -0.16 0.00 -0.53 0.00 0.00 40.66 43.44 1v3f h LEU 57 CO -0.05 -0.15 0.56 -0.33 -0.13 0.00 0.00 178.44 178.35 1v3f h GLU 58 N -0.37 0.16 -0.16 1.25 5.08 -0.62 1.19 114.58 121.10 1v3f h GLU 58 Ca -0.03 -0.01 -0.07 0.00 -1.00 0.00 0.00 59.36 58.25 1v3f h GLU 58 Cb 0.23 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.44 1v3f h GLU 58 CO 0.05 0.10 -0.16 0.00 -1.00 0.00 0.00 179.01 178.01 1v3f h ALA 59 N 1.92 0.24 -0.61 3.43 0.00 -1.24 -0.42 119.26 122.58 1v3f h ALA 59 Ca 0.79 -0.33 0.10 0.00 0.00 0.00 0.00 54.91 55.48 1v3f h ALA 59 Cb 1.98 -0.05 -0.08 0.00 0.00 0.00 0.00 17.79 19.64 1v3f h ALA 59 CO -0.68 0.13 0.20 0.28 0.00 0.00 0.00 179.25 179.18 1v3f h VAL 60 N 0.04 0.72 -0.46 0.00 2.07 0.58 0.73 116.25 119.94 1v3f h VAL 60 Ca 0.03 -0.12 -0.07 0.00 0.82 0.00 0.00 66.70 67.35 1v3f h VAL 60 Cb 0.69 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 30.78 1v3f h VAL 60 CO 0.04 0.07 0.01 0.74 0.02 0.00 0.00 177.57 178.44 1v3f h THR 61 N 0.36 1.26 -0.70 2.57 2.02 -0.60 -1.86 112.91 115.95 1v3f h THR 61 Ca 0.31 -1.04 -0.02 0.00 0.77 0.00 0.00 66.41 66.43 1v3f h THR 61 Cb 0.42 1.02 -0.03 0.00 -1.74 0.00 0.00 68.15 67.82 1v3f h THR 61 CO -0.34 0.36 0.36 -0.07 0.37 0.00 0.00 175.52 176.20 1v3f h LEU 62 N 0.66 0.88 0.89 2.58 4.07 0.43 -0.64 115.31 124.18 1v3f h LEU 62 Ca 0.13 -0.08 -0.04 0.00 0.08 0.00 0.00 57.88 57.96 1v3f h LEU 62 Cb 0.49 -0.22 0.01 0.00 1.08 0.00 0.00 40.66 42.02 1v3f h LEU 62 CO 0.02 0.73 -0.43 0.00 -1.08 0.00 0.00 178.44 177.68 1v3f h ALA 63 N 1.41 -1.28 -0.95 1.53 0.00 0.75 -1.37 119.26 119.35 1v3f h ALA 63 Ca 0.25 -0.26 0.21 0.00 0.00 0.00 0.00 54.91 55.11 1v3f h ALA 63 Cb 0.06 0.46 -0.12 0.00 0.00 0.00 0.00 17.79 18.20 1v3f h ALA 63 CO -0.04 -1.19 0.51 0.66 0.00 0.00 0.00 179.25 179.20 1v3f h SER 64 N -1.24 0.57 -0.31 0.00 4.64 -1.17 0.13 113.55 116.17 1v3f h SER 64 Ca -0.12 0.13 0.04 0.00 -0.47 0.00 0.00 61.79 61.37 1v3f h SER 64 Cb 0.92 0.04 -0.04 0.00 -0.31 0.00 0.00 62.40 63.01 1v3f h SER 64 CO 0.20 0.12 0.07 0.24 -0.87 0.00 0.00 176.83 176.59 1v3f h MET 65 N 0.57 0.18 -0.41 4.77 2.07 -0.81 0.94 114.93 122.24 1v3f h MET 65 Ca 0.58 -0.01 0.00 0.00 -2.07 0.00 0.00 59.70 58.20 1v3f h MET 65 Cb 1.03 -0.04 -0.02 0.00 -1.87 0.00 0.00 31.60 30.70 1v3f h MET 65 CO -0.46 0.12 0.27 -0.07 1.07 0.00 0.00 176.91 177.84 1v3f h LEU 66 N 0.19 0.47 -0.93 1.22 3.38 0.33 -0.44 115.31 119.52 1v3f h LEU 66 Ca 0.14 -0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.17 1v3f h LEU 66 Cb 0.15 -0.12 -0.07 0.00 0.09 0.00 0.00 40.66 40.71 1v3f h LEU 66 CO -0.18 0.34 0.59 0.24 0.09 0.00 0.00 178.44 179.52 1v3f h MET 67 N 0.55 1.03 -0.36 1.13 2.86 -0.48 0.17 114.93 119.84 1v3f h MET 67 Ca 0.15 -0.06 -0.04 0.00 -2.06 0.00 0.00 59.70 57.68 1v3f h MET 67 Cb -0.06 -0.23 -0.01 0.00 0.06 0.00 0.00 31.60 31.35 1v3f h MET 67 CO -0.03 0.68 0.06 0.93 1.06 0.00 0.00 176.91 179.61 1v3f h GLU 68 N 1.07 0.60 0.00 1.72 4.39 -0.16 -1.67 114.58 120.53 1v3f h GLU 68 Ca 0.41 -0.16 0.00 0.00 0.34 0.00 0.00 59.36 59.95 1v3f h GLU 68 Cb 0.18 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 28.76 1v3f h GLU 68 CO -0.18 0.67 0.00 0.39 -1.16 0.00 0.00 179.01 178.73 1v3f n GLU 69 N -4.56 0.04 -0.89 2.33 -0.58 -0.24 -4.77 120.64 111.98 1v3f n GLU 69 Ca -0.01 0.50 0.00 0.00 -0.42 0.00 0.00 57.16 57.23 1v3f n GLU 69 Cb 0.22 -1.63 0.00 0.00 -0.57 0.00 0.00 31.44 29.47 1v3f n GLU 69 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 1v3f n ASN 70 N -1.72 -1.54 0.09 1.62 2.85 -0.63 -4.95 115.26 110.99 1v3f n ASN 70 Ca 0.00 0.00 0.11 0.00 -0.11 0.00 0.00 54.58 54.59 1v3f n ASN 70 Cb 0.04 -0.33 -0.02 0.00 1.24 0.00 0.00 39.78 40.71 1v3f n ASN 70 CO 0.00 0.00 0.00 0.49 -2.11 0.00 0.00 177.26 175.64 1v3f n PHE 71 N -2.77 0.85 -3.93 1.20 3.72 0.53 -3.92 117.46 113.14 1v3f n PHE 71 Ca 0.00 0.25 -0.10 0.00 -0.05 0.00 0.00 57.45 57.55 1v3f n PHE 71 Cb 0.11 -0.91 -0.02 0.00 -0.94 0.00 0.00 39.48 37.72 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 -5.26 0.25 0.01 4.37 2.34 -1.20 -1.90 118.68 117.28 1v3f s LEU 72 Ca -0.02 -1.03 -0.19 0.00 0.06 0.00 0.00 54.13 52.95 1v3f s LEU 72 Cb 0.10 2.21 0.04 0.00 -0.56 0.00 0.00 46.19 47.98 1v3f s LEU 72 CO 0.81 -1.37 0.42 0.00 -1.06 0.00 0.00 176.35 175.15 1v3f s ARG 73 N -3.34 0.86 -0.46 1.48 3.03 0.16 -4.17 118.95 116.51 1v3f s ARG 73 Ca 0.20 -0.20 -0.28 0.00 2.03 0.00 0.00 55.73 57.47 1v3f s ARG 73 Cb -0.03 0.39 0.01 0.00 -1.03 0.00 0.00 34.95 34.29 1v3f s ARG 73 CO 0.11 -0.27 1.44 -1.25 -1.13 0.00 0.00 175.30 174.20 1v3f s PRO 74 N -1.88 3.45 0.31 3.89 0.04 -1.26 -1.54 135.00 138.01 1v3f s PRO 74 Ca -0.09 0.80 -0.29 0.00 0.04 0.00 0.00 61.00 61.46 1v3f s PRO 74 Cb -0.02 -4.07 -0.10 0.00 0.04 0.00 0.00 34.50 30.35 1v3f s PRO 74 CO 0.02 -1.73 1.28 0.08 0.04 0.00 0.00 177.00 176.69 1v3f s VAL 75 N 5.79 2.90 0.00 -0.36 1.01 -1.07 -4.38 120.40 124.29 1v3f s VAL 75 Ca 0.59 0.88 0.00 0.00 0.00 0.00 0.00 61.98 63.46 1v3f s VAL 75 Cb -0.13 -3.56 0.00 0.00 0.00 0.00 0.00 36.38 32.69 1v3f s VAL 75 CO 0.30 0.20 0.00 0.61 0.00 0.00 0.00 175.10 176.21 1v3f n GLY 76 N 1.09 -3.33 4.93 4.51 0.00 -1.26 -3.38 105.19 107.74 1v3f n GLY 76 Ca 0.01 -1.18 0.00 0.00 0.00 0.00 0.00 46.02 44.85 1v3f n GLY 76 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1v3f n VAL 77 N -0.88 0.00 0.00 1.61 3.14 -1.26 -4.14 118.33 116.80 1v3f n VAL 77 Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 1v3f n VAL 77 Cb 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.78 1v3f n VAL 77 CO 0.00 0.00 0.00 -1.14 -6.46 0.00 0.00 176.83 169.23 1v3f n ARG 78 N 0.00 0.00 0.00 1.45 3.00 -1.26 -5.08 116.66 114.78 1v3f n ARG 78 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 1v3f n ARG 78 Cb 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 32.46 32.44 1v3f n ARG 78 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06 1v3f n SER 79 N -1.62 0.00 -1.42 6.15 7.64 -1.22 -4.92 113.62 118.23 1v3f n SER 79 Ca 0.00 0.00 0.19 0.00 1.01 0.00 0.00 58.87 60.07 1v3f n SER 79 Cb 0.00 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.15 1v3f n SER 79 CO 0.00 0.00 0.00 0.23 -3.01 0.00 0.00 175.04 172.26 1v3f n MET 80 N 0.00 -2.92 0.00 1.43 2.81 -1.26 -4.73 117.12 112.44 1v3f n MET 80 Ca 0.00 2.02 0.00 0.00 -1.81 0.00 0.00 57.70 57.91 1v3f n MET 80 Cb 0.00 -3.54 0.00 0.00 -0.71 0.00 0.00 33.22 28.97 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 -4.21 1.30 0.06 3.03 0.00 -1.26 -4.77 105.19 99.34 1v3f n GLY 81 Ca -0.01 -0.37 -0.03 0.00 0.00 0.00 0.00 46.02 45.61 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 0.00 1.94 -1.51 4.61 0.00 -1.26 -5.10 120.51 119.19 1v3f n ALA 82 Ca 0.00 -0.92 0.08 0.00 0.00 0.00 0.00 53.44 52.60 1v3f n ALA 82 Cb 0.00 -0.29 -0.04 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 -2.48 -1.93 -2.71 0.00 2.08 -1.26 -4.94 119.36 108.12 1v3f n ILE 83 Ca -0.20 1.18 -0.02 0.00 0.56 0.00 0.00 62.75 64.27 1v3f n ILE 83 Cb 0.87 -1.90 0.11 0.00 -0.75 0.00 0.00 39.64 37.98 1v3f n ILE 83 CO 0.00 0.00 0.00 0.54 0.56 0.00 0.00 176.55 177.65 1v3f n ARG 84 N -3.40 1.43 -2.54 0.38 3.00 -1.26 -5.04 116.66 109.23 1v3f n ARG 84 Ca -0.04 -1.78 -0.43 0.00 -0.01 0.00 0.00 57.85 55.59 1v3f n ARG 84 Cb 0.56 -0.07 0.00 0.00 0.00 0.00 0.00 32.46 32.95 1v3f n ARG 84 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06 1v3f n SER 85 N -1.27 4.88 0.04 0.55 7.64 -1.26 -3.72 113.62 120.47 1v3f n SER 85 Ca -0.11 -2.92 0.00 0.00 1.01 0.00 0.00 58.87 56.84 1v3f n SER 85 Cb 0.86 -1.71 0.00 0.00 -1.01 0.00 0.00 64.21 62.35 1v3f n SER 85 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1v3f n GLY 86 N 5.05 -0.88 3.08 0.23 0.00 -1.26 -4.99 105.19 106.42 1v3f n GLY 86 Ca 0.47 0.28 -0.23 0.00 0.00 0.00 0.00 46.02 46.55 1v3f n GLY 86 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1v3f n ASP 87 N -2.64 0.12 0.04 1.61 8.00 -1.24 -4.90 116.55 117.54 1v3f n ASP 87 Ca 0.00 -1.41 0.06 0.00 0.71 0.00 0.00 54.79 54.16 1v3f n ASP 87 Cb 0.00 -0.80 0.29 0.00 -0.02 0.00 0.00 41.12 40.59 1v3f n ASP 87 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 1v3f n LEU 88 N 0.00 0.19 -3.94 0.64 -0.00 -1.26 -4.81 117.00 107.82 1v3f n LEU 88 Ca 0.13 0.56 -0.37 0.00 -0.00 0.00 0.00 56.01 56.33 1v3f n LEU 88 Cb 0.46 -0.56 0.00 0.00 -0.00 0.00 0.00 43.42 43.33 1v3f n LEU 88 CO 0.33 -0.47 -0.48 0.00 -0.00 0.00 0.00 177.39 176.77 1v3f n ALA 89 N -1.58 -2.90 -2.34 1.96 0.00 -1.26 -4.88 120.51 109.50 1v3f n ALA 89 Ca 0.02 0.04 -0.25 0.00 0.00 0.00 0.00 53.44 53.25 1v3f n ALA 89 Cb 0.12 -1.33 0.01 0.00 0.00 0.00 0.00 19.45 18.24 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 1.30 3.40 -1.51 0.00 1.02 -1.26 -4.89 120.64 118.70 1v3f n GLU 90 Ca 0.09 -4.35 -0.41 0.00 -0.02 0.00 0.00 57.16 52.47 1v3f n GLU 90 Cb 0.40 -2.22 -0.08 0.00 -0.02 0.00 0.00 31.44 29.52 1v3f n GLU 90 CO 0.00 0.00 0.00 0.94 1.18 0.00 0.00 177.13 179.25 1v3f n GLN 91 N -0.55 0.76 -3.65 3.49 0.00 -1.26 -4.79 117.38 111.38 1v3f n GLN 91 Ca 0.39 0.08 -0.01 0.00 -0.00 0.00 0.00 57.00 57.46 1v3f n GLN 91 Cb 0.77 -2.63 -0.07 0.00 0.00 0.00 0.00 30.24 28.32 1v3f n GLN 91 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.06 177.18 1v3f s PHE 92 N 10.04 -0.16 0.37 3.69 2.19 -1.26 -4.65 117.98 128.20 1v3f s PHE 92 Ca 1.12 0.34 0.07 0.00 0.33 0.00 0.00 56.93 58.79 1v3f s PHE 92 Cb -0.66 0.25 -0.02 0.00 -1.31 0.00 0.00 43.02 41.28 1v3f s PHE 92 CO 0.39 -0.08 0.36 -0.51 1.83 0.00 0.00 175.22 177.21 1v3f s LEU 93 N 0.67 3.58 -0.53 6.12 1.43 -1.26 -5.01 118.68 123.68 1v3f s LEU 93 Ca -0.02 -0.54 0.07 0.00 -1.03 0.00 0.00 54.13 52.61 1v3f s LEU 93 Cb -0.04 -2.26 0.28 0.00 0.03 0.00 0.00 46.19 44.21 1v3f s LEU 93 CO -0.12 -0.49 0.72 -0.67 0.23 0.00 0.00 176.35 176.02 1v3f n ASP 94 N -1.50 2.57 -4.02 2.29 2.03 -1.26 -4.44 116.55 112.22 1v3f n ASP 94 Ca 0.01 -3.23 -0.10 0.00 0.52 0.00 0.00 54.79 51.99 1v3f n ASP 94 Cb 0.60 -0.64 -0.08 0.00 -0.72 0.00 0.00 41.12 40.29 1v3f n ASP 94 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1v3f s ASP 95 N -2.30 0.12 0.05 1.67 -1.08 -1.26 -4.59 116.67 109.28 1v3f s ASP 95 Ca 0.40 -0.99 -0.34 0.00 -0.52 0.00 0.00 52.55 51.11 1v3f s ASP 95 Cb 0.20 0.40 -0.19 0.00 -1.46 0.00 0.00 42.92 41.87 1v3f s ASP 95 CO -0.07 -0.85 1.51 0.28 0.52 0.00 0.00 175.17 176.56 1v3f h SER 96 N 2.63 -0.91 0.00 -0.34 0.02 -1.95 -2.01 113.55 110.99 1v3f h SER 96 Ca -0.33 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.65 1v3f h SER 96 Cb 1.22 0.24 0.00 0.00 0.14 0.00 0.00 62.40 64.00 1v3f h SER 96 CO 0.51 -0.62 0.00 0.35 -1.14 0.00 0.00 176.83 175.93 1v3f n THR 97 N -5.53 0.00 -1.52 -2.27 -2.24 -1.26 -4.12 114.28 97.33 1v3f n THR 97 Ca -0.15 1.34 -0.58 0.00 -2.27 0.00 0.00 64.05 62.40 1v3f n THR 97 Cb 0.43 -1.81 -0.08 0.00 -2.10 0.00 0.00 70.33 66.77 1v3f n THR 97 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1v3f n ALA 98 N -2.68 -3.12 -2.65 6.98 0.00 -1.23 -4.74 120.51 113.06 1v3f n ALA 98 Ca 0.00 0.58 -0.29 0.00 0.00 0.00 0.00 53.44 53.73 1v3f n ALA 98 Cb 0.00 -1.82 -0.10 0.00 0.00 0.00 0.00 19.45 17.53 1v3f n ALA 98 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1v3f s LEU 99 N 0.21 2.70 -0.28 0.00 1.43 -1.26 0.18 118.68 121.66 1v3f s LEU 99 Ca 0.91 -1.45 -0.25 0.00 -1.03 0.00 0.00 54.13 52.31 1v3f s LEU 99 Cb -1.23 -0.84 0.09 0.00 0.03 0.00 0.00 46.19 44.24 1v3f s LEU 99 CO 0.56 -0.56 0.85 -0.31 0.23 0.00 0.00 176.35 177.12 1v3f s TYR 100 N -2.77 -0.66 0.44 0.29 2.02 -0.54 -2.59 117.35 113.54 1v3f s TYR 100 Ca 0.27 1.61 0.04 0.00 -0.37 0.00 0.00 57.07 58.61 1v3f s TYR 100 Cb 0.08 0.31 -0.04 0.00 -0.40 0.00 0.00 41.96 41.90 1v3f s TYR 100 CO 0.14 -0.32 0.03 -0.08 -1.57 0.00 0.00 175.55 173.75 1v3f s THR 101 N 0.33 1.37 0.06 -0.71 -1.32 -0.59 -1.08 115.64 113.71 1v3f s THR 101 Ca 0.01 -2.00 -0.25 0.00 -1.21 0.00 0.00 61.69 58.24 1v3f s THR 101 Cb -0.05 -2.57 -0.06 0.00 -1.51 0.00 0.00 72.50 68.32 1v3f s THR 101 CO -0.02 0.00 0.78 -0.36 -2.21 0.00 0.00 174.62 172.81 1v3f s PHE 102 N -2.93 3.75 -0.42 9.09 0.08 -1.26 0.39 117.98 126.68 1v3f s PHE 102 Ca 0.23 1.50 -0.29 0.00 0.12 0.00 0.00 56.93 58.49 1v3f s PHE 102 Cb 0.06 -2.83 0.02 0.00 -0.57 0.00 0.00 43.02 39.70 1v3f s PHE 102 CO 0.11 0.28 1.14 0.00 -0.10 0.00 0.00 175.22 176.66 1v3f s ALA 103 N -0.12 3.26 -0.31 5.36 0.00 -0.80 -4.75 121.76 124.40 1v3f s ALA 103 Ca 0.39 -0.31 -0.28 0.00 0.00 0.00 0.00 51.96 51.76 1v3f s ALA 103 Cb -0.21 -3.83 -0.04 0.00 0.00 0.00 0.00 23.12 19.05 1v3f s ALA 103 CO 0.24 -2.01 2.03 -1.83 0.00 0.00 0.00 175.76 174.19 1v3f s GLU 104 N 4.22 3.09 0.00 0.00 -1.05 -1.26 -4.51 118.70 119.19 1v3f s GLU 104 Ca 0.48 1.63 0.00 0.00 -0.15 0.00 0.00 54.97 56.93 1v3f s GLU 104 Cb -0.09 -4.32 0.00 0.00 -0.44 0.00 0.00 34.13 29.28 1v3f s GLU 104 CO 0.26 -2.14 0.00 -1.13 0.95 0.00 0.00 175.26 173.20 1v3f n SER 105 N 11.54 0.00 -4.20 0.83 3.41 -1.26 -5.11 113.62 118.82 1v3f n SER 105 Ca 0.27 0.00 -0.12 0.00 -0.26 0.00 0.00 58.87 58.76 1v3f n SER 105 Cb 0.47 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.32 1v3f n SER 105 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 1v3f s TYR 106 N 0.00 1.03 0.00 7.33 1.51 -1.26 -4.97 117.35 121.00 1v3f s TYR 106 Ca 0.00 -1.08 0.22 0.00 -1.01 0.00 0.00 57.07 55.20 1v3f s TYR 106 Cb 0.00 -0.59 0.36 0.00 -0.11 0.00 0.00 41.96 41.62 1v3f s TYR 106 CO 0.00 -0.31 1.14 0.36 -1.11 0.00 0.00 175.55 175.64 1v3f n LYS 107 N -0.16 0.00 -2.00 -0.62 0.00 -1.26 -4.99 118.16 109.14 1v3f n LYS 107 Ca -0.07 -1.85 -0.03 0.00 -0.00 0.00 0.00 58.31 56.36 1v3f n LYS 107 Cb 0.63 0.07 0.02 0.00 -0.00 0.00 0.00 35.03 35.74 1v3f n LYS 107 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 1v3f n LYS 108 N 0.42 -0.76 -3.16 -1.58 3.00 -1.26 -4.37 118.16 110.46 1v3f n LYS 108 Ca 0.01 0.18 -0.20 0.00 -0.00 0.00 0.00 58.31 58.30 1v3f n LYS 108 Cb 1.08 -2.65 0.02 0.00 0.00 0.00 0.00 35.03 33.48 1v3f n LYS 108 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 1v3f n LYS 109 N -1.79 -1.08 -1.42 1.64 5.02 -1.26 -4.61 118.16 114.66 1v3f n LYS 109 Ca -0.03 1.03 -0.42 0.00 -2.02 0.00 0.00 58.31 56.88 1v3f n LYS 109 Cb 0.53 -1.41 -0.04 0.00 -0.02 0.00 0.00 35.03 34.09 1v3f n LYS 109 CO 0.00 0.00 0.00 1.55 -0.52 0.00 0.00 177.40 178.43 1v3f n VAL 110 N 0.46 2.30 -3.74 -0.18 3.14 -1.26 -4.80 118.33 114.26 1v3f n VAL 110 Ca -0.05 -2.06 -0.16 0.00 -2.96 0.00 0.00 64.34 59.11 1v3f n VAL 110 Cb 0.56 -2.38 -0.16 0.00 -1.06 0.00 0.00 33.84 30.79 1v3f n VAL 110 CO 0.00 0.00 0.00 -0.55 -6.46 0.00 0.00 176.83 169.82 1v3f s SER 111 N 4.65 0.33 -0.34 6.55 0.15 -1.26 -4.65 113.70 119.12 1v3f s SER 111 Ca 0.56 0.11 -0.41 0.00 0.70 0.00 0.00 55.95 56.91 1v3f s SER 111 Cb 0.13 -0.02 -0.16 0.00 -1.71 0.00 0.00 66.02 64.26 1v3f s SER 111 CO 0.07 -0.17 1.83 -0.24 1.20 0.00 0.00 173.24 175.93 1v3f n SER 112 N 4.52 2.03 -0.59 5.45 2.88 -1.26 -4.48 113.62 122.17 1v3f n SER 112 Ca -0.20 0.96 0.00 0.00 -1.33 0.00 0.00 58.87 58.30 1v3f n SER 112 Cb 0.50 -1.10 0.00 0.00 -0.75 0.00 0.00 64.21 62.87 1v3f n SER 112 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 1v3f n LYS 113 N 5.80 0.00 -2.88 -1.46 4.81 -1.26 -5.00 118.16 118.17 1v3f n LYS 113 Ca 0.32 0.00 -0.02 0.00 -0.87 0.00 0.00 58.31 57.74 1v3f n LYS 113 Cb 0.10 0.00 -0.01 0.00 0.02 0.00 0.00 35.03 35.13 1v3f n LYS 113 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 1v3f n GLU 114 N -1.18 -2.59 -3.06 1.64 2.13 -1.26 -5.03 120.64 111.29 1v3f n GLU 114 Ca 0.00 2.18 0.02 0.00 0.66 0.00 0.00 57.16 60.02 1v3f n GLU 114 Cb 0.00 -3.25 -0.00 0.00 0.27 0.00 0.00 31.44 28.46 1v3f n GLU 114 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 1v3f s SER 115 N -0.84 -1.11 0.00 4.31 0.15 -1.26 -4.84 113.70 110.11 1v3f s SER 115 Ca -0.08 -0.46 0.00 0.00 0.70 0.00 0.00 55.95 56.10 1v3f s SER 115 Cb 0.01 1.45 0.00 0.00 -1.71 0.00 0.00 66.02 65.76 1v3f s SER 115 CO 0.43 -0.13 0.00 0.61 1.20 0.00 0.00 173.24 175.35 1v3f n GLY 116 N 4.31 2.20 0.16 9.45 0.00 -1.26 -5.05 105.19 114.99 1v3f n GLY 116 Ca 0.09 0.32 -0.17 0.00 0.00 0.00 0.00 46.02 46.26 1v3f n GLY 116 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1v3f h PRO 117 N 0.00 0.48 -3.66 1.61 0.13 -2.00 -3.50 132.00 125.06 1v3f h PRO 117 Ca 0.00 -0.47 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1v3f h PRO 117 Cb 0.00 0.12 0.00 0.00 0.13 0.00 0.00 31.00 31.25 1v3f h PRO 117 CO 0.00 1.11 -0.86 0.45 -0.23 0.00 0.00 178.00 178.47 1v3f n SER 118 N -4.18 -8.63 -4.78 1.44 2.88 -1.26 -4.94 113.62 94.14 1v3f n SER 118 Ca -0.10 1.21 -0.36 0.00 -1.33 0.00 0.00 58.87 58.30 1v3f n SER 118 Cb 0.67 -4.48 -0.07 0.00 -0.75 0.00 0.00 64.21 59.58 1v3f n SER 118 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1v3f s SER 119 N -2.26 6.12 0.00 -3.46 0.01 -1.26 -5.19 113.70 107.67 1v3f s SER 119 Ca 0.00 0.32 0.00 0.00 1.31 0.00 0.00 55.95 57.58 1v3f s SER 119 Cb 0.00 -2.00 0.00 0.00 0.21 0.00 0.00 66.02 64.23 1v3f s SER 119 CO 0.00 0.31 0.07 0.61 0.41 0.00 0.00 173.24 174.64