#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v6f s SER 2 N 0.00 3.55 1.01 1.61 0.01 -1.26 -5.14 113.70 113.49 1v6f s SER 2 Ca 0.00 -1.14 -0.12 0.00 1.31 0.00 0.00 55.95 56.00 1v6f s SER 2 Cb 0.00 -0.31 0.20 0.00 0.21 0.00 0.00 66.02 66.12 1v6f s SER 2 CO 0.00 -0.15 1.08 -0.94 0.41 0.00 0.00 173.24 173.64 1v6f s SER 3 N -3.55 2.38 0.21 2.44 1.04 -1.26 -5.04 113.70 109.92 1v6f s SER 3 Ca 0.31 1.46 0.01 0.00 0.48 0.00 0.00 55.95 58.22 1v6f s SER 3 Cb 0.00 -2.15 -0.04 0.00 0.10 0.00 0.00 66.02 63.94 1v6f s SER 3 CO 0.15 -3.32 0.37 -0.83 0.98 0.00 0.00 173.24 170.59 1v6f s GLY 4 N -3.09 1.61 -0.28 7.32 0.00 -1.26 -5.09 107.32 106.53 1v6f s GLY 4 Ca 0.66 -0.97 -0.03 0.00 0.00 0.00 0.00 44.72 44.38 1v6f s GLY 4 CO 0.60 -0.95 -0.01 -1.35 0.00 0.00 0.00 173.10 171.39 1v6f s SER 5 N -3.43 4.71 0.07 1.64 1.04 -1.26 -5.10 113.70 111.37 1v6f s SER 5 Ca 0.37 -1.01 0.02 0.00 0.48 0.00 0.00 55.95 55.81 1v6f s SER 5 Cb -0.10 -1.73 -0.04 0.00 0.10 0.00 0.00 66.02 64.25 1v6f s SER 5 CO 0.30 -0.20 0.09 -0.94 0.98 0.00 0.00 173.24 173.47 1v6f s SER 6 N 1.33 5.63 -0.01 7.02 1.04 -1.26 -5.03 113.70 122.42 1v6f s SER 6 Ca -0.02 0.04 -0.00 0.00 0.48 0.00 0.00 55.95 56.45 1v6f s SER 6 Cb -0.18 -1.55 -0.01 0.00 0.10 0.00 0.00 66.02 64.38 1v6f s SER 6 CO -0.02 0.18 -0.01 0.61 0.98 0.00 0.00 173.24 174.98 1v6f n GLY 7 N 0.52 -0.02 3.79 7.32 0.00 -1.26 -5.08 105.19 110.46 1v6f n GLY 7 Ca -0.09 -0.01 -0.22 0.00 0.00 0.00 0.00 46.02 45.71 1v6f n GLY 7 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1v6f s SER 8 N -4.65 5.14 -0.54 1.61 1.04 -1.26 -5.09 113.70 109.94 1v6f s SER 8 Ca -0.02 -0.49 -0.06 0.00 0.48 0.00 0.00 55.95 55.86 1v6f s SER 8 Cb 0.01 -1.04 0.14 0.00 0.10 0.00 0.00 66.02 65.22 1v6f s SER 8 CO 0.03 -0.19 0.39 -0.70 0.98 0.00 0.00 173.24 173.74 1v6f s GLU 9 N -3.87 2.50 0.04 4.02 2.56 -1.26 -5.06 118.70 117.63 1v6f s GLU 9 Ca 0.36 -2.10 0.06 0.00 0.00 0.00 0.00 54.97 53.29 1v6f s GLU 9 Cb -0.06 -3.83 -0.02 0.00 2.00 0.00 0.00 34.13 32.22 1v6f s GLU 9 CO 0.24 -1.17 -0.17 -1.12 -0.56 0.00 0.00 175.26 172.48 1v6f s SER 10 N 1.76 2.04 0.01 -1.70 0.01 -1.26 -5.15 113.70 109.42 1v6f s SER 10 Ca 0.11 -0.47 0.02 0.00 1.31 0.00 0.00 55.95 56.92 1v6f s SER 10 Cb -0.22 -0.16 -0.04 0.00 0.21 0.00 0.00 66.02 65.81 1v6f s SER 10 CO -0.03 0.11 0.00 -0.76 0.41 0.00 0.00 173.24 172.97 1v6f s LEU 11 N -1.07 3.50 -0.41 2.44 1.43 -1.26 -4.99 118.68 118.33 1v6f s LEU 11 Ca 0.05 -0.02 -0.06 0.00 -1.03 0.00 0.00 54.13 53.06 1v6f s LEU 11 Cb -0.08 -2.03 0.09 0.00 0.03 0.00 0.00 46.19 44.20 1v6f s LEU 11 CO 0.01 0.27 0.22 -0.69 0.23 0.00 0.00 176.35 176.39 1v6f s VAL 12 N -1.11 3.80 0.02 -1.59 1.01 -1.26 -5.03 120.40 116.24 1v6f s VAL 12 Ca 0.20 -1.63 0.00 0.00 0.00 0.00 0.00 61.98 60.56 1v6f s VAL 12 Cb -0.12 -3.40 -0.04 0.00 0.00 0.00 0.00 36.38 32.82 1v6f s VAL 12 CO 0.11 -0.54 0.10 -0.69 0.00 0.00 0.00 175.10 174.08 1v6f s VAL 13 N 1.31 4.78 0.11 2.92 1.01 -1.26 -4.12 120.40 125.15 1v6f s VAL 13 Ca 0.04 -0.47 0.07 0.00 0.00 0.00 0.00 61.98 61.61 1v6f s VAL 13 Cb -0.23 -3.23 -0.04 0.00 0.00 0.00 0.00 36.38 32.89 1v6f s VAL 13 CO -0.00 0.28 -0.16 0.00 0.00 0.00 0.00 175.10 175.22 1v6f s ASP 15 N -2.18 6.27 -0.27 0.00 1.11 -1.26 -4.74 116.67 115.59 1v6f s ASP 15 Ca 0.07 0.89 -0.17 0.00 0.18 0.00 0.00 52.55 53.51 1v6f s ASP 15 Cb -0.07 -2.23 -0.03 0.00 1.07 0.00 0.00 42.92 41.66 1v6f s ASP 15 CO 0.04 -0.55 0.50 0.68 1.18 0.00 0.00 175.17 177.01 1v6f s VAL 16 N -2.71 5.08 0.41 -1.27 -7.23 -1.26 -0.25 120.40 113.17 1v6f s VAL 16 Ca 0.47 0.77 -0.27 0.00 -1.81 0.00 0.00 61.98 61.15 1v6f s VAL 16 Cb -0.10 -3.83 -0.09 0.00 0.56 0.00 0.00 36.38 32.92 1v6f s VAL 16 CO 0.44 0.06 1.43 0.00 -0.31 0.00 0.00 175.10 176.72 1v6f s ALA 17 N 2.29 3.37 0.20 1.32 0.00 -0.08 -4.77 121.76 124.09 1v6f s ALA 17 Ca 0.20 1.47 -0.11 0.00 0.00 0.00 0.00 51.96 53.52 1v6f s ALA 17 Cb -0.16 -3.58 0.23 0.00 0.00 0.00 0.00 23.12 19.62 1v6f s ALA 17 CO 0.10 -1.07 1.74 1.05 0.00 0.00 0.00 175.76 177.58 1v6f h GLU 18 N 2.66 0.36 -0.92 0.00 4.11 -1.96 0.49 114.58 119.32 1v6f h GLU 18 Ca -0.51 -0.02 0.26 0.00 0.07 0.00 0.00 59.36 59.16 1v6f h GLU 18 Cb 1.25 -0.08 -0.05 0.00 0.50 0.00 0.00 28.75 30.38 1v6f h GLU 18 CO 0.63 0.24 0.65 -0.44 0.07 0.00 0.00 179.01 180.15 1v6f h ASP 19 N 0.37 0.10 0.00 3.06 3.32 -1.96 -1.20 116.42 120.11 1v6f h ASP 19 Ca 0.28 0.01 -0.08 0.00 0.02 0.00 0.00 57.03 57.26 1v6f h ASP 19 Cb 0.33 -0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.86 1v6f h ASP 19 CO -0.29 0.03 -0.52 0.25 -1.72 0.00 0.00 179.24 176.99 1v6f h LEU 20 N 0.09 0.00 -0.71 1.55 5.85 -1.31 -3.37 115.31 117.40 1v6f h LEU 20 Ca 0.45 -0.53 0.13 0.00 0.84 0.00 0.00 57.88 58.78 1v6f h LEU 20 Cb 1.64 0.00 -0.13 0.00 0.37 0.00 0.00 40.66 42.53 1v6f h LEU 20 CO -0.05 1.06 -0.27 0.58 -0.34 0.00 0.00 178.44 179.42 1v6f h VAL 21 N -1.00 0.19 -0.94 1.05 2.07 -0.40 0.20 116.25 117.41 1v6f h VAL 21 Ca -0.12 0.00 0.28 0.00 0.82 0.00 0.00 66.70 67.68 1v6f h VAL 21 Cb 0.89 0.19 -0.16 0.00 -1.52 0.00 0.00 31.29 30.68 1v6f h VAL 21 CO -0.08 0.00 0.23 1.05 0.02 0.00 0.00 177.57 178.79 1v6f h GLU 22 N -0.07 0.10 0.30 1.57 4.11 -1.42 0.13 114.58 119.30 1v6f h GLU 22 Ca 0.31 -0.01 -0.01 0.00 0.07 0.00 0.00 59.36 59.72 1v6f h GLU 22 Cb 0.56 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.79 1v6f h GLU 22 CO -0.76 0.07 -0.14 0.87 0.07 0.00 0.00 179.01 179.11 1v6f h LYS 23 N 0.10 -0.39 -0.69 1.06 1.57 -0.78 -2.92 116.57 114.52 1v6f h LYS 23 Ca 0.63 0.03 0.13 0.00 -1.87 0.00 0.00 60.65 59.57 1v6f h LYS 23 Cb 1.38 0.09 -0.09 0.00 0.08 0.00 0.00 32.23 33.68 1v6f h LYS 23 CO -0.77 -0.10 0.22 -0.07 -0.57 0.00 0.00 179.45 178.15 1v6f h LEU 24 N -0.65 0.14 -0.59 2.94 3.38 -0.43 -0.60 115.31 119.49 1v6f h LEU 24 Ca -0.04 0.12 0.10 0.00 0.09 0.00 0.00 57.88 58.15 1v6f h LEU 24 Cb 0.46 0.13 -0.08 0.00 0.09 0.00 0.00 40.66 41.26 1v6f h LEU 24 CO 0.07 0.05 0.16 0.03 0.09 0.00 0.00 178.44 178.84 1v6f h ARG 25 N 0.35 0.30 -0.58 1.13 3.08 -0.82 -1.42 114.38 116.41 1v6f h ARG 25 Ca 0.38 -0.02 -0.05 0.00 0.07 0.00 0.00 59.98 60.36 1v6f h ARG 25 Cb 0.58 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.54 1v6f h ARG 25 CO -0.42 0.20 0.16 0.87 -1.07 0.00 0.00 179.97 179.71 1v6f h LYS 26 N 0.31 0.92 -0.89 0.04 1.79 -0.96 -3.01 116.57 114.77 1v6f h LYS 26 Ca 0.31 -0.21 0.19 0.00 -2.18 0.00 0.00 60.65 58.75 1v6f h LYS 26 Cb 0.43 -0.13 -0.17 0.00 -1.58 0.00 0.00 32.23 30.78 1v6f h LYS 26 CO -0.36 0.84 -0.18 0.35 -1.08 0.00 0.00 179.45 179.02 1v6f h PHE 27 N 0.83 -0.40 0.02 -1.35 3.04 -0.15 1.37 116.94 120.31 1v6f h PHE 27 Ca 0.19 0.08 -0.00 0.00 3.98 0.00 0.00 57.97 62.21 1v6f h PHE 27 Cb 0.32 0.32 0.00 0.00 2.56 0.00 0.00 35.95 39.15 1v6f h PHE 27 CO 0.02 -0.38 -0.01 0.00 -2.02 0.00 0.00 178.31 175.93 1v6f h ARG 28 N 0.01 -0.03 -1.14 1.11 2.47 -1.42 -2.99 114.38 112.39 1v6f h ARG 28 Ca 0.44 0.00 -0.50 0.00 -1.26 0.00 0.00 59.98 58.66 1v6f h ARG 28 Cb 0.71 0.01 -0.24 0.00 -1.65 0.00 0.00 29.97 28.80 1v6f h ARG 28 CO -0.90 0.20 0.65 1.19 0.56 0.00 0.00 179.97 181.67 1v6f n PHE 29 N -5.00 2.54 -2.42 3.04 3.72 0.22 -4.96 117.46 114.62 1v6f n PHE 29 Ca -0.08 -2.30 -0.42 0.00 -0.05 0.00 0.00 57.45 54.60 1v6f n PHE 29 Cb 0.14 -1.12 -0.03 0.00 -0.94 0.00 0.00 39.48 37.53 1v6f n PHE 29 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 176.76 175.73 1v6f s ARG 30 N -2.92 4.34 -0.32 -1.08 1.70 0.45 -4.91 118.95 116.21 1v6f s ARG 30 Ca 0.50 1.73 -0.01 0.00 -0.47 0.00 0.00 55.73 57.48 1v6f s ARG 30 Cb 0.40 -3.55 0.22 0.00 -0.57 0.00 0.00 34.95 31.45 1v6f s ARG 30 CO 0.02 -0.46 1.98 1.63 -1.08 0.00 0.00 175.30 177.39 1v6f n LYS 31 N 5.18 1.80 -4.67 3.89 4.76 -1.26 -4.89 118.16 122.97 1v6f n LYS 31 Ca 0.11 -1.58 -0.30 0.00 -2.87 0.00 0.00 58.31 53.67 1v6f n LYS 31 Cb 0.46 -1.62 -0.13 0.00 -1.84 0.00 0.00 35.03 31.89 1v6f n LYS 31 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 1v6f s GLU 32 N -1.83 1.80 -0.07 1.97 2.02 -1.26 -5.04 118.70 116.28 1v6f s GLU 32 Ca 0.31 -1.13 -0.09 0.00 0.02 0.00 0.00 54.97 54.08 1v6f s GLU 32 Cb 0.25 -2.04 -0.29 0.00 0.10 0.00 0.00 34.13 32.14 1v6f s GLU 32 CO -0.00 0.50 0.58 1.15 0.02 0.00 0.00 175.26 177.51 1v6f h THR 33 N 4.00 0.84 -2.98 3.63 2.02 -2.05 -3.47 112.91 114.90 1v6f h THR 33 Ca -0.48 -2.47 -0.37 0.00 0.77 0.00 0.00 66.41 63.86 1v6f h THR 33 Cb 1.15 2.68 0.22 0.00 -1.74 0.00 0.00 68.15 70.46 1v6f h THR 33 CO 0.44 0.87 -0.16 -1.38 0.37 0.00 0.00 175.52 175.66 1v6f s HIS 34 N -2.57 -0.97 0.73 3.16 0.00 -1.26 -5.03 115.29 109.34 1v6f s HIS 34 Ca -0.18 0.53 -0.04 0.00 -3.00 0.00 0.00 55.06 52.37 1v6f s HIS 34 Cb 0.06 -2.81 0.11 0.00 -4.00 0.00 0.00 32.58 25.94 1v6f s HIS 34 CO 0.83 -5.24 1.01 -0.80 -1.00 0.00 0.00 174.74 169.54 1v6f s ASN 35 N -3.12 4.39 0.16 7.38 -0.87 -1.26 -4.81 114.94 116.80 1v6f s ASN 35 Ca 0.68 -0.06 -0.20 0.00 -1.57 0.00 0.00 52.86 51.71 1v6f s ASN 35 Cb -0.12 -0.40 0.05 0.00 -0.02 0.00 0.00 41.25 40.76 1v6f s ASN 35 CO 0.57 -1.84 0.53 0.00 -2.57 0.00 0.00 177.10 173.80 1v6f s ALA 36 N -3.22 -1.30 -0.27 0.60 0.00 -1.26 0.89 121.76 117.20 1v6f s ALA 36 Ca 0.65 0.22 -0.06 0.00 0.00 0.00 0.00 51.96 52.76 1v6f s ALA 36 Cb -0.07 0.82 0.13 0.00 0.00 0.00 0.00 23.12 24.00 1v6f s ALA 36 CO 0.45 -0.74 0.55 0.00 0.00 0.00 0.00 175.76 176.02 1v6f s ALA 37 N -3.78 -1.75 -0.26 0.00 0.00 0.12 -3.09 121.76 112.99 1v6f s ALA 37 Ca 0.03 1.86 -0.08 0.00 0.00 0.00 0.00 51.96 53.77 1v6f s ALA 37 Cb -0.00 -1.73 -0.03 0.00 0.00 0.00 0.00 23.12 21.36 1v6f s ALA 37 CO -0.11 -1.00 0.09 0.42 0.00 0.00 0.00 175.76 175.16 1v6f s ILE 38 N 2.78 4.45 -0.06 0.00 1.01 -1.03 -0.05 121.20 128.30 1v6f s ILE 38 Ca 0.03 -0.17 -0.09 0.00 0.00 0.00 0.00 60.65 60.42 1v6f s ILE 38 Cb -0.13 -3.11 -0.05 0.00 0.01 0.00 0.00 42.46 39.19 1v6f s ILE 38 CO -0.17 0.30 0.24 -0.63 0.00 0.00 0.00 174.94 174.68 1v6f s ILE 39 N 1.63 5.33 -0.02 2.92 1.01 -1.08 -1.38 121.20 129.60 1v6f s ILE 39 Ca 0.06 0.39 0.01 0.00 0.00 0.00 0.00 60.65 61.11 1v6f s ILE 39 Cb -0.15 -3.53 0.01 0.00 0.01 0.00 0.00 42.46 38.80 1v6f s ILE 39 CO 0.05 0.56 -0.03 -0.04 0.00 0.00 0.00 174.94 175.48 1v6f s MET 40 N -1.18 0.48 0.41 2.79 -1.94 0.17 -1.80 119.30 118.22 1v6f s MET 40 Ca 0.20 -0.07 0.04 0.00 -1.71 0.00 0.00 55.69 54.15 1v6f s MET 40 Cb -0.14 -0.53 -0.05 0.00 2.01 0.00 0.00 34.83 36.12 1v6f s MET 40 CO 0.09 -0.03 0.05 -1.59 -0.01 0.00 0.00 175.02 173.53 1v6f s LYS 41 N 0.54 1.92 -0.05 2.03 0.00 -1.17 -2.15 119.74 120.85 1v6f s LYS 41 Ca -0.06 -2.14 0.05 0.00 0.00 0.00 0.00 55.97 53.83 1v6f s LYS 41 Cb -0.09 -1.17 -0.02 0.00 0.00 0.00 0.00 37.83 36.55 1v6f s LYS 41 CO -0.01 -0.25 -0.22 0.42 0.00 0.00 0.00 175.35 175.29 1v6f s ILE 42 N -3.03 2.39 0.66 3.79 1.01 -1.26 -2.83 121.20 121.93 1v6f s ILE 42 Ca 0.26 -0.96 -0.11 0.00 0.00 0.00 0.00 60.65 59.84 1v6f s ILE 42 Cb 0.06 -1.89 0.15 0.00 0.01 0.00 0.00 42.46 40.79 1v6f s ILE 42 CO 0.13 0.57 0.89 -0.67 0.00 0.00 0.00 174.94 175.86 1v6f n ASP 43 N 2.73 0.03 -0.02 3.58 2.03 -1.26 -5.02 116.55 118.63 1v6f n ASP 43 Ca -0.17 -1.32 0.06 0.00 0.52 0.00 0.00 54.79 53.88 1v6f n ASP 43 Cb 0.52 -0.68 -0.12 0.00 -0.72 0.00 0.00 41.12 40.12 1v6f n ASP 43 CO 0.00 0.00 0.00 2.29 -1.92 0.00 0.00 177.20 177.57 1v6f n LYS 44 N -2.91 0.65 -0.01 -0.67 0.00 -1.26 -4.44 118.16 109.52 1v6f n LYS 44 Ca 0.11 -0.12 -0.03 0.00 -0.00 0.00 0.00 58.31 58.27 1v6f n LYS 44 Cb 0.39 -1.37 -0.01 0.00 -0.00 0.00 0.00 35.03 34.04 1v6f n LYS 44 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 1v6f n ASP 45 N -2.11 0.35 0.17 -5.58 2.03 -1.26 -4.64 116.55 105.50 1v6f n ASP 45 Ca -0.06 0.05 0.10 0.00 0.52 0.00 0.00 54.79 55.40 1v6f n ASP 45 Cb 0.49 -0.13 0.54 0.00 -0.72 0.00 0.00 41.12 41.30 1v6f n ASP 45 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1v6f n GLU 46 N -3.20 0.13 -3.45 -0.67 4.71 -1.26 -4.79 120.64 112.10 1v6f n GLU 46 Ca -0.06 0.62 -0.21 0.00 -0.01 0.00 0.00 57.16 57.51 1v6f n GLU 46 Cb 0.48 -2.01 -0.05 0.00 -1.01 0.00 0.00 31.44 28.85 1v6f n GLU 46 CO 0.00 0.00 0.00 2.89 0.09 0.00 0.00 177.13 180.11 1v6f n ARG 47 N -2.22 -0.91 -3.78 3.49 -4.01 -1.26 -4.86 116.66 103.11 1v6f n ARG 47 Ca -0.01 0.06 -0.13 0.00 -1.04 0.00 0.00 57.85 56.73 1v6f n ARG 47 Cb 0.11 -2.34 -0.13 0.00 -3.04 0.00 0.00 32.46 27.06 1v6f n ARG 47 CO 0.00 0.00 0.00 -1.17 -3.04 0.00 0.00 177.63 173.42 1v6f s LEU 48 N -5.21 0.99 -0.06 2.89 2.96 -1.26 -4.33 118.68 114.66 1v6f s LEU 48 Ca 0.19 0.41 -0.30 0.00 -0.22 0.00 0.00 54.13 54.21 1v6f s LEU 48 Cb -0.11 0.65 -0.05 0.00 0.50 0.00 0.00 46.19 47.18 1v6f s LEU 48 CO 0.59 -0.10 1.54 -0.69 -1.32 0.00 0.00 176.35 176.37 1v6f s VAL 49 N 0.50 3.70 0.20 1.68 1.01 0.65 -4.13 120.40 124.02 1v6f s VAL 49 Ca -0.03 0.91 0.09 0.00 0.00 0.00 0.00 61.98 62.95 1v6f s VAL 49 Cb -0.05 -3.59 -0.05 0.00 0.00 0.00 0.00 36.38 32.70 1v6f s VAL 49 CO -0.03 -0.06 -0.17 0.68 0.00 0.00 0.00 175.10 175.52 1v6f s VAL 50 N 3.60 1.92 0.08 2.92 -7.23 -1.13 -0.90 120.40 119.65 1v6f s VAL 50 Ca 0.68 -2.13 -0.31 0.00 -1.81 0.00 0.00 61.98 58.41 1v6f s VAL 50 Cb -0.31 -2.02 -0.07 0.00 0.56 0.00 0.00 36.38 34.55 1v6f s VAL 50 CO 0.26 -0.44 1.29 -0.22 -0.31 0.00 0.00 175.10 175.68 1v6f s LEU 51 N -3.09 4.37 -0.22 1.32 1.98 -1.26 -3.06 118.68 118.72 1v6f s LEU 51 Ca 0.21 2.15 -0.14 0.00 -2.89 0.00 0.00 54.13 53.47 1v6f s LEU 51 Cb -0.04 -3.58 -0.18 0.00 0.66 0.00 0.00 46.19 43.05 1v6f s LEU 51 CO 0.08 -0.56 0.03 -0.67 -1.89 0.00 0.00 176.35 173.34 1v6f n ASP 52 N 4.00 1.95 -3.63 3.68 2.03 -0.75 -4.95 116.55 118.89 1v6f n ASP 52 Ca 0.10 0.30 -0.05 0.00 0.52 0.00 0.00 54.79 55.66 1v6f n ASP 52 Cb 0.44 -0.85 -0.02 0.00 -0.72 0.00 0.00 41.12 39.98 1v6f n ASP 52 CO 0.00 0.00 0.00 -1.83 -1.92 0.00 0.00 177.20 173.45 1v6f s GLU 53 N -2.46 0.91 -0.18 -0.67 -1.05 -1.24 -5.04 118.70 108.97 1v6f s GLU 53 Ca -0.31 -0.44 0.01 0.00 -0.15 0.00 0.00 54.97 54.08 1v6f s GLU 53 Cb 0.09 0.35 0.04 0.00 -0.44 0.00 0.00 34.13 34.17 1v6f s GLU 53 CO 0.60 -0.41 -0.11 -1.21 0.95 0.00 0.00 175.26 175.07 1v6f s GLU 54 N -3.07 2.10 -0.22 -4.83 2.02 -1.26 -2.63 118.70 110.80 1v6f s GLU 54 Ca 0.09 -0.74 -0.14 0.00 0.02 0.00 0.00 54.97 54.20 1v6f s GLU 54 Cb -0.01 -2.30 -0.04 0.00 0.10 0.00 0.00 34.13 31.88 1v6f s GLU 54 CO -0.03 -0.37 0.32 -0.51 0.02 0.00 0.00 175.26 174.69 1v6f s LEU 55 N 1.43 4.12 0.13 1.80 1.02 0.93 -4.96 118.68 123.15 1v6f s LEU 55 Ca 0.01 0.35 0.06 0.00 0.02 0.00 0.00 54.13 54.58 1v6f s LEU 55 Cb -0.15 -2.38 -0.04 0.00 0.02 0.00 0.00 46.19 43.64 1v6f s LEU 55 CO -0.09 -0.05 -0.03 -1.61 0.02 0.00 0.00 176.35 174.59 1v6f s GLU 56 N 1.37 2.38 -1.07 1.70 2.02 -1.26 0.13 118.70 123.97 1v6f s GLU 56 Ca 0.15 -0.99 -0.25 0.00 0.02 0.00 0.00 54.97 53.89 1v6f s GLU 56 Cb -0.15 -2.40 0.03 0.00 0.10 0.00 0.00 34.13 31.71 1v6f s GLU 56 CO 0.07 0.50 0.47 0.41 0.02 0.00 0.00 175.26 176.74 1v6f n GLY 57 N 0.33 -0.60 3.88 -1.39 0.00 0.26 -4.88 105.19 102.79 1v6f n GLY 57 Ca -0.11 0.26 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 1v6f n GLY 57 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1v6f s VAL 58 N -3.83 1.40 0.20 1.61 -7.23 -1.25 -4.83 120.40 106.47 1v6f s VAL 58 Ca 0.35 -1.63 0.09 0.00 -1.81 0.00 0.00 61.98 58.98 1v6f s VAL 58 Cb -0.20 -2.03 -0.05 0.00 0.56 0.00 0.00 36.38 34.67 1v6f s VAL 58 CO 0.82 0.00 -0.17 -0.94 -0.31 0.00 0.00 175.10 174.50 1v6f s SER 59 N -4.20 2.86 0.18 4.85 1.04 -1.26 -4.59 113.70 112.57 1v6f s SER 59 Ca 0.24 -0.95 0.21 0.00 0.48 0.00 0.00 55.95 55.92 1v6f s SER 59 Cb -0.02 -0.18 0.87 0.00 0.10 0.00 0.00 66.02 66.79 1v6f s SER 59 CO 0.15 -0.06 1.63 -0.81 0.98 0.00 0.00 173.24 175.13 1v6f n PRO 60 N -0.14 0.13 -0.05 4.02 -0.04 -1.26 -0.45 135.00 137.22 1v6f n PRO 60 Ca -0.10 0.37 -0.07 0.00 -0.04 0.00 0.00 63.50 63.67 1v6f n PRO 60 Cb 0.59 -1.76 -0.14 0.00 -0.04 0.00 0.00 33.50 32.15 1v6f n PRO 60 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1v6f n ASP 61 N -2.01 0.45 -0.02 3.54 9.92 -1.26 -3.50 116.55 123.67 1v6f n ASP 61 Ca 0.02 0.21 -0.12 0.00 -0.53 0.00 0.00 54.79 54.37 1v6f n ASP 61 Cb 0.21 0.55 -0.14 0.00 -0.64 0.00 0.00 41.12 41.10 1v6f n ASP 61 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1v6f n GLU 62 N -2.85 0.67 0.01 -1.24 1.02 -1.05 -4.29 120.64 112.91 1v6f n GLU 62 Ca -0.22 0.26 -0.10 0.00 -0.02 0.00 0.00 57.16 57.08 1v6f n GLU 62 Cb 1.04 -1.74 -0.04 0.00 -0.02 0.00 0.00 31.44 30.68 1v6f n GLU 62 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 1v6f h LEU 63 N 0.02 -0.20 -1.84 -4.62 5.85 -0.96 -0.99 115.31 112.56 1v6f h LEU 63 Ca -0.36 0.05 0.20 0.00 0.84 0.00 0.00 57.88 58.62 1v6f h LEU 63 Cb 2.04 0.11 -0.03 0.00 0.37 0.00 0.00 40.66 43.15 1v6f h LEU 63 CO 0.07 -0.09 0.66 0.07 -0.34 0.00 0.00 178.44 178.81 1v6f h LYS 64 N -0.07 0.00 -0.03 1.25 2.10 -1.75 0.75 116.57 118.82 1v6f h LYS 64 Ca 0.06 0.00 -0.12 0.00 -2.00 0.00 0.00 60.65 58.59 1v6f h LYS 64 Cb 0.16 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.47 1v6f h LYS 64 CO -0.14 0.00 -0.55 0.22 -2.00 0.00 0.00 179.45 176.98 1v6f h ASP 65 N 0.00 0.11 -0.24 7.07 1.82 -1.37 -2.65 116.42 121.16 1v6f h ASP 65 Ca 0.33 -0.06 0.00 0.00 -0.39 0.00 0.00 57.03 56.92 1v6f h ASP 65 Cb 1.65 -0.03 0.00 0.00 0.68 0.00 0.00 39.33 41.63 1v6f h ASP 65 CO -0.00 0.64 0.00 -0.62 -1.61 0.00 0.00 179.24 177.65 1v6f n GLU 66 N -3.90 1.82 -4.33 0.28 -0.58 0.26 -4.85 120.64 109.34 1v6f n GLU 66 Ca -0.02 -0.98 -0.29 0.00 -0.42 0.00 0.00 57.16 55.45 1v6f n GLU 66 Cb 0.57 -1.36 -0.12 0.00 -0.57 0.00 0.00 31.44 29.96 1v6f n GLU 66 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1v6f s LEU 67 N -0.99 2.59 0.26 -4.62 1.43 -1.00 -5.11 118.68 111.25 1v6f s LEU 67 Ca 0.18 -0.62 -0.29 0.00 -1.03 0.00 0.00 54.13 52.36 1v6f s LEU 67 Cb 0.11 -1.44 -0.09 0.00 0.03 0.00 0.00 46.19 44.79 1v6f s LEU 67 CO 0.10 0.17 1.26 -2.16 0.23 0.00 0.00 176.35 175.96 1v6f s PRO 68 N -2.16 4.43 -0.04 1.29 0.04 -1.26 -4.94 135.00 132.36 1v6f s PRO 68 Ca 0.17 2.05 0.16 0.00 0.04 0.00 0.00 61.00 63.42 1v6f s PRO 68 Cb -0.10 -3.15 0.50 0.00 0.04 0.00 0.00 34.50 31.78 1v6f s PRO 68 CO 0.09 -0.13 1.42 -0.85 0.04 0.00 0.00 177.00 177.57 1v6f n GLU 69 N 1.69 2.99 0.00 4.56 0.28 -1.26 -4.37 120.64 124.53 1v6f n GLU 69 Ca 0.02 -2.45 0.00 0.00 -0.16 0.00 0.00 57.16 54.58 1v6f n GLU 69 Cb 0.43 -1.52 0.00 0.00 1.43 0.00 0.00 31.44 31.78 1v6f n GLU 69 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 1v6f n ARG 70 N 0.85 1.98 -4.13 3.44 1.74 -1.26 -4.69 116.66 114.58 1v6f n ARG 70 Ca 0.19 0.00 -0.16 0.00 -0.77 0.00 0.00 57.85 57.11 1v6f n ARG 70 Cb 0.61 -0.92 -0.12 0.00 -1.02 0.00 0.00 32.46 31.01 1v6f n ARG 70 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1v6f s GLN 71 N -1.74 0.68 0.25 5.56 -0.21 -1.26 -3.86 119.66 119.08 1v6f s GLN 71 Ca 0.00 -0.83 -0.30 0.00 0.02 0.00 0.00 55.36 54.26 1v6f s GLN 71 Cb 0.00 -0.58 -0.09 0.00 1.00 0.00 0.00 33.01 33.34 1v6f s GLN 71 CO 0.00 0.12 1.27 -1.25 -2.12 0.00 0.00 175.29 173.31 1v6f s PRO 72 N -1.57 4.43 0.06 2.91 0.04 -1.26 -4.58 135.00 135.02 1v6f s PRO 72 Ca -0.05 2.06 0.01 0.00 0.04 0.00 0.00 61.00 63.05 1v6f s PRO 72 Cb -0.10 -3.16 -0.03 0.00 0.04 0.00 0.00 34.50 31.25 1v6f s PRO 72 CO 0.01 -0.15 -0.05 0.50 0.04 0.00 0.00 177.00 177.35 1v6f s ARG 73 N -0.87 0.64 -0.13 4.56 6.06 -0.42 -5.01 118.95 123.78 1v6f s ARG 73 Ca 0.52 -1.09 -0.10 0.00 -2.50 0.00 0.00 55.73 52.56 1v6f s ARG 73 Cb -0.37 -0.06 -0.05 0.00 0.06 0.00 0.00 34.95 34.54 1v6f s ARG 73 CO 0.43 -0.04 0.21 -0.06 -2.50 0.00 0.00 175.30 173.35 1v6f s PHE 74 N -2.97 3.54 -0.12 5.12 0.08 -0.91 -2.73 117.98 119.99 1v6f s PHE 74 Ca 0.02 0.57 -0.10 0.00 0.12 0.00 0.00 56.93 57.54 1v6f s PHE 74 Cb 0.01 -2.14 0.03 0.00 -0.57 0.00 0.00 43.02 40.35 1v6f s PHE 74 CO -0.05 0.50 0.31 0.42 -0.10 0.00 0.00 175.22 176.30 1v6f s ILE 75 N -0.36 -0.00 -0.34 0.64 1.09 -1.23 -0.65 121.20 120.35 1v6f s ILE 75 Ca 0.15 0.01 0.03 0.00 -1.10 0.00 0.00 60.65 59.74 1v6f s ILE 75 Cb -0.13 -0.43 0.10 0.00 -1.06 0.00 0.00 42.46 40.94 1v6f s ILE 75 CO 0.04 0.01 0.07 -0.69 -0.10 0.00 0.00 174.94 174.26 1v6f s VAL 76 N 0.29 2.01 0.14 2.92 1.01 -0.48 -1.97 120.40 124.32 1v6f s VAL 76 Ca -0.01 -2.20 0.03 0.00 0.00 0.00 0.00 61.98 59.81 1v6f s VAL 76 Cb -0.03 -2.49 -0.04 0.00 0.00 0.00 0.00 36.38 33.82 1v6f s VAL 76 CO -0.01 -0.62 0.19 -0.47 0.00 0.00 0.00 175.10 174.19 1v6f s TYR 77 N 1.00 3.30 -0.40 5.22 5.04 -1.22 -2.46 117.35 127.84 1v6f s TYR 77 Ca 0.11 0.07 0.02 0.00 -2.44 0.00 0.00 57.07 54.83 1v6f s TYR 77 Cb -0.19 -1.60 0.12 0.00 0.35 0.00 0.00 41.96 40.64 1v6f s TYR 77 CO -0.11 0.52 0.16 0.45 -1.34 0.00 0.00 175.55 175.24 1v6f s SER 78 N -3.00 4.17 1.11 4.32 0.15 -1.18 -2.85 113.70 116.42 1v6f s SER 78 Ca 0.32 -2.35 -0.13 0.00 0.70 0.00 0.00 55.95 54.50 1v6f s SER 78 Cb -0.11 -1.27 0.26 0.00 -1.71 0.00 0.00 66.02 63.18 1v6f s SER 78 CO 0.25 -0.32 1.05 -0.47 1.20 0.00 0.00 173.24 174.95 1v6f s TYR 79 N 0.66 1.62 -0.35 3.44 5.04 -1.25 -4.54 117.35 121.98 1v6f s TYR 79 Ca 0.14 1.08 -0.01 0.00 -2.44 0.00 0.00 57.07 55.84 1v6f s TYR 79 Cb -0.22 -3.16 0.08 0.00 0.35 0.00 0.00 41.96 39.02 1v6f s TYR 79 CO -0.08 -3.56 0.09 0.21 -1.34 0.00 0.00 175.55 170.87 1v6f s LYS 80 N -4.65 2.08 -0.72 4.97 2.20 -1.26 -3.64 119.74 118.72 1v6f s LYS 80 Ca 0.67 -1.60 -0.21 0.00 -0.36 0.00 0.00 55.97 54.47 1v6f s LYS 80 Cb -0.23 -3.34 0.09 0.00 -1.51 0.00 0.00 37.83 32.85 1v6f s LYS 80 CO 0.62 -0.86 0.97 -0.47 -0.36 0.00 0.00 175.35 175.25 1v6f s TYR 81 N 1.14 2.84 -0.05 4.03 6.14 0.10 -4.94 117.35 126.61 1v6f s TYR 81 Ca 0.03 -0.84 -0.19 0.00 0.64 0.00 0.00 57.07 56.71 1v6f s TYR 81 Cb -0.21 -4.25 -0.05 0.00 0.42 0.00 0.00 41.96 37.88 1v6f s TYR 81 CO -0.04 -1.55 0.53 -1.14 0.64 0.00 0.00 175.55 173.99 1v6f s GLN 82 N 3.48 4.27 0.06 4.97 2.00 -1.26 -1.38 119.66 131.81 1v6f s GLN 82 Ca 0.23 0.59 0.00 0.00 -2.00 0.00 0.00 55.36 54.18 1v6f s GLN 82 Cb -0.15 -3.36 -0.04 0.00 0.80 0.00 0.00 33.01 30.26 1v6f s GLN 82 CO 0.04 0.32 0.20 -1.01 -0.50 0.00 0.00 175.29 174.35 1v6f s HIS 83 N 0.03 3.49 0.12 1.67 3.76 0.24 -4.97 115.29 119.63 1v6f s HIS 83 Ca 0.28 0.23 -0.34 0.00 -0.15 0.00 0.00 55.06 55.09 1v6f s HIS 83 Cb -0.17 -1.75 -0.12 0.00 1.11 0.00 0.00 32.58 31.65 1v6f s HIS 83 CO 0.14 0.58 1.56 0.22 -0.85 0.00 0.00 174.74 176.39 1v6f h ASP 84 N 3.09 -1.70 -0.95 1.40 3.58 -1.98 -0.65 116.42 119.21 1v6f h ASP 84 Ca -0.45 0.20 0.29 0.00 0.42 0.00 0.00 57.03 57.50 1v6f h ASP 84 Cb 1.16 0.66 -0.16 0.00 1.72 0.00 0.00 39.33 42.71 1v6f h ASP 84 CO 0.75 -0.48 0.29 -0.78 -2.88 0.00 0.00 179.24 176.14 1v6f h ASP 85 N -0.58 0.02 0.00 2.28 3.58 -2.05 -3.44 116.42 116.23 1v6f h ASP 85 Ca 0.04 0.23 0.00 0.00 0.42 0.00 0.00 57.03 57.72 1v6f h ASP 85 Cb 0.68 0.30 0.00 0.00 1.72 0.00 0.00 39.33 42.03 1v6f h ASP 85 CO -0.43 -0.26 0.00 0.61 -2.88 0.00 0.00 179.24 176.28 1v6f n GLY 86 N -1.37 1.61 3.73 -0.78 0.00 -0.25 -5.13 105.19 103.00 1v6f n GLY 86 Ca 0.27 -0.09 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 1v6f n GLY 86 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1v6f n ARG 87 N 0.00 2.43 -3.77 1.61 3.00 -1.26 -4.52 116.66 114.16 1v6f n ARG 87 Ca 0.00 0.86 -0.13 0.00 -0.00 0.00 0.00 57.85 58.58 1v6f n ARG 87 Cb 0.00 -2.55 -0.13 0.00 0.00 0.00 0.00 32.46 29.78 1v6f n ARG 87 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 1v6f s VAL 88 N -0.63 -0.03 0.09 5.15 0.11 -1.26 0.82 120.40 124.66 1v6f s VAL 88 Ca 0.59 0.10 0.05 0.00 -2.93 0.00 0.00 61.98 59.79 1v6f s VAL 88 Cb -0.53 -0.29 -0.03 0.00 -1.53 0.00 0.00 36.38 33.99 1v6f s VAL 88 CO 0.57 0.04 -0.12 -0.94 -3.33 0.00 0.00 175.10 171.32 1v6f s SER 89 N 0.77 1.60 -0.67 3.54 1.04 -0.48 -4.94 113.70 114.56 1v6f s SER 89 Ca -0.06 -0.74 -0.04 0.00 0.48 0.00 0.00 55.95 55.60 1v6f s SER 89 Cb -0.07 -0.02 0.17 0.00 0.10 0.00 0.00 66.02 66.20 1v6f s SER 89 CO -0.04 -0.18 0.51 -0.31 0.98 0.00 0.00 173.24 174.20 1v6f s TYR 90 N -1.96 3.47 -0.03 5.02 2.02 -1.26 0.00 117.35 124.62 1v6f s TYR 90 Ca 0.03 -2.66 -0.30 0.00 -0.37 0.00 0.00 57.07 53.77 1v6f s TYR 90 Cb -0.06 -3.28 -0.05 0.00 -0.40 0.00 0.00 41.96 38.17 1v6f s TYR 90 CO 0.01 -0.85 1.47 -1.25 -1.57 0.00 0.00 175.55 173.37 1v6f s PRO 91 N -0.16 4.24 -0.07 -1.71 0.04 -1.24 -4.81 135.00 131.28 1v6f s PRO 91 Ca 0.18 2.02 -0.30 0.00 0.04 0.00 0.00 61.00 62.94 1v6f s PRO 91 Cb -0.18 -3.70 -0.02 0.00 0.04 0.00 0.00 34.50 30.63 1v6f s PRO 91 CO -0.05 -0.68 1.12 -0.51 0.04 0.00 0.00 177.00 176.93 1v6f s LEU 92 N 2.98 4.27 0.06 -3.56 2.01 -1.26 -3.88 118.68 119.29 1v6f s LEU 92 Ca 0.66 1.70 0.05 0.00 0.01 0.00 0.00 54.13 56.55 1v6f s LEU 92 Cb -0.31 -3.56 -0.03 0.00 0.01 0.00 0.00 46.19 42.30 1v6f s LEU 92 CO 0.26 -0.53 -0.14 0.00 1.01 0.00 0.00 176.35 176.96 1v6f s PHE 94 N -1.15 3.18 -0.54 0.00 2.19 -0.41 -3.38 117.98 117.86 1v6f s PHE 94 Ca -0.02 0.03 -0.17 0.00 0.33 0.00 0.00 56.93 57.11 1v6f s PHE 94 Cb -0.09 -2.90 0.11 0.00 -1.31 0.00 0.00 43.02 38.83 1v6f s PHE 94 CO 0.02 -0.57 0.52 0.42 1.83 0.00 0.00 175.22 177.44 1v6f s ILE 95 N 2.31 5.13 -0.97 3.12 1.01 -0.83 -0.66 121.20 130.31 1v6f s ILE 95 Ca 0.16 -1.30 -0.23 0.00 0.00 0.00 0.00 60.65 59.29 1v6f s ILE 95 Cb -0.16 -4.33 0.06 0.00 0.01 0.00 0.00 42.46 38.04 1v6f s ILE 95 CO 0.13 -0.86 1.39 0.12 0.00 0.00 0.00 174.94 175.72 1v6f s PHE 96 N 1.83 2.56 -0.48 3.97 5.36 0.41 -3.49 117.98 128.15 1v6f s PHE 96 Ca 0.05 -0.80 -0.28 0.00 -0.96 0.00 0.00 56.93 54.94 1v6f s PHE 96 Cb -0.28 -4.64 -0.00 0.00 -0.34 0.00 0.00 43.02 37.76 1v6f s PHE 96 CO 0.05 -1.90 1.61 0.45 -1.46 0.00 0.00 175.22 173.97 1v6f s SER 97 N 4.68 5.92 -0.31 6.13 0.15 -1.11 -2.22 113.70 126.95 1v6f s SER 97 Ca 0.43 0.69 0.01 0.00 0.70 0.00 0.00 55.95 57.78 1v6f s SER 97 Cb -0.02 -2.54 0.10 0.00 -1.71 0.00 0.00 66.02 61.85 1v6f s SER 97 CO -0.07 -1.79 0.07 -0.44 1.20 0.00 0.00 173.24 172.20 1v6f s SER 98 N 5.56 4.24 0.15 5.45 0.01 -0.22 -1.30 113.70 127.59 1v6f s SER 98 Ca 0.65 -1.75 -0.31 0.00 1.31 0.00 0.00 55.95 55.85 1v6f s SER 98 Cb -0.15 -1.15 -0.08 0.00 0.21 0.00 0.00 66.02 64.85 1v6f s SER 98 CO 0.28 -0.38 1.34 -2.16 0.41 0.00 0.00 173.24 172.72 1v6f s PRO 99 N 1.36 4.36 0.44 12.44 0.04 -1.26 -3.50 135.00 148.89 1v6f s PRO 99 Ca 0.08 2.04 0.21 0.00 0.04 0.00 0.00 61.00 63.37 1v6f s PRO 99 Cb -0.18 -3.23 1.17 0.00 0.04 0.00 0.00 34.50 32.30 1v6f s PRO 99 CO -0.17 -0.33 1.86 -0.39 0.04 0.00 0.00 177.00 178.01 1v6f h VAL 100 N 4.02 0.65 0.00 -0.36 -1.51 -1.71 0.72 116.25 118.06 1v6f h VAL 100 Ca -0.43 -0.11 0.00 0.00 -1.23 0.00 0.00 66.70 64.93 1v6f h VAL 100 Cb 1.21 0.31 0.00 0.00 -2.13 0.00 0.00 31.29 30.68 1v6f h VAL 100 CO 0.81 0.06 0.00 0.61 -1.23 0.00 0.00 177.57 177.82 1v6f n GLY 101 N -1.56 1.77 3.95 5.19 0.00 -1.26 -4.83 105.19 108.45 1v6f n GLY 101 Ca 0.19 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.97 1v6f n GLY 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1v6f s LYS 103 N -3.52 3.57 -0.02 0.00 -2.85 -1.26 -5.01 119.74 110.64 1v6f s LYS 103 Ca 0.34 -0.09 -0.26 0.00 -1.00 0.00 0.00 55.97 54.97 1v6f s LYS 103 Cb -0.10 -2.61 -0.20 0.00 -2.06 0.00 0.00 37.83 32.85 1v6f s LYS 103 CO 0.29 0.12 1.27 -1.00 0.10 0.00 0.00 175.35 176.13 1v6f h PRO 104 N 1.12 0.00 -1.44 1.78 0.13 -1.99 -1.97 132.00 129.63 1v6f h PRO 104 Ca -0.48 -0.00 0.42 0.00 -0.87 0.00 0.00 66.00 65.07 1v6f h PRO 104 Cb 1.20 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.27 1v6f h PRO 104 CO 0.64 0.49 1.19 1.49 -0.23 0.00 0.00 178.00 181.57 1v6f h GLU 105 N -0.49 0.00 0.03 0.86 4.81 -2.01 0.24 114.58 118.02 1v6f h GLU 105 Ca 0.00 0.00 -0.34 0.00 -0.13 0.00 0.00 59.36 58.89 1v6f h GLU 105 Cb 0.49 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.83 1v6f h GLU 105 CO 0.00 0.00 -1.93 1.04 -0.73 0.00 0.00 179.01 177.39 1v6f n GLN 106 N -3.77 0.63 -0.31 1.92 1.13 -1.18 -4.08 117.38 111.72 1v6f n GLN 106 Ca 0.32 0.36 0.17 0.00 -1.94 0.00 0.00 57.00 55.91 1v6f n GLN 106 Cb 1.63 -1.65 0.36 0.00 0.11 0.00 0.00 30.24 30.69 1v6f n GLN 106 CO 0.00 0.00 0.00 1.96 -1.44 0.00 0.00 177.06 177.58 1v6f h GLN 107 N -0.57 0.30 -0.69 -1.09 1.08 0.23 0.54 115.11 114.90 1v6f h GLN 107 Ca -0.49 -0.02 -0.05 0.00 -1.45 0.00 0.00 58.65 56.65 1v6f h GLN 107 Cb 1.66 -0.07 -0.03 0.00 -0.05 0.00 0.00 27.48 28.99 1v6f h GLN 107 CO -0.17 0.20 0.23 0.52 -0.95 0.00 0.00 178.83 178.67 1v6f h MET 108 N 0.31 1.05 0.64 1.46 2.86 -1.48 0.59 114.93 120.36 1v6f h MET 108 Ca 0.62 -0.20 -0.03 0.00 -2.06 0.00 0.00 59.70 58.02 1v6f h MET 108 Cb 1.28 -0.16 0.01 0.00 0.06 0.00 0.00 31.60 32.78 1v6f h MET 108 CO -0.60 0.88 -0.31 1.98 1.06 0.00 0.00 176.91 179.92 1v6f h MET 109 N 1.02 -0.83 -0.24 1.72 1.85 -0.10 -1.98 114.93 116.35 1v6f h MET 109 Ca 0.23 0.06 -0.11 0.00 -0.61 0.00 0.00 59.70 59.27 1v6f h MET 109 Cb 0.26 0.19 -0.01 0.00 0.43 0.00 0.00 31.60 32.46 1v6f h MET 109 CO -0.01 -0.52 -0.30 1.88 -0.40 0.00 0.00 176.91 177.56 1v6f h TYR 110 N -0.99 0.56 0.17 1.39 -1.99 -1.26 -2.20 116.97 112.66 1v6f h TYR 110 Ca -0.09 -0.13 -0.01 0.00 2.00 0.00 0.00 58.73 60.50 1v6f h TYR 110 Cb 0.70 -0.13 -0.00 0.00 2.00 0.00 0.00 36.73 39.29 1v6f h TYR 110 CO -0.01 0.74 -0.14 0.00 -0.00 0.00 0.00 178.16 178.76 1v6f h ALA 111 N 1.25 -0.91 -0.21 3.88 0.00 0.24 0.43 119.26 123.94 1v6f h ALA 111 Ca 0.06 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 54.93 1v6f h ALA 111 Cb 0.74 0.33 -0.03 0.00 0.00 0.00 0.00 17.79 18.84 1v6f h ALA 111 CO 0.06 -0.91 0.04 0.78 0.00 0.00 0.00 179.25 179.21 1v6f h GLY 112 N -0.30 0.23 0.62 0.00 0.00 -1.43 -2.55 103.07 99.64 1v6f h GLY 112 Ca -0.02 -0.01 0.07 0.00 0.00 0.00 0.00 47.33 47.37 1v6f h GLY 112 CO -0.00 -0.01 0.41 1.76 0.00 0.00 0.00 176.54 178.70 1v6f h SER 113 N 0.12 0.60 -0.50 0.19 0.02 -1.39 -2.68 113.55 109.90 1v6f h SER 113 Ca 0.10 0.04 0.08 0.00 -0.84 0.00 0.00 61.79 61.16 1v6f h SER 113 Cb 0.10 -0.08 -0.10 0.00 0.14 0.00 0.00 62.40 62.46 1v6f h SER 113 CO -0.13 0.37 -0.44 0.50 -1.14 0.00 0.00 176.83 175.99 1v6f h LYS 114 N 0.73 -0.26 -0.62 3.45 3.64 0.30 -2.00 116.57 121.81 1v6f h LYS 114 Ca 0.34 0.02 0.06 0.00 -1.27 0.00 0.00 60.65 59.79 1v6f h LYS 114 Cb 0.25 0.06 -0.07 0.00 -0.41 0.00 0.00 32.23 32.05 1v6f h LYS 114 CO -0.21 -0.18 -0.36 -1.71 -2.27 0.00 0.00 179.45 174.72 1v6f n ASN 115 N -5.41 -0.65 -0.21 4.20 2.85 -1.01 0.83 115.26 115.85 1v6f n ASN 115 Ca 0.01 1.24 0.00 0.00 -0.11 0.00 0.00 54.58 55.72 1v6f n ASN 115 Cb 0.35 -0.21 0.09 0.00 1.24 0.00 0.00 39.78 41.24 1v6f n ASN 115 CO 0.00 0.00 0.00 0.50 -2.11 0.00 0.00 177.26 175.65 1v6f h LYS 116 N 0.00 0.05 -0.04 1.20 3.64 -1.47 -1.61 116.57 118.34 1v6f h LYS 116 Ca 0.10 -0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.51 1v6f h LYS 116 Cb 0.25 -0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 32.00 1v6f h LYS 116 CO -0.58 0.03 -0.39 -0.07 -2.27 0.00 0.00 179.45 176.17 1v6f h LEU 117 N 0.05 -1.20 -1.57 5.20 3.38 0.67 0.26 115.31 122.09 1v6f h LEU 117 Ca 0.32 0.15 0.05 0.00 0.09 0.00 0.00 57.88 58.49 1v6f h LEU 117 Cb 0.51 0.48 -0.01 0.00 0.09 0.00 0.00 40.66 41.73 1v6f h LEU 117 CO -0.61 -0.43 0.55 0.58 0.09 0.00 0.00 178.44 178.62 1v6f h VAL 118 N -0.52 0.09 0.06 1.22 2.07 -0.25 0.42 116.25 119.34 1v6f h VAL 118 Ca 0.06 0.00 -0.34 0.00 0.82 0.00 0.00 66.70 67.24 1v6f h VAL 118 Cb 0.62 0.49 -0.04 0.00 -1.52 0.00 0.00 31.29 30.85 1v6f h VAL 118 CO -0.33 0.00 -1.95 0.00 0.02 0.00 0.00 177.57 175.31 1v6f n GLN 119 N -3.04 0.70 -0.06 1.57 1.13 0.63 -1.28 117.38 117.02 1v6f n GLN 119 Ca 0.03 0.25 -0.12 0.00 -1.94 0.00 0.00 57.00 55.22 1v6f n GLN 119 Cb 0.64 -1.72 -0.06 0.00 0.11 0.00 0.00 30.24 29.21 1v6f n GLN 119 CO 0.00 0.00 0.00 1.15 -1.44 0.00 0.00 177.06 176.77 1v6f h THR 120 N 0.03 1.28 -0.00 5.09 2.02 0.24 -2.77 112.91 118.81 1v6f h THR 120 Ca -0.39 -1.01 0.00 0.00 0.77 0.00 0.00 66.41 65.78 1v6f h THR 120 Cb 2.03 1.57 0.00 0.00 -1.74 0.00 0.00 68.15 70.01 1v6f h THR 120 CO 0.07 0.30 -0.01 0.00 0.37 0.00 0.00 175.52 176.25 1v6f n ALA 121 N -2.36 2.63 -3.63 6.16 0.00 -0.25 -4.89 120.51 118.17 1v6f n ALA 121 Ca -0.05 -0.20 -0.21 0.00 0.00 0.00 0.00 53.44 52.98 1v6f n ALA 121 Cb 0.27 -1.48 0.05 0.00 0.00 0.00 0.00 19.45 18.29 1v6f n ALA 121 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1v6f n GLU 122 N -1.03 -4.90 -3.58 0.00 1.02 -1.05 -4.94 120.64 106.17 1v6f n GLU 122 Ca 0.20 0.66 -0.37 0.00 -0.02 0.00 0.00 57.16 57.64 1v6f n GLU 122 Cb 0.18 -5.28 -0.08 0.00 -0.02 0.00 0.00 31.44 26.24 1v6f n GLU 122 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1v6f s LEU 123 N -6.54 4.17 -0.14 -4.62 1.43 -0.41 -4.98 118.68 107.58 1v6f s LEU 123 Ca 0.05 0.31 -0.17 0.00 -1.03 0.00 0.00 54.13 53.28 1v6f s LEU 123 Cb -0.01 -2.25 -0.24 0.00 0.03 0.00 0.00 46.19 43.72 1v6f s LEU 123 CO 0.80 0.06 0.42 0.71 0.23 0.00 0.00 176.35 178.56 1v6f h THR 124 N 4.89 0.97 -3.33 5.49 1.35 -1.85 -3.45 112.91 116.98 1v6f h THR 124 Ca -0.39 -2.31 -0.60 0.00 -0.55 0.00 0.00 66.41 62.57 1v6f h THR 124 Cb 1.16 2.55 -0.09 0.00 -1.73 0.00 0.00 68.15 70.04 1v6f h THR 124 CO 0.71 0.60 0.38 -0.54 -0.25 0.00 0.00 175.52 176.42 1v6f s LYS 125 N -2.43 4.18 -0.22 4.72 3.01 -1.26 -5.03 119.74 122.70 1v6f s LYS 125 Ca -0.23 0.85 0.01 0.00 -1.01 0.00 0.00 55.97 55.59 1v6f s LYS 125 Cb 0.05 -3.64 0.05 0.00 -1.01 0.00 0.00 37.83 33.28 1v6f s LYS 125 CO 0.70 -0.47 -0.10 0.08 0.51 0.00 0.00 175.35 176.07 1v6f s VAL 126 N 2.67 1.79 -0.04 3.17 1.01 -1.26 -1.29 120.40 126.44 1v6f s VAL 126 Ca 0.33 -1.20 0.04 0.00 0.00 0.00 0.00 61.98 61.15 1v6f s VAL 126 Cb -0.15 -1.89 -0.02 0.00 0.00 0.00 0.00 36.38 34.31 1v6f s VAL 126 CO 0.08 0.10 -0.16 -0.36 0.00 0.00 0.00 175.10 174.75 1v6f s PHE 127 N 1.31 2.63 -0.01 5.22 0.08 0.17 -4.96 117.98 122.42 1v6f s PHE 127 Ca -0.04 -0.21 0.08 0.00 0.12 0.00 0.00 56.93 56.88 1v6f s PHE 127 Cb -0.17 -1.61 -0.02 0.00 -0.57 0.00 0.00 43.02 40.65 1v6f s PHE 127 CO -0.07 0.15 -0.24 -2.00 -0.10 0.00 0.00 175.22 172.95 1v6f s GLU 128 N -0.71 1.94 -0.11 0.44 -6.30 -1.26 -0.45 118.70 112.26 1v6f s GLU 128 Ca 0.11 -0.90 0.03 0.00 -2.50 0.00 0.00 54.97 51.72 1v6f s GLU 128 Cb -0.10 -1.90 0.00 0.00 0.00 0.00 0.00 34.13 32.12 1v6f s GLU 128 CO 0.00 0.52 -0.23 0.96 0.02 0.00 0.00 175.26 176.54 1v6f s ILE 129 N -0.60 1.99 -2.00 -3.70 -4.36 -0.94 -4.94 121.20 106.65 1v6f s ILE 129 Ca 0.10 -0.97 0.01 0.00 -0.26 0.00 0.00 60.65 59.52 1v6f s ILE 129 Cb -0.09 -1.74 0.02 0.00 1.25 0.00 0.00 42.46 41.89 1v6f s ILE 129 CO -0.01 0.54 1.02 -2.11 0.24 0.00 0.00 174.94 174.63 1v6f n ARG 130 N 3.71 1.01 -3.41 0.37 -4.01 -1.25 -1.05 116.66 112.03 1v6f n ARG 130 Ca -0.19 -0.01 0.01 0.00 -1.04 0.00 0.00 57.85 56.62 1v6f n ARG 130 Cb 0.52 -1.01 -0.04 0.00 -3.04 0.00 0.00 32.46 28.89 1v6f n ARG 130 CO 0.00 0.00 0.00 0.54 -3.04 0.00 0.00 177.63 175.13 1v6f s ASN 131 N -1.01 -0.46 0.42 2.89 2.20 -1.23 -1.94 114.94 115.80 1v6f s ASN 131 Ca 0.01 0.65 0.26 0.00 -0.94 0.00 0.00 52.86 52.84 1v6f s ASN 131 Cb 0.00 1.48 1.33 0.00 -2.00 0.00 0.00 41.25 42.06 1v6f s ASN 131 CO 0.01 -0.09 1.66 0.71 -2.94 0.00 0.00 177.10 176.44 1v6f h THR 132 N 5.34 0.22 -0.94 0.54 1.35 -1.87 0.68 112.91 118.23 1v6f h THR 132 Ca -0.17 -0.06 0.12 0.00 -0.55 0.00 0.00 66.41 65.75 1v6f h THR 132 Cb 1.13 0.04 -0.08 0.00 -1.73 0.00 0.00 68.15 67.51 1v6f h THR 132 CO 0.10 0.03 0.57 -0.33 -0.25 0.00 0.00 175.52 175.64 1v6f h GLU 133 N 0.17 0.88 -0.85 4.72 5.08 -1.95 -0.27 114.58 122.36 1v6f h GLU 133 Ca 0.76 -0.05 0.16 0.00 -1.00 0.00 0.00 59.36 59.23 1v6f h GLU 133 Cb 2.26 -0.20 -0.06 0.00 0.50 0.00 0.00 28.75 31.25 1v6f h GLU 133 CO -0.42 0.58 0.56 0.22 -1.00 0.00 0.00 179.01 178.95 1v6f h ASP 134 N 0.91 0.53 -0.50 1.42 3.58 -0.03 -3.37 116.42 118.97 1v6f h ASP 134 Ca 0.47 0.04 -0.07 0.00 0.42 0.00 0.00 57.03 57.89 1v6f h ASP 134 Cb 0.47 -0.07 -0.00 0.00 1.72 0.00 0.00 39.33 41.45 1v6f h ASP 134 CO -0.27 0.26 0.21 -0.22 -2.88 0.00 0.00 179.24 176.34 1v6f s LEU 135 N -9.61 2.93 0.17 2.28 2.96 -0.11 -4.64 118.68 112.65 1v6f s LEU 135 Ca -0.09 0.11 -0.02 0.00 -0.22 0.00 0.00 54.13 53.91 1v6f s LEU 135 Cb 0.22 -2.55 -0.04 0.00 0.50 0.00 0.00 46.19 44.32 1v6f s LEU 135 CO 0.78 -3.73 0.11 0.42 -1.32 0.00 0.00 176.35 172.61 1v6f s THR 136 N 14.31 0.05 0.10 3.68 -4.23 -1.23 -4.20 115.64 124.12 1v6f s THR 136 Ca 0.92 -1.92 -0.35 0.00 -1.18 0.00 0.00 61.69 59.16 1v6f s THR 136 Cb -0.13 -2.25 -0.15 0.00 1.34 0.00 0.00 72.50 71.31 1v6f s THR 136 CO 0.09 -0.24 1.56 -0.08 -0.54 0.00 0.00 174.62 175.42 1v6f h GLU 137 N 2.73 -0.80 -0.84 3.99 4.81 -1.89 -0.66 114.58 121.92 1v6f h GLU 137 Ca -0.35 0.05 0.17 0.00 -0.13 0.00 0.00 59.36 59.10 1v6f h GLU 137 Cb 1.22 0.18 -0.11 0.00 0.63 0.00 0.00 28.75 30.68 1v6f h GLU 137 CO 0.55 -0.53 0.38 1.49 -0.73 0.00 0.00 179.01 180.17 1v6f h GLU 138 N -0.83 0.48 -0.33 1.92 4.57 -1.97 -0.63 114.58 117.78 1v6f h GLU 138 Ca -0.02 -0.03 0.02 0.00 -1.18 0.00 0.00 59.36 58.15 1v6f h GLU 138 Cb 0.79 -0.11 -0.03 0.00 -0.16 0.00 0.00 28.75 29.25 1v6f h GLU 138 CO -0.21 0.32 0.17 2.35 -1.18 0.00 0.00 179.01 180.45 1v6f h TRP 139 N 0.49 0.31 0.04 0.92 7.01 -1.63 -2.14 115.95 120.95 1v6f h TRP 139 Ca 0.48 0.01 0.02 0.00 2.11 0.00 0.00 58.89 61.52 1v6f h TRP 139 Cb 0.79 -0.09 -0.05 0.00 -2.10 0.00 0.00 29.16 27.71 1v6f h TRP 139 CO -0.13 0.17 -0.50 -0.07 -2.79 0.00 0.00 178.44 175.12 1v6f h LEU 140 N 0.35 -1.51 -2.02 0.65 3.38 0.39 0.51 115.31 117.05 1v6f h LEU 140 Ca 0.14 0.17 0.14 0.00 0.09 0.00 0.00 57.88 58.42 1v6f h LEU 140 Cb 0.05 0.57 -0.02 0.00 0.09 0.00 0.00 40.66 41.35 1v6f h LEU 140 CO -0.09 -0.52 0.37 0.03 0.09 0.00 0.00 178.44 178.32 1v6f h ARG 141 N -0.67 0.00 -0.20 1.13 3.08 -1.35 -0.97 114.38 115.39 1v6f h ARG 141 Ca 0.02 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.05 1v6f h ARG 141 Cb 0.72 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.76 1v6f h ARG 141 CO -0.32 0.00 0.05 1.49 -1.07 0.00 0.00 179.97 180.11 1v6f h GLU 142 N 0.00 0.33 -0.38 0.04 4.57 -0.24 0.36 114.58 119.26 1v6f h GLU 142 Ca 0.23 -0.08 -0.05 0.00 -1.18 0.00 0.00 59.36 58.29 1v6f h GLU 142 Cb 0.98 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.51 1v6f h GLU 142 CO -0.00 0.45 0.06 0.87 -1.18 0.00 0.00 179.01 179.21 1v6f h LYS 143 N 0.14 0.63 -0.34 1.92 1.79 -0.43 -2.73 116.57 117.56 1v6f h LYS 143 Ca 0.06 -0.17 -0.12 0.00 -2.18 0.00 0.00 60.65 58.24 1v6f h LYS 143 Cb 0.27 -0.07 -0.01 0.00 -1.58 0.00 0.00 32.23 30.84 1v6f h LYS 143 CO 0.00 0.70 -0.27 -0.07 -1.08 0.00 0.00 179.45 178.73 1v6f h LEU 144 N 0.48 0.71 -0.87 2.94 3.38 -1.32 -3.07 115.31 117.56 1v6f h LEU 144 Ca 0.12 -0.27 0.03 0.00 0.09 0.00 0.00 57.88 57.85 1v6f h LEU 144 Cb 0.37 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 40.88 1v6f h LEU 144 CO 0.01 0.95 0.56 1.23 0.09 0.00 0.00 178.44 181.28 1v6f h GLY 145 N 0.98 1.26 -5.74 0.83 0.00 -0.12 -3.44 103.07 96.85 1v6f h GLY 145 Ca 0.08 -0.43 0.15 0.00 0.00 0.00 0.00 47.33 47.13 1v6f h GLY 145 CO 0.06 0.37 0.31 -1.35 0.00 0.00 0.00 176.54 175.94 1v6f s SER 146 N -5.90 -0.52 0.00 0.19 1.04 -1.04 -5.09 113.70 102.37 1v6f s SER 146 Ca -0.13 0.77 0.00 0.00 0.48 0.00 0.00 55.95 57.07 1v6f s SER 146 Cb 0.17 1.44 0.00 0.00 0.10 0.00 0.00 66.02 67.73 1v6f s SER 146 CO 0.80 -0.11 0.00 0.61 0.98 0.00 0.00 173.24 175.51 1v6f n GLY 147 N 4.37 4.35 3.72 7.32 0.00 -1.23 -4.56 105.19 119.16 1v6f n GLY 147 Ca -0.13 -1.29 -0.42 0.00 0.00 0.00 0.00 46.02 44.18 1v6f n GLY 147 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1v6f s PRO 148 N 4.80 4.35 -0.85 1.61 0.04 -1.26 -4.95 135.00 138.73 1v6f s PRO 148 Ca 0.00 2.04 -0.25 0.00 0.04 0.00 0.00 61.00 62.83 1v6f s PRO 148 Cb 0.00 -3.24 0.04 0.00 0.04 0.00 0.00 34.50 31.34 1v6f s PRO 148 CO 0.00 -0.36 1.33 -1.12 0.04 0.00 0.00 177.00 176.89 1v6f s SER 149 N 0.87 6.31 0.27 6.66 0.01 -1.26 -4.99 113.70 121.56 1v6f s SER 149 Ca 0.62 -0.91 -0.27 0.00 1.31 0.00 0.00 55.95 56.69 1v6f s SER 149 Cb -0.36 -2.55 -0.09 0.00 0.21 0.00 0.00 66.02 63.22 1v6f s SER 149 CO 0.32 -1.67 0.92 -0.94 0.41 0.00 0.00 173.24 172.28 1v6f s SER 150 N 4.22 7.47 0.00 2.44 1.04 -1.26 -5.35 113.70 122.26 1v6f s SER 150 Ca 0.39 1.85 0.27 0.00 0.48 0.00 0.00 55.95 58.93 1v6f s SER 150 Cb -0.05 -2.58 0.78 0.00 0.10 0.00 0.00 66.02 64.27 1v6f s SER 150 CO 0.04 0.07 1.59 0.61 0.98 0.00 0.00 173.24 176.53