#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 0.08 0.33 1.61 0.01 -1.26 -5.17 113.70 109.30 1v6f s SER 2 Ca 0.00 -0.19 0.07 0.00 1.31 0.00 0.00 55.95 57.14 1v6f s SER 2 Cb 0.00 0.11 -0.01 0.00 0.21 0.00 0.00 66.02 66.33 1v6f s SER 2 CO 0.00 -0.17 0.46 -0.94 0.41 0.00 0.00 173.24 173.00 1v6f s SER 3 N -0.75 5.98 0.00 2.44 1.04 -1.26 -5.11 113.70 116.04 1v6f s SER 3 Ca -0.08 -0.18 0.00 0.00 0.48 0.00 0.00 55.95 56.17 1v6f s SER 3 Cb -0.05 -1.26 0.00 0.00 0.10 0.00 0.00 66.02 64.81 1v6f s SER 3 CO -0.00 -0.41 0.00 0.61 0.98 0.00 0.00 173.24 174.42 1v6f n GLY 4 N -1.62 4.14 3.56 7.32 0.00 -1.26 -5.14 105.19 112.18 1v6f n GLY 4 Ca -0.01 -0.51 -0.34 0.00 0.00 0.00 0.00 46.02 45.17 1v6f n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1v6f s SER 5 N 1.00 4.76 0.72 1.61 0.01 -1.26 -5.12 113.70 115.42 1v6f s SER 5 Ca 0.00 -0.05 -0.00 0.00 1.31 0.00 0.00 55.95 57.21 1v6f s SER 5 Cb 0.00 -1.45 0.13 0.00 0.21 0.00 0.00 66.02 64.91 1v6f s SER 5 CO 0.00 0.29 0.99 -0.44 0.41 0.00 0.00 173.24 174.49 1v6f s SER 6 N -0.37 4.35 0.00 2.44 0.01 -1.26 -5.10 113.70 113.78 1v6f s SER 6 Ca 0.06 -0.39 0.00 0.00 1.31 0.00 0.00 55.95 56.92 1v6f s SER 6 Cb -0.12 0.02 0.00 0.00 0.21 0.00 0.00 66.02 66.13 1v6f s SER 6 CO 0.02 -1.86 0.00 0.61 0.41 0.00 0.00 173.24 172.42 1v6f n GLY 7 N -2.82 2.71 3.62 3.44 0.00 -1.26 -5.01 105.19 105.87 1v6f n GLY 7 Ca 0.15 -0.20 -0.24 0.00 0.00 0.00 0.00 46.02 45.73 1v6f n GLY 7 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1v6f n SER 8 N 0.00 -5.63 -3.67 1.61 2.88 -1.26 -4.99 113.62 102.56 1v6f n SER 8 Ca 0.00 -0.58 -0.08 0.00 -1.33 0.00 0.00 58.87 56.88 1v6f n SER 8 Cb 0.00 -4.91 -0.09 0.00 -0.75 0.00 0.00 64.21 58.46 1v6f n SER 8 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 1v6f s GLU 9 N -6.23 0.44 -1.66 -1.46 0.41 -1.26 -4.92 118.70 104.01 1v6f s GLU 9 Ca 0.52 1.00 -0.13 0.00 -0.41 0.00 0.00 54.97 55.95 1v6f s GLU 9 Cb -0.23 0.19 0.12 0.00 -1.78 0.00 0.00 34.13 32.42 1v6f s GLU 9 CO 0.74 -0.19 0.51 -1.13 -0.49 0.00 0.00 175.26 174.71 1v6f n SER 10 N 4.71 -1.52 -4.77 -0.19 3.41 -1.26 -4.89 113.62 109.11 1v6f n SER 10 Ca -0.17 -1.12 -0.32 0.00 -0.26 0.00 0.00 58.87 56.99 1v6f n SER 10 Cb 0.54 -2.29 0.06 0.00 -0.26 0.00 0.00 64.21 62.26 1v6f n SER 10 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1v6f s LEU 11 N -7.23 3.26 -0.40 1.04 1.43 -1.26 -5.03 118.68 110.50 1v6f s LEU 11 Ca 0.48 1.93 0.04 0.00 -1.03 0.00 0.00 54.13 55.55 1v6f s LEU 11 Cb -0.27 -4.54 0.11 0.00 0.03 0.00 0.00 46.19 41.52 1v6f s LEU 11 CO 0.96 -1.77 0.12 -0.69 0.23 0.00 0.00 176.35 175.20 1v6f s VAL 12 N -2.55 2.29 0.10 -1.59 1.01 -1.25 -5.06 120.40 113.36 1v6f s VAL 12 Ca 0.65 -2.61 0.01 0.00 0.00 0.00 0.00 61.98 60.02 1v6f s VAL 12 Cb -0.19 -2.66 -0.04 0.00 0.00 0.00 0.00 36.38 33.49 1v6f s VAL 12 CO 0.47 -0.67 0.25 0.54 0.00 0.00 0.00 175.10 175.68 1v6f s VAL 13 N 0.55 5.36 0.32 2.92 0.11 -1.26 -3.95 120.40 124.45 1v6f s VAL 13 Ca 0.13 -0.51 0.05 0.00 -2.93 0.00 0.00 61.98 58.71 1v6f s VAL 13 Cb -0.21 -3.68 -0.03 0.00 -1.53 0.00 0.00 36.38 30.93 1v6f s VAL 13 CO -0.06 0.03 0.21 0.00 -3.33 0.00 0.00 175.10 171.96 1v6f s ASP 15 N -3.39 5.49 -0.10 0.00 1.11 -1.26 -4.82 116.67 113.70 1v6f s ASP 15 Ca 0.37 -0.24 -0.24 0.00 0.18 0.00 0.00 52.55 52.62 1v6f s ASP 15 Cb 0.03 -1.40 -0.03 0.00 1.07 0.00 0.00 42.92 42.60 1v6f s ASP 15 CO 0.22 -0.01 0.74 0.68 1.18 0.00 0.00 175.17 177.97 1v6f s VAL 16 N -2.06 5.00 0.39 -1.27 -7.23 -1.26 -1.29 120.40 112.69 1v6f s VAL 16 Ca 0.32 1.50 -0.27 0.00 -1.81 0.00 0.00 61.98 61.72 1v6f s VAL 16 Cb -0.08 -4.07 -0.10 0.00 0.56 0.00 0.00 36.38 32.69 1v6f s VAL 16 CO 0.24 0.19 1.39 0.00 -0.31 0.00 0.00 175.10 176.61 1v6f s ALA 17 N 1.20 3.41 0.19 1.32 0.00 0.61 -4.83 121.76 123.66 1v6f s ALA 17 Ca 0.38 1.40 -0.12 0.00 0.00 0.00 0.00 51.96 53.62 1v6f s ALA 17 Cb -0.17 -3.55 0.12 0.00 0.00 0.00 0.00 23.12 19.52 1v6f s ALA 17 CO 0.17 -0.94 1.85 1.05 0.00 0.00 0.00 175.76 177.89 1v6f h GLU 18 N 2.86 0.80 0.00 0.00 4.11 -1.96 0.43 114.58 120.82 1v6f h GLU 18 Ca -0.50 -0.05 -0.01 0.00 0.07 0.00 0.00 59.36 58.87 1v6f h GLU 18 Cb 1.24 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 30.31 1v6f h GLU 18 CO 0.63 0.53 -0.06 -0.44 0.07 0.00 0.00 179.01 179.74 1v6f h ASP 19 N 0.83 0.00 0.00 3.06 3.32 -1.94 -2.96 116.42 118.73 1v6f h ASP 19 Ca 0.24 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.25 1v6f h ASP 19 Cb -0.06 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 1v6f h ASP 19 CO -0.07 0.06 -0.28 0.25 -1.72 0.00 0.00 179.24 177.48 1v6f h LEU 20 N 0.00 0.00 -0.99 1.55 6.46 -1.55 -3.36 115.31 117.43 1v6f h LEU 20 Ca -0.00 -0.42 0.09 0.00 -0.12 0.00 0.00 57.88 57.44 1v6f h LEU 20 Cb 0.16 0.00 -0.12 0.00 -0.73 0.00 0.00 40.66 39.97 1v6f h LEU 20 CO 0.01 0.87 -0.58 0.58 -0.62 0.00 0.00 178.44 178.69 1v6f h VAL 21 N -1.00 0.00 -0.97 1.05 2.07 -0.86 0.51 116.25 117.05 1v6f h VAL 21 Ca -0.06 0.00 0.31 0.00 0.82 0.00 0.00 66.70 67.77 1v6f h VAL 21 Cb 0.62 0.00 -0.17 0.00 -1.52 0.00 0.00 31.29 30.22 1v6f h VAL 21 CO -0.03 0.00 0.24 1.05 0.02 0.00 0.00 177.57 178.85 1v6f h GLU 22 N -0.01 0.06 -0.61 1.57 4.11 -1.71 1.25 114.58 119.25 1v6f h GLU 22 Ca 0.17 -0.00 -0.07 0.00 0.07 0.00 0.00 59.36 59.53 1v6f h GLU 22 Cb 0.42 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.63 1v6f h GLU 22 CO -0.94 0.04 0.11 0.87 0.07 0.00 0.00 179.01 179.16 1v6f h LYS 23 N 0.06 0.98 -0.19 1.06 1.57 -0.15 -2.62 116.57 117.29 1v6f h LYS 23 Ca 0.67 -0.24 -0.11 0.00 -1.87 0.00 0.00 60.65 59.10 1v6f h LYS 23 Cb 1.52 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 33.71 1v6f h LYS 23 CO -0.81 0.90 -0.30 -0.07 -0.57 0.00 0.00 179.45 178.60 1v6f h LEU 24 N 0.93 0.59 -0.50 2.94 3.38 0.22 -2.97 115.31 119.89 1v6f h LEU 24 Ca 0.19 -0.53 0.09 0.00 0.09 0.00 0.00 57.88 57.72 1v6f h LEU 24 Cb 0.39 -0.17 -0.07 0.00 0.09 0.00 0.00 40.66 40.90 1v6f h LEU 24 CO 0.01 1.00 0.07 0.03 0.09 0.00 0.00 178.44 179.64 1v6f h ARG 25 N 0.19 0.20 -0.80 1.13 3.08 -0.33 -0.77 114.38 117.08 1v6f h ARG 25 Ca 0.02 -0.01 0.01 0.00 0.07 0.00 0.00 59.98 60.06 1v6f h ARG 25 Cb 0.88 -0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.85 1v6f h ARG 25 CO 0.07 0.13 0.52 0.87 -1.07 0.00 0.00 179.97 180.49 1v6f h LYS 26 N 0.20 1.06 -0.57 0.04 1.79 -1.49 -2.11 116.57 115.49 1v6f h LYS 26 Ca 0.25 -0.07 0.12 0.00 -2.18 0.00 0.00 60.65 58.77 1v6f h LYS 26 Cb 0.35 -0.24 -0.10 0.00 -1.58 0.00 0.00 32.23 30.67 1v6f h LYS 26 CO -0.35 0.71 0.01 0.35 -1.08 0.00 0.00 179.45 179.08 1v6f h PHE 27 N 1.09 -0.03 -0.19 -1.35 3.04 -0.97 1.57 116.94 120.10 1v6f h PHE 27 Ca 0.29 0.04 -0.10 0.00 3.98 0.00 0.00 57.97 62.19 1v6f h PHE 27 Cb -0.11 0.10 -0.00 0.00 2.56 0.00 0.00 35.95 38.50 1v6f h PHE 27 CO 0.00 -0.14 -0.26 0.00 -2.02 0.00 0.00 178.31 175.89 1v6f h ARG 28 N 0.12 0.51 -1.04 1.11 2.47 -1.32 -3.16 114.38 113.07 1v6f h ARG 28 Ca 0.30 -0.30 -0.56 0.00 -1.26 0.00 0.00 59.98 58.15 1v6f h ARG 28 Cb 0.47 0.02 -0.28 0.00 -1.65 0.00 0.00 29.97 28.53 1v6f h ARG 28 CO -0.48 0.89 0.72 1.19 0.56 0.00 0.00 179.97 182.85 1v6f n PHE 29 N -4.39 2.93 -2.73 3.04 3.72 -0.71 -4.98 117.46 114.35 1v6f n PHE 29 Ca -0.06 -2.38 -0.39 0.00 -0.05 0.00 0.00 57.45 54.57 1v6f n PHE 29 Cb 0.45 -1.17 -0.06 0.00 -0.94 0.00 0.00 39.48 37.76 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 -3.32 4.72 -0.44 -1.08 1.70 0.53 -4.87 118.95 116.18 1v6f s ARG 30 Ca 0.57 1.46 0.04 0.00 -0.47 0.00 0.00 55.73 57.33 1v6f s ARG 30 Cb 0.46 -3.07 0.49 0.00 -0.57 0.00 0.00 34.95 32.26 1v6f s ARG 30 CO 0.04 0.38 1.63 1.63 -1.08 0.00 0.00 175.30 177.90 1v6f n LYS 31 N 1.07 2.70 -4.48 3.89 4.76 -1.26 -4.99 118.16 119.85 1v6f n LYS 31 Ca -0.00 -3.50 -0.34 0.00 -2.87 0.00 0.00 58.31 51.60 1v6f n LYS 31 Cb 0.48 -2.15 -0.10 0.00 -1.84 0.00 0.00 35.03 31.41 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 -3.56 2.79 0.02 1.97 0.41 -1.26 -5.03 118.70 114.04 1v6f s GLU 32 Ca 0.55 -0.54 -0.17 0.00 -0.41 0.00 0.00 54.97 54.39 1v6f s GLU 32 Cb 0.45 -2.65 -0.32 0.00 -1.78 0.00 0.00 34.13 29.84 1v6f s GLU 32 CO 0.02 0.66 1.02 1.15 -0.49 0.00 0.00 175.26 177.61 1v6f h THR 33 N 4.03 1.34 -3.20 3.63 2.02 -2.06 -3.46 112.91 115.21 1v6f h THR 33 Ca -0.49 -2.54 -0.40 0.00 0.77 0.00 0.00 66.41 63.75 1v6f h THR 33 Cb 1.18 2.94 0.21 0.00 -1.74 0.00 0.00 68.15 70.73 1v6f h THR 33 CO 0.54 0.75 -0.03 -1.38 0.37 0.00 0.00 175.52 175.77 1v6f s HIS 34 N -2.73 0.09 0.91 3.16 -3.43 -1.26 -5.04 115.29 106.99 1v6f s HIS 34 Ca -0.11 0.69 -0.11 0.00 -0.80 0.00 0.00 55.06 54.74 1v6f s HIS 34 Cb 0.04 -3.06 0.20 0.00 -1.43 0.00 0.00 32.58 28.33 1v6f s HIS 34 CO 0.91 -4.49 1.23 0.09 -2.00 0.00 0.00 174.74 170.48 1v6f n ASN 35 N -5.28 0.56 -3.45 7.38 4.13 -1.26 -4.76 115.26 112.58 1v6f n ASN 35 Ca 0.10 -1.73 -0.12 0.00 1.68 0.00 0.00 54.58 54.52 1v6f n ASN 35 Cb 0.59 -0.90 -0.02 0.00 -1.54 0.00 0.00 39.78 37.90 1v6f n ASN 35 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1v6f s ALA 36 N -3.69 -1.59 -0.21 5.41 0.00 -1.26 0.29 121.76 120.70 1v6f s ALA 36 Ca 0.73 0.48 -0.08 0.00 0.00 0.00 0.00 51.96 53.09 1v6f s ALA 36 Cb -0.03 0.86 0.09 0.00 0.00 0.00 0.00 23.12 24.04 1v6f s ALA 36 CO 0.51 -0.78 0.46 0.00 0.00 0.00 0.00 175.76 175.95 1v6f s ALA 37 N -3.72 -1.28 -0.21 0.00 0.00 -0.93 -3.26 121.76 112.34 1v6f s ALA 37 Ca 0.02 1.67 -0.02 0.00 0.00 0.00 0.00 51.96 53.63 1v6f s ALA 37 Cb -0.01 -1.29 0.00 0.00 0.00 0.00 0.00 23.12 21.82 1v6f s ALA 37 CO -0.12 -0.63 -0.08 0.42 0.00 0.00 0.00 175.76 175.35 1v6f s ILE 38 N 2.28 2.99 -0.22 0.00 1.01 -0.98 -0.98 121.20 125.30 1v6f s ILE 38 Ca -0.05 -0.66 -0.09 0.00 0.00 0.00 0.00 60.65 59.85 1v6f s ILE 38 Cb -0.11 -2.36 -0.05 0.00 0.01 0.00 0.00 42.46 39.96 1v6f s ILE 38 CO -0.14 0.43 0.13 -0.63 0.00 0.00 0.00 174.94 174.72 1v6f s ILE 39 N 1.42 5.15 0.07 2.92 1.01 -1.12 -1.04 121.20 129.61 1v6f s ILE 39 Ca 0.05 0.10 0.07 0.00 0.00 0.00 0.00 60.65 60.88 1v6f s ILE 39 Cb -0.14 -3.38 -0.04 0.00 0.01 0.00 0.00 42.46 38.91 1v6f s ILE 39 CO -0.06 0.39 -0.15 -0.04 0.00 0.00 0.00 174.94 175.08 1v6f s MET 40 N 0.84 2.07 0.05 2.79 -1.94 -0.67 -0.30 119.30 122.14 1v6f s MET 40 Ca 0.06 -1.01 -0.10 0.00 -1.71 0.00 0.00 55.69 52.94 1v6f s MET 40 Cb -0.13 -2.23 0.00 0.00 2.01 0.00 0.00 34.83 34.48 1v6f s MET 40 CO 0.02 0.52 0.21 -1.59 -0.01 0.00 0.00 175.02 174.18 1v6f s LYS 41 N -1.79 0.75 -0.01 2.03 0.00 -0.36 -2.81 119.74 117.55 1v6f s LYS 41 Ca 0.17 -0.71 0.01 0.00 0.00 0.00 0.00 55.97 55.44 1v6f s LYS 41 Cb -0.11 0.31 -0.04 0.00 0.00 0.00 0.00 37.83 38.00 1v6f s LYS 41 CO 0.09 -0.23 0.03 0.42 0.00 0.00 0.00 175.35 175.66 1v6f s ILE 42 N -2.93 4.39 0.35 3.79 1.01 -1.26 -1.25 121.20 125.30 1v6f s ILE 42 Ca -0.02 -0.51 0.04 0.00 0.00 0.00 0.00 60.65 60.16 1v6f s ILE 42 Cb 0.01 -2.97 -0.01 0.00 0.01 0.00 0.00 42.46 39.49 1v6f s ILE 42 CO -0.06 0.38 0.51 -0.62 0.00 0.00 0.00 174.94 175.15 1v6f s ASP 43 N -1.59 6.04 0.15 3.58 2.15 -1.24 -4.97 116.67 120.79 1v6f s ASP 43 Ca 0.20 0.07 0.24 0.00 0.43 0.00 0.00 52.55 53.49 1v6f s ASP 43 Cb -0.12 -1.53 0.29 0.00 -0.30 0.00 0.00 42.92 41.26 1v6f s ASP 43 CO 0.11 -0.42 1.29 0.07 -0.17 0.00 0.00 175.17 176.05 1v6f h LYS 44 N 0.80 0.00 0.00 4.34 2.10 -1.98 -2.75 116.57 119.08 1v6f h LYS 44 Ca -0.48 0.00 -0.25 0.00 -2.00 0.00 0.00 60.65 57.92 1v6f h LYS 44 Cb 1.25 0.00 -0.05 0.00 -0.90 0.00 0.00 32.23 32.53 1v6f h LYS 44 CO 0.57 0.00 -1.96 -0.25 -2.00 0.00 0.00 179.45 175.81 1v6f n ASP 45 N -2.25 2.63 0.04 7.07 8.00 -1.26 -4.51 116.55 126.27 1v6f n ASP 45 Ca 0.03 -0.08 0.13 0.00 0.71 0.00 0.00 54.79 55.58 1v6f n ASP 45 Cb 0.46 -0.28 0.43 0.00 -0.02 0.00 0.00 41.12 41.71 1v6f n ASP 45 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1v6f n GLU 46 N -3.03 0.12 -3.41 -1.24 4.71 -1.26 -4.91 120.64 111.63 1v6f n GLU 46 Ca -0.30 0.07 -0.25 0.00 -0.01 0.00 0.00 57.16 56.67 1v6f n GLU 46 Cb 0.81 -1.61 -0.05 0.00 -1.01 0.00 0.00 31.44 29.58 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 -1.80 -0.85 -3.84 3.49 -4.01 -1.04 -4.84 116.66 103.77 1v6f n ARG 47 Ca 0.06 0.08 -0.12 0.00 -1.04 0.00 0.00 57.85 56.83 1v6f n ARG 47 Cb 0.38 -2.77 -0.11 0.00 -3.04 0.00 0.00 32.46 26.92 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 -4.97 1.41 0.30 2.89 2.96 -1.26 -4.47 118.68 115.54 1v6f s LEU 48 Ca 0.43 0.08 -0.29 0.00 -0.22 0.00 0.00 54.13 54.12 1v6f s LEU 48 Cb -0.25 0.67 -0.10 0.00 0.50 0.00 0.00 46.19 47.02 1v6f s LEU 48 CO 0.63 -0.23 1.27 -0.69 -1.32 0.00 0.00 176.35 176.01 1v6f s VAL 49 N -0.68 2.92 0.14 1.68 1.01 -0.41 -3.67 120.40 121.40 1v6f s VAL 49 Ca -0.08 0.90 -0.07 0.00 0.00 0.00 0.00 61.98 62.74 1v6f s VAL 49 Cb -0.04 -3.58 -0.02 0.00 0.00 0.00 0.00 36.38 32.74 1v6f s VAL 49 CO 0.01 0.21 0.21 0.68 0.00 0.00 0.00 175.10 176.20 1v6f s VAL 50 N -0.98 0.09 -0.27 2.92 -7.23 -0.38 -0.29 120.40 114.26 1v6f s VAL 50 Ca 0.49 -1.50 -0.24 0.00 -1.81 0.00 0.00 61.98 58.92 1v6f s VAL 50 Cb -0.38 -1.81 -0.00 0.00 0.56 0.00 0.00 36.38 34.75 1v6f s VAL 50 CO 0.49 -0.41 0.81 -0.22 -0.31 0.00 0.00 175.10 175.46 1v6f s LEU 51 N -2.97 4.07 -0.02 1.32 1.98 -1.26 -1.22 118.68 120.58 1v6f s LEU 51 Ca 0.17 0.87 -0.21 0.00 -2.89 0.00 0.00 54.13 52.08 1v6f s LEU 51 Cb 0.05 -3.14 -0.27 0.00 0.66 0.00 0.00 46.19 43.48 1v6f s LEU 51 CO -0.01 -0.56 1.01 -0.78 -1.89 0.00 0.00 176.35 174.11 1v6f h ASP 52 N 7.88 0.50 -4.65 3.68 1.82 -1.00 -3.48 116.42 121.17 1v6f h ASP 52 Ca -0.24 -0.85 0.13 0.00 -0.39 0.00 0.00 57.03 55.69 1v6f h ASP 52 Cb 1.09 -0.16 -0.15 0.00 0.68 0.00 0.00 39.33 40.80 1v6f h ASP 52 CO 0.88 1.30 0.53 -1.83 -1.61 0.00 0.00 179.24 178.51 1v6f s GLU 53 N -2.86 0.78 -0.12 0.28 -1.05 -1.24 -5.05 118.70 109.45 1v6f s GLU 53 Ca -0.13 -0.30 0.02 0.00 -0.15 0.00 0.00 54.97 54.41 1v6f s GLU 53 Cb 0.02 0.35 0.01 0.00 -0.44 0.00 0.00 34.13 34.08 1v6f s GLU 53 CO 0.83 -0.34 -0.18 -1.21 0.95 0.00 0.00 175.26 175.30 1v6f s GLU 54 N -3.05 2.52 0.09 -4.83 2.02 -1.26 -2.79 118.70 111.40 1v6f s GLU 54 Ca 0.06 -0.67 0.03 0.00 0.02 0.00 0.00 54.97 54.41 1v6f s GLU 54 Cb -0.01 -2.08 -0.04 0.00 0.10 0.00 0.00 34.13 32.10 1v6f s GLU 54 CO -0.08 -0.03 0.06 -0.51 0.02 0.00 0.00 175.26 174.73 1v6f s LEU 55 N 0.87 3.73 0.04 1.80 1.43 -0.15 -4.99 118.68 121.41 1v6f s LEU 55 Ca -0.08 -0.05 0.05 0.00 -1.03 0.00 0.00 54.13 53.02 1v6f s LEU 55 Cb -0.15 -2.42 -0.02 0.00 0.03 0.00 0.00 46.19 43.63 1v6f s LEU 55 CO -0.01 0.17 -0.14 -1.61 0.23 0.00 0.00 176.35 174.99 1v6f s GLU 56 N -2.40 0.91 -1.41 1.70 2.02 -1.26 -2.19 118.70 116.07 1v6f s GLU 56 Ca 0.29 -0.75 -0.04 0.00 0.02 0.00 0.00 54.97 54.48 1v6f s GLU 56 Cb -0.12 -0.91 0.00 0.00 0.10 0.00 0.00 34.13 33.20 1v6f s GLU 56 CO 0.21 0.22 0.36 0.41 0.02 0.00 0.00 175.26 176.49 1v6f n GLY 57 N 1.89 -0.31 3.94 -1.39 0.00 0.14 -4.90 105.19 104.57 1v6f n GLY 57 Ca -0.18 0.20 -0.24 0.00 0.00 0.00 0.00 46.02 45.80 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 -4.00 1.93 0.25 1.61 -7.23 -1.26 -4.81 120.40 106.89 1v6f s VAL 58 Ca 0.08 -1.34 0.09 0.00 -1.81 0.00 0.00 61.98 59.00 1v6f s VAL 58 Cb -0.03 -2.27 -0.05 0.00 0.56 0.00 0.00 36.38 34.59 1v6f s VAL 58 CO 0.92 0.00 -0.14 -0.44 -0.31 0.00 0.00 175.10 175.14 1v6f s SER 59 N -4.36 2.97 0.41 4.85 0.01 -1.26 -4.63 113.70 111.68 1v6f s SER 59 Ca 0.44 -1.07 0.29 0.00 1.31 0.00 0.00 55.95 56.91 1v6f s SER 59 Cb -0.03 -0.20 1.21 0.00 0.21 0.00 0.00 66.02 67.20 1v6f s SER 59 CO 0.27 -0.16 1.86 1.55 0.41 0.00 0.00 173.24 177.17 1v6f h PRO 60 N 2.38 0.00 0.00 12.44 0.13 -1.93 0.31 132.00 145.33 1v6f h PRO 60 Ca -0.39 0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 64.48 1v6f h PRO 60 Cb 1.24 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.32 1v6f h PRO 60 CO 0.63 0.00 -1.61 0.38 -0.23 0.00 0.00 178.00 177.17 1v6f h ASP 61 N 0.00 0.00 0.37 1.44 3.04 -1.92 -3.35 116.42 115.99 1v6f h ASP 61 Ca 0.00 0.00 -0.13 0.00 -3.24 0.00 0.00 57.03 53.66 1v6f h ASP 61 Cb 0.42 0.00 -0.02 0.00 -1.04 0.00 0.00 39.33 38.69 1v6f h ASP 61 CO 0.00 0.89 -1.75 -0.62 -2.04 0.00 0.00 179.24 175.72 1v6f n GLU 62 N -3.01 0.65 -0.00 4.15 1.02 -1.06 -4.30 120.64 118.07 1v6f n GLU 62 Ca -0.14 0.02 -0.11 0.00 -0.02 0.00 0.00 57.16 56.90 1v6f n GLU 62 Cb 0.99 -1.66 -0.06 0.00 -0.02 0.00 0.00 31.44 30.70 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 0.00 0.10 -1.82 -4.62 5.85 -0.54 -2.43 115.31 111.85 1v6f h LEU 63 Ca -0.17 -0.10 0.13 0.00 0.84 0.00 0.00 57.88 58.58 1v6f h LEU 63 Cb 1.45 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 42.42 1v6f h LEU 63 CO 0.02 0.18 0.39 0.07 -0.34 0.00 0.00 178.44 178.76 1v6f h LYS 64 N 0.02 0.19 0.00 1.25 2.10 -1.76 0.13 116.57 118.50 1v6f h LYS 64 Ca 0.03 -0.01 -0.02 0.00 -2.00 0.00 0.00 60.65 58.65 1v6f h LYS 64 Cb 0.10 -0.04 -0.00 0.00 -0.90 0.00 0.00 32.23 31.39 1v6f h LYS 64 CO -0.00 0.12 -0.08 0.22 -2.00 0.00 0.00 179.45 177.71 1v6f h ASP 65 N 0.19 0.00 -0.38 7.07 1.82 -1.62 -0.32 116.42 123.18 1v6f h ASP 65 Ca 0.27 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.91 1v6f h ASP 65 Cb 0.79 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.80 1v6f h ASP 65 CO -0.05 0.08 0.00 -0.62 -1.61 0.00 0.00 179.24 177.05 1v6f n GLU 66 N -4.31 2.58 -4.42 0.28 -0.58 0.44 -4.88 120.64 109.74 1v6f n GLU 66 Ca -0.03 -1.67 -0.29 0.00 -0.42 0.00 0.00 57.16 54.75 1v6f n GLU 66 Cb 0.16 -1.62 -0.13 0.00 -0.57 0.00 0.00 31.44 29.29 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 -1.27 2.34 0.29 -4.62 1.43 -0.13 -5.11 118.68 111.61 1v6f s LEU 67 Ca 0.30 -0.72 -0.29 0.00 -1.03 0.00 0.00 54.13 52.39 1v6f s LEU 67 Cb 0.19 -1.26 -0.10 0.00 0.03 0.00 0.00 46.19 45.06 1v6f s LEU 67 CO 0.15 0.19 1.24 -2.16 0.23 0.00 0.00 176.35 175.99 1v6f s PRO 68 N -2.00 4.46 -0.20 1.29 0.04 -1.26 -4.94 135.00 132.38 1v6f s PRO 68 Ca 0.14 2.06 0.16 0.00 0.04 0.00 0.00 61.00 63.39 1v6f s PRO 68 Cb -0.10 -3.13 0.61 0.00 0.04 0.00 0.00 34.50 31.92 1v6f s PRO 68 CO 0.06 -0.06 1.52 -0.85 0.04 0.00 0.00 177.00 177.71 1v6f n GLU 69 N 1.21 3.44 0.00 4.56 0.28 -1.26 -4.46 120.64 124.41 1v6f n GLU 69 Ca 0.01 -2.95 0.00 0.00 -0.16 0.00 0.00 57.16 54.06 1v6f n GLU 69 Cb 0.43 -1.97 0.00 0.00 1.43 0.00 0.00 31.44 31.33 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 -0.23 1.39 -4.36 3.44 3.00 -1.26 -4.78 116.66 113.86 1v6f n ARG 70 Ca 0.24 0.00 -0.26 0.00 -0.01 0.00 0.00 57.85 57.82 1v6f n ARG 70 Cb 0.99 -0.76 -0.13 0.00 0.00 0.00 0.00 32.46 32.56 1v6f n ARG 70 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.63 176.98 1v6f s GLN 71 N -1.53 1.25 0.20 5.56 -0.21 -1.26 -3.33 119.66 120.34 1v6f s GLN 71 Ca 0.00 -1.20 -0.30 0.00 0.02 0.00 0.00 55.36 53.87 1v6f s GLN 71 Cb 0.00 -1.57 -0.09 0.00 1.00 0.00 0.00 33.01 32.35 1v6f s GLN 71 CO 0.00 0.37 1.30 -1.25 -2.12 0.00 0.00 175.29 173.59 1v6f s PRO 72 N -1.89 4.40 0.05 2.91 0.04 -1.26 -4.52 135.00 134.73 1v6f s PRO 72 Ca 0.09 2.05 -0.00 0.00 0.04 0.00 0.00 61.00 63.17 1v6f s PRO 72 Cb -0.10 -3.19 -0.04 0.00 0.04 0.00 0.00 34.50 31.21 1v6f s PRO 72 CO 0.05 -0.24 -0.04 0.50 0.04 0.00 0.00 177.00 177.31 1v6f s ARG 73 N -0.17 0.61 -0.10 4.56 6.06 0.53 -4.99 118.95 125.44 1v6f s ARG 73 Ca 0.56 -1.17 -0.09 0.00 -2.50 0.00 0.00 55.73 52.53 1v6f s ARG 73 Cb -0.36 0.13 -0.04 0.00 0.06 0.00 0.00 34.95 34.73 1v6f s ARG 73 CO 0.38 -0.09 0.20 -0.06 -2.50 0.00 0.00 175.30 173.24 1v6f s PHE 74 N -3.60 3.61 -0.13 5.12 0.08 -1.13 -2.20 117.98 119.74 1v6f s PHE 74 Ca 0.05 0.62 -0.06 0.00 0.12 0.00 0.00 56.93 57.66 1v6f s PHE 74 Cb 0.06 -2.04 0.05 0.00 -0.57 0.00 0.00 43.02 40.52 1v6f s PHE 74 CO -0.08 0.67 0.29 0.42 -0.10 0.00 0.00 175.22 176.42 1v6f s ILE 75 N -0.89 -0.10 -0.42 0.64 1.09 -1.16 -1.67 121.20 118.69 1v6f s ILE 75 Ca 0.16 0.15 -0.04 0.00 -1.10 0.00 0.00 60.65 59.83 1v6f s ILE 75 Cb -0.13 -0.45 0.11 0.00 -1.06 0.00 0.00 42.46 40.93 1v6f s ILE 75 CO 0.06 0.06 0.22 -0.69 -0.10 0.00 0.00 174.94 174.49 1v6f s VAL 76 N 1.48 3.39 0.13 2.92 1.01 -0.21 -1.62 120.40 127.50 1v6f s VAL 76 Ca -0.08 -2.04 0.04 0.00 0.00 0.00 0.00 61.98 59.90 1v6f s VAL 76 Cb -0.10 -3.31 -0.04 0.00 0.00 0.00 0.00 36.38 32.93 1v6f s VAL 76 CO -0.10 -0.70 0.14 -0.47 0.00 0.00 0.00 175.10 173.97 1v6f s TYR 77 N 1.16 3.22 -0.41 5.22 5.04 -1.22 -2.32 117.35 128.04 1v6f s TYR 77 Ca 0.08 0.05 0.03 0.00 -2.44 0.00 0.00 57.07 54.79 1v6f s TYR 77 Cb -0.23 -1.58 0.12 0.00 0.35 0.00 0.00 41.96 40.61 1v6f s TYR 77 CO -0.04 0.52 0.16 0.45 -1.34 0.00 0.00 175.55 175.30 1v6f s SER 78 N -2.84 4.34 0.87 4.32 0.15 -1.20 -2.69 113.70 116.65 1v6f s SER 78 Ca 0.31 -2.47 -0.11 0.00 0.70 0.00 0.00 55.95 54.38 1v6f s SER 78 Cb -0.11 -1.45 0.12 0.00 -1.71 0.00 0.00 66.02 62.87 1v6f s SER 78 CO 0.24 -0.31 1.10 -0.47 1.20 0.00 0.00 173.24 174.99 1v6f s TYR 79 N 0.49 2.22 -0.50 3.44 5.04 -1.24 -4.59 117.35 122.21 1v6f s TYR 79 Ca 0.14 1.46 -0.08 0.00 -2.44 0.00 0.00 57.07 56.14 1v6f s TYR 79 Cb -0.22 -3.15 0.13 0.00 0.35 0.00 0.00 41.96 39.07 1v6f s TYR 79 CO -0.06 -2.35 0.36 0.21 -1.34 0.00 0.00 175.55 172.37 1v6f s LYS 80 N -4.84 2.49 -0.82 4.97 2.20 -1.26 -3.30 119.74 119.17 1v6f s LYS 80 Ca 0.63 -1.87 -0.21 0.00 -0.36 0.00 0.00 55.97 54.16 1v6f s LYS 80 Cb -0.19 -3.90 0.09 0.00 -1.51 0.00 0.00 37.83 32.32 1v6f s LYS 80 CO 0.57 -1.19 1.11 -0.47 -0.36 0.00 0.00 175.35 175.02 1v6f s TYR 81 N 1.16 2.82 0.21 4.03 6.14 0.04 -4.95 117.35 126.81 1v6f s TYR 81 Ca 0.08 -0.92 -0.19 0.00 0.64 0.00 0.00 57.07 56.67 1v6f s TYR 81 Cb -0.25 -4.36 -0.08 0.00 0.42 0.00 0.00 41.96 37.70 1v6f s TYR 81 CO -0.02 -1.64 0.70 -1.14 0.64 0.00 0.00 175.55 174.10 1v6f s GLN 82 N 3.68 4.24 0.00 4.97 2.00 -1.26 -2.03 119.66 131.26 1v6f s GLN 82 Ca 0.30 0.84 0.04 0.00 -2.00 0.00 0.00 55.36 54.54 1v6f s GLN 82 Cb -0.09 -2.91 -0.03 0.00 0.80 0.00 0.00 33.01 30.78 1v6f s GLN 82 CO -0.01 0.42 -0.11 -1.01 -0.50 0.00 0.00 175.29 174.08 1v6f s HIS 83 N -1.49 2.77 0.18 1.67 3.76 0.22 -4.97 115.29 117.44 1v6f s HIS 83 Ca 0.42 -0.11 -0.24 0.00 -0.15 0.00 0.00 55.06 54.98 1v6f s HIS 83 Cb -0.17 -1.58 0.08 0.00 1.11 0.00 0.00 32.58 32.02 1v6f s HIS 83 CO 0.21 0.31 1.57 0.22 -0.85 0.00 0.00 174.74 176.20 1v6f h ASP 84 N 4.69 -1.44 -1.00 1.40 3.58 -1.98 0.29 116.42 121.97 1v6f h ASP 84 Ca -0.48 0.25 0.39 0.00 0.42 0.00 0.00 57.03 57.61 1v6f h ASP 84 Cb 1.16 0.68 -0.17 0.00 1.72 0.00 0.00 39.33 42.71 1v6f h ASP 84 CO 0.51 -0.32 0.49 -0.78 -2.88 0.00 0.00 179.24 176.27 1v6f h ASP 85 N -0.18 0.28 0.00 2.28 1.82 -2.05 -3.44 116.42 115.13 1v6f h ASP 85 Ca 0.21 0.25 0.00 0.00 -0.39 0.00 0.00 57.03 57.10 1v6f h ASP 85 Cb 0.56 0.27 0.00 0.00 0.68 0.00 0.00 39.33 40.84 1v6f h ASP 85 CO -0.73 -0.37 0.00 0.61 -1.61 0.00 0.00 179.24 177.13 1v6f n GLY 86 N -1.29 1.75 3.73 -0.78 0.00 0.10 -5.12 105.19 103.59 1v6f n GLY 86 Ca 0.35 -0.09 -0.42 0.00 0.00 0.00 0.00 46.02 45.87 1v6f n GLY 86 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1v6f s ARG 87 N 0.00 4.27 -0.04 1.61 3.00 -1.25 -4.63 118.95 121.90 1v6f s ARG 87 Ca 0.00 2.27 0.00 0.00 -1.00 0.00 0.00 55.73 57.00 1v6f s ARG 87 Cb 0.00 -3.15 0.03 0.00 0.00 0.00 0.00 34.95 31.83 1v6f s ARG 87 CO 0.00 -0.46 -0.02 0.54 0.00 0.00 0.00 175.30 175.36 1v6f s VAL 88 N 0.50 0.35 0.12 7.11 0.11 -1.26 -0.61 120.40 126.72 1v6f s VAL 88 Ca 0.63 0.02 0.09 0.00 -2.93 0.00 0.00 61.98 59.79 1v6f s VAL 88 Cb -0.41 -0.43 -0.04 0.00 -1.53 0.00 0.00 36.38 33.97 1v6f s VAL 88 CO 0.37 0.20 -0.22 -0.94 -3.33 0.00 0.00 175.10 171.18 1v6f s SER 89 N 1.19 2.80 -0.74 3.54 1.04 -0.86 -4.95 113.70 115.73 1v6f s SER 89 Ca -0.07 -0.73 -0.09 0.00 0.48 0.00 0.00 55.95 55.54 1v6f s SER 89 Cb -0.14 -0.17 0.19 0.00 0.10 0.00 0.00 66.02 66.01 1v6f s SER 89 CO -0.02 0.08 0.62 -0.31 0.98 0.00 0.00 173.24 174.60 1v6f s TYR 90 N -1.26 3.60 0.01 5.02 2.02 -1.26 -0.78 117.35 124.70 1v6f s TYR 90 Ca 0.10 -2.33 -0.30 0.00 -0.37 0.00 0.00 57.07 54.17 1v6f s TYR 90 Cb -0.09 -3.53 -0.06 0.00 -0.40 0.00 0.00 41.96 37.87 1v6f s TYR 90 CO 0.05 -0.92 1.44 -1.25 -1.57 0.00 0.00 175.55 173.30 1v6f s PRO 91 N 0.05 4.27 -0.03 -1.71 0.04 -1.21 -4.82 135.00 131.58 1v6f s PRO 91 Ca 0.17 2.02 -0.30 0.00 0.04 0.00 0.00 61.00 62.93 1v6f s PRO 91 Cb -0.15 -3.59 -0.03 0.00 0.04 0.00 0.00 34.50 30.77 1v6f s PRO 91 CO -0.06 -0.61 1.10 -0.51 0.04 0.00 0.00 177.00 176.95 1v6f s LEU 92 N 2.50 4.31 0.17 -3.56 2.01 -1.26 -3.72 118.68 119.12 1v6f s LEU 92 Ca 0.65 1.74 0.06 0.00 0.01 0.00 0.00 54.13 56.59 1v6f s LEU 92 Cb -0.32 -3.56 -0.05 0.00 0.01 0.00 0.00 46.19 42.27 1v6f s LEU 92 CO 0.27 -0.45 -0.12 0.00 1.01 0.00 0.00 176.35 177.06 1v6f s PHE 94 N -3.14 3.25 -0.50 0.00 2.19 0.13 -3.38 117.98 116.53 1v6f s PHE 94 Ca 0.19 -1.41 -0.16 0.00 0.33 0.00 0.00 56.93 55.87 1v6f s PHE 94 Cb 0.01 -2.28 0.09 0.00 -1.31 0.00 0.00 43.02 39.53 1v6f s PHE 94 CO 0.03 -0.73 0.46 0.42 1.83 0.00 0.00 175.22 177.24 1v6f s ILE 95 N 1.41 5.17 -0.99 3.12 1.01 -0.64 0.10 121.20 130.38 1v6f s ILE 95 Ca -0.02 -1.12 -0.21 0.00 0.00 0.00 0.00 60.65 59.30 1v6f s ILE 95 Cb -0.19 -4.22 0.08 0.00 0.01 0.00 0.00 42.46 38.14 1v6f s ILE 95 CO 0.03 -0.71 1.33 0.12 0.00 0.00 0.00 174.94 175.71 1v6f s PHE 96 N 1.78 2.77 -0.46 3.97 5.36 0.83 -2.97 117.98 129.25 1v6f s PHE 96 Ca 0.05 -1.07 -0.28 0.00 -0.96 0.00 0.00 56.93 54.67 1v6f s PHE 96 Cb -0.25 -4.54 -0.01 0.00 -0.34 0.00 0.00 43.02 37.88 1v6f s PHE 96 CO 0.06 -1.76 1.69 0.45 -1.46 0.00 0.00 175.22 174.20 1v6f s SER 97 N 4.44 5.82 -0.31 6.13 0.15 -0.93 -2.73 113.70 126.28 1v6f s SER 97 Ca 0.41 0.79 0.01 0.00 0.70 0.00 0.00 55.95 57.85 1v6f s SER 97 Cb -0.02 -2.53 0.09 0.00 -1.71 0.00 0.00 66.02 61.85 1v6f s SER 97 CO -0.10 -1.86 0.07 -0.94 1.20 0.00 0.00 173.24 171.62 1v6f s SER 98 N 6.05 4.16 -0.21 5.45 1.04 -0.85 -0.35 113.70 128.99 1v6f s SER 98 Ca 0.69 -1.70 -0.29 0.00 0.48 0.00 0.00 55.95 55.13 1v6f s SER 98 Cb -0.16 -1.08 -0.03 0.00 0.10 0.00 0.00 66.02 64.85 1v6f s SER 98 CO 0.28 -0.39 1.60 -2.16 0.98 0.00 0.00 173.24 173.56 1v6f s PRO 99 N 1.42 3.83 0.62 4.02 0.04 -1.23 -4.14 135.00 139.56 1v6f s PRO 99 Ca 0.08 1.69 0.23 0.00 0.04 0.00 0.00 61.00 63.04 1v6f s PRO 99 Cb -0.18 -4.02 0.95 0.00 0.04 0.00 0.00 34.50 31.29 1v6f s PRO 99 CO -0.18 -1.25 1.44 0.28 0.04 0.00 0.00 177.00 177.33 1v6f h VAL 100 N 6.09 0.08 0.00 -0.36 2.07 -1.52 0.96 116.25 123.56 1v6f h VAL 100 Ca -0.34 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.18 1v6f h VAL 100 Cb 1.15 0.20 0.00 0.00 -1.52 0.00 0.00 31.29 31.13 1v6f h VAL 100 CO 1.00 0.00 0.00 0.61 0.02 0.00 0.00 177.57 179.20 1v6f n GLY 101 N -1.58 0.43 3.98 2.17 0.00 -1.26 -4.82 105.19 104.10 1v6f n GLY 101 Ca 0.13 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.95 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 -4.06 3.73 0.11 0.00 -2.85 -1.26 -5.01 119.74 110.40 1v6f s LYS 103 Ca 0.38 0.37 -0.14 0.00 -1.00 0.00 0.00 55.97 55.58 1v6f s LYS 103 Cb -0.09 -2.43 -0.07 0.00 -2.06 0.00 0.00 37.83 33.18 1v6f s LYS 103 CO 0.30 -0.02 1.44 -1.00 0.10 0.00 0.00 175.35 176.17 1v6f h PRO 104 N 1.19 0.78 -0.86 1.78 0.13 -1.99 -2.60 132.00 130.43 1v6f h PRO 104 Ca -0.47 -0.41 0.25 0.00 -0.87 0.00 0.00 66.00 64.49 1v6f h PRO 104 Cb 1.19 0.01 -0.03 0.00 0.13 0.00 0.00 31.00 32.30 1v6f h PRO 104 CO 0.64 1.04 0.79 1.49 -0.23 0.00 0.00 178.00 181.72 1v6f h GLU 105 N 0.55 0.00 0.04 0.86 4.57 -2.01 -0.49 114.58 118.09 1v6f h GLU 105 Ca 0.05 0.00 -0.33 0.00 -1.18 0.00 0.00 59.36 57.90 1v6f h GLU 105 Cb 0.90 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 29.45 1v6f h GLU 105 CO 0.08 0.00 -1.83 1.04 -1.18 0.00 0.00 179.01 177.12 1v6f n GLN 106 N -3.77 0.63 -0.39 1.92 1.13 -1.15 -4.04 117.38 111.71 1v6f n GLN 106 Ca 0.18 0.39 0.32 0.00 -1.94 0.00 0.00 57.00 55.95 1v6f n GLN 106 Cb 1.08 -1.67 0.59 0.00 0.11 0.00 0.00 30.24 30.35 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 -0.60 0.15 -0.14 -1.09 1.08 -0.71 1.40 115.11 115.20 1v6f h GLN 107 Ca -0.46 -0.01 -0.16 0.00 -1.45 0.00 0.00 58.65 56.58 1v6f h GLN 107 Cb 1.63 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 29.01 1v6f h GLN 107 CO -0.16 0.10 -0.58 0.52 -0.95 0.00 0.00 178.83 177.77 1v6f h MET 108 N 0.15 0.44 -0.39 1.46 2.86 -1.61 0.57 114.93 118.41 1v6f h MET 108 Ca 0.79 -0.29 -0.05 0.00 -2.06 0.00 0.00 59.70 58.09 1v6f h MET 108 Cb 2.24 0.04 -0.02 0.00 0.06 0.00 0.00 31.60 33.92 1v6f h MET 108 CO -0.50 0.89 0.01 1.98 1.06 0.00 0.00 176.91 180.36 1v6f h MET 109 N 0.33 0.62 0.02 1.72 1.85 0.17 -2.61 114.93 117.04 1v6f h MET 109 Ca 0.00 -0.14 -0.33 0.00 -0.61 0.00 0.00 59.70 58.62 1v6f h MET 109 Cb 1.10 -0.09 -0.05 0.00 0.43 0.00 0.00 31.60 33.00 1v6f h MET 109 CO 0.10 0.63 -1.94 0.66 -0.40 0.00 0.00 176.91 175.96 1v6f n TYR 110 N -4.26 0.80 0.15 1.39 4.02 -0.73 -3.74 117.16 114.78 1v6f n TYR 110 Ca 0.02 0.25 -0.08 0.00 -0.01 0.00 0.00 57.90 58.09 1v6f n TYR 110 Cb 0.26 -1.14 -0.04 0.00 -0.02 0.00 0.00 39.34 38.40 1v6f n TYR 110 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1v6f h ALA 111 N 0.76 -0.99 -0.27 -0.72 0.00 0.25 0.50 119.26 118.79 1v6f h ALA 111 Ca -0.38 -0.09 0.05 0.00 0.00 0.00 0.00 54.91 54.49 1v6f h ALA 111 Cb 2.06 0.38 -0.05 0.00 0.00 0.00 0.00 17.79 20.18 1v6f h ALA 111 CO 0.06 -0.98 -0.02 0.78 0.00 0.00 0.00 179.25 179.09 1v6f h GLY 112 N -0.45 0.25 0.85 0.00 0.00 -1.69 -2.15 103.07 99.87 1v6f h GLY 112 Ca -0.04 0.05 0.04 0.00 0.00 0.00 0.00 47.33 47.38 1v6f h GLY 112 CO 0.01 -0.07 0.60 1.76 0.00 0.00 0.00 176.54 178.84 1v6f h SER 113 N 0.06 1.00 -0.12 0.19 0.02 -1.63 -2.94 113.55 110.13 1v6f h SER 113 Ca 0.13 -0.00 0.03 0.00 -0.84 0.00 0.00 61.79 61.10 1v6f h SER 113 Cb 0.18 -0.22 -0.06 0.00 0.14 0.00 0.00 62.40 62.43 1v6f h SER 113 CO -0.23 0.67 -0.54 0.50 -1.14 0.00 0.00 176.83 176.09 1v6f h LYS 114 N 1.16 -0.58 -0.33 3.45 3.64 0.68 -2.67 116.57 121.92 1v6f h LYS 114 Ca 0.38 0.04 0.03 0.00 -1.27 0.00 0.00 60.65 59.83 1v6f h LYS 114 Cb 0.03 0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 31.94 1v6f h LYS 114 CO -0.13 -0.38 -0.20 -1.71 -2.27 0.00 0.00 179.45 174.76 1v6f n ASN 115 N -5.44 -0.35 -0.29 4.20 2.85 -1.11 0.92 115.26 116.04 1v6f n ASN 115 Ca -0.06 0.98 0.05 0.00 -0.11 0.00 0.00 54.58 55.44 1v6f n ASN 115 Cb 0.38 -0.27 0.15 0.00 1.24 0.00 0.00 39.78 41.28 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 0.04 -0.20 1.20 3.64 -1.58 0.11 116.57 119.78 1v6f h LYS 116 Ca 0.05 -0.00 0.06 0.00 -1.27 0.00 0.00 60.65 59.49 1v6f h LYS 116 Cb 0.14 -0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 31.88 1v6f h LYS 116 CO -0.31 0.02 -0.32 -0.07 -2.27 0.00 0.00 179.45 176.50 1v6f h LEU 117 N 0.04 -1.02 -1.41 5.20 3.38 0.82 0.36 115.31 122.68 1v6f h LEU 117 Ca 0.43 0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.56 1v6f h LEU 117 Cb 0.73 0.45 0.00 0.00 0.09 0.00 0.00 40.66 41.93 1v6f h LEU 117 CO -0.79 -0.35 0.51 0.58 0.09 0.00 0.00 178.44 178.48 1v6f h VAL 118 N -0.36 0.00 0.00 1.22 2.07 -0.10 0.64 116.25 119.72 1v6f h VAL 118 Ca 0.11 0.00 -0.34 0.00 0.82 0.00 0.00 66.70 67.29 1v6f h VAL 118 Cb 0.54 0.47 -0.06 0.00 -1.52 0.00 0.00 31.29 30.72 1v6f h VAL 118 CO -0.40 0.00 -2.13 0.00 0.02 0.00 0.00 177.57 175.06 1v6f n GLN 119 N -2.74 0.67 -0.03 1.57 1.13 0.11 -1.80 117.38 116.28 1v6f n GLN 119 Ca -0.01 0.12 -0.14 0.00 -1.94 0.00 0.00 57.00 55.03 1v6f n GLN 119 Cb 0.55 -1.63 -0.10 0.00 0.11 0.00 0.00 30.24 29.17 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 0.00 1.46 0.00 5.09 2.02 0.23 -3.12 112.91 118.59 1v6f h THR 120 Ca -0.45 -1.56 0.00 0.00 0.77 0.00 0.00 66.41 65.17 1v6f h THR 120 Cb 2.14 2.38 0.00 0.00 -1.74 0.00 0.00 68.15 70.93 1v6f h THR 120 CO 0.04 0.43 0.00 0.00 0.37 0.00 0.00 175.52 176.36 1v6f n ALA 121 N -2.45 2.26 -3.35 6.16 0.00 -0.10 -4.85 120.51 118.18 1v6f n ALA 121 Ca -0.08 -0.11 -0.18 0.00 0.00 0.00 0.00 53.44 53.07 1v6f n ALA 121 Cb 0.39 -1.42 0.08 0.00 0.00 0.00 0.00 19.45 18.50 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 -1.37 -6.39 -3.52 0.00 1.02 -1.18 -4.84 120.64 104.36 1v6f n GLU 122 Ca 0.10 0.75 -0.37 0.00 -0.02 0.00 0.00 57.16 57.62 1v6f n GLU 122 Cb 0.25 -5.49 -0.07 0.00 -0.02 0.00 0.00 31.44 26.11 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 -6.17 4.31 -0.14 -4.62 1.43 -0.74 -4.98 118.68 107.75 1v6f s LEU 123 Ca 0.22 0.65 -0.03 0.00 -1.03 0.00 0.00 54.13 53.94 1v6f s LEU 123 Cb -0.10 -2.45 -0.24 0.00 0.03 0.00 0.00 46.19 43.43 1v6f s LEU 123 CO 0.65 0.15 0.27 0.35 0.23 0.00 0.00 176.35 177.99 1v6f n THR 124 N 3.11 1.70 -3.37 5.49 -2.24 -1.26 -4.76 114.28 112.95 1v6f n THR 124 Ca -0.12 -0.66 -0.38 0.00 -2.27 0.00 0.00 64.05 60.63 1v6f n THR 124 Cb 0.52 -1.59 -0.07 0.00 -2.10 0.00 0.00 70.33 67.10 1v6f n THR 124 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1v6f s LYS 125 N -2.55 4.28 -0.22 -0.78 3.01 -1.26 -5.05 119.74 117.17 1v6f s LYS 125 Ca -0.23 0.32 -0.02 0.00 -1.01 0.00 0.00 55.97 55.03 1v6f s LYS 125 Cb 0.07 -3.46 0.07 0.00 -1.01 0.00 0.00 37.83 33.49 1v6f s LYS 125 CO 0.74 0.11 0.03 0.08 0.51 0.00 0.00 175.35 176.82 1v6f s VAL 126 N 0.81 0.73 0.13 3.17 1.01 -1.26 -0.70 120.40 124.30 1v6f s VAL 126 Ca 0.22 -0.79 0.08 0.00 0.00 0.00 0.00 61.98 61.50 1v6f s VAL 126 Cb -0.15 -1.25 -0.04 0.00 0.00 0.00 0.00 36.38 34.95 1v6f s VAL 126 CO 0.08 -0.26 -0.13 -0.36 0.00 0.00 0.00 175.10 174.43 1v6f s PHE 127 N 1.75 2.64 -0.01 5.22 0.08 0.12 -4.95 117.98 122.83 1v6f s PHE 127 Ca -0.00 -0.21 0.04 0.00 0.12 0.00 0.00 56.93 56.88 1v6f s PHE 127 Cb -0.17 -1.37 -0.01 0.00 -0.57 0.00 0.00 43.02 40.90 1v6f s PHE 127 CO -0.10 0.43 -0.14 -2.00 -0.10 0.00 0.00 175.22 173.31 1v6f s GLU 128 N -2.34 1.11 -0.05 0.44 -6.30 -1.26 -0.12 118.70 110.18 1v6f s GLU 128 Ca 0.21 -0.51 0.05 0.00 -2.50 0.00 0.00 54.97 52.22 1v6f s GLU 128 Cb -0.10 -1.08 -0.02 0.00 0.00 0.00 0.00 34.13 32.93 1v6f s GLU 128 CO 0.13 0.29 -0.20 0.96 0.02 0.00 0.00 175.26 176.47 1v6f s ILE 129 N -0.35 2.57 0.30 -3.70 -4.36 -1.10 -4.93 121.20 109.63 1v6f s ILE 129 Ca 0.05 -0.89 0.12 0.00 -0.26 0.00 0.00 60.65 59.66 1v6f s ILE 129 Cb -0.05 -1.97 0.02 0.00 1.25 0.00 0.00 42.46 41.70 1v6f s ILE 129 CO -0.00 0.58 1.69 0.08 0.24 0.00 0.00 174.94 177.52 1v6f h ARG 130 N 5.68 0.00 -3.31 0.37 0.11 -1.89 -2.27 114.38 113.07 1v6f h ARG 130 Ca -0.40 0.00 -0.19 0.00 0.10 0.00 0.00 59.98 59.49 1v6f h ARG 130 Cb 1.16 0.00 -0.26 0.00 1.11 0.00 0.00 29.97 31.97 1v6f h ARG 130 CO 0.49 0.52 -0.52 -0.80 0.10 0.00 0.00 179.97 179.77 1v6f s ASN 131 N -6.86 -0.18 0.57 0.08 0.01 -1.26 -1.25 114.94 106.04 1v6f s ASN 131 Ca -0.02 0.35 0.31 0.00 -0.71 0.00 0.00 52.86 52.79 1v6f s ASN 131 Cb 0.13 0.35 1.44 0.00 0.41 0.00 0.00 41.25 43.58 1v6f s ASN 131 CO 0.75 -0.06 1.80 0.71 -1.51 0.00 0.00 177.10 178.79 1v6f h THR 132 N 4.90 0.37 -0.26 1.60 1.35 -1.86 0.51 112.91 119.51 1v6f h THR 132 Ca -0.26 0.00 -0.04 0.00 -0.55 0.00 0.00 66.41 65.57 1v6f h THR 132 Cb 1.20 0.48 -0.01 0.00 -1.73 0.00 0.00 68.15 68.08 1v6f h THR 132 CO 0.40 0.00 0.00 -0.33 -0.25 0.00 0.00 175.52 175.34 1v6f h GLU 133 N 0.00 0.39 -0.81 4.72 5.08 -1.95 -2.37 114.58 119.65 1v6f h GLU 133 Ca 0.38 -0.07 0.03 0.00 -1.00 0.00 0.00 59.36 58.70 1v6f h GLU 133 Cb 1.76 -0.06 -0.05 0.00 0.50 0.00 0.00 28.75 30.90 1v6f h GLU 133 CO -0.00 0.42 0.53 0.22 -1.00 0.00 0.00 179.01 179.18 1v6f h ASP 134 N 0.38 0.86 -1.03 1.42 3.58 -0.38 -3.40 116.42 117.85 1v6f h ASP 134 Ca 0.09 -0.01 -0.39 0.00 0.42 0.00 0.00 57.03 57.13 1v6f h ASP 134 Cb 0.25 -0.20 -0.02 0.00 1.72 0.00 0.00 39.33 41.09 1v6f h ASP 134 CO 0.01 0.59 1.43 -0.11 -2.88 0.00 0.00 179.24 178.28 1v6f n LEU 135 N -4.45 1.68 -4.06 2.28 0.00 -0.89 -4.72 117.00 106.83 1v6f n LEU 135 Ca 0.10 -0.54 -0.10 0.00 0.00 0.00 0.00 56.01 55.48 1v6f n LEU 135 Cb 0.11 -1.42 -0.09 0.00 0.00 0.00 0.00 43.42 42.02 1v6f n LEU 135 CO 0.35 -1.58 -0.16 0.42 0.00 0.00 0.00 177.39 176.42 1v6f s THR 136 N 11.48 0.08 0.09 1.96 -4.23 -1.26 -4.31 115.64 119.46 1v6f s THR 136 Ca 1.06 -1.66 -0.34 0.00 -1.18 0.00 0.00 61.69 59.57 1v6f s THR 136 Cb -0.40 -1.96 -0.15 0.00 1.34 0.00 0.00 72.50 71.32 1v6f s THR 136 CO 0.29 -0.37 1.57 -0.08 -0.54 0.00 0.00 174.62 175.50 1v6f h GLU 137 N 2.70 -0.87 -0.99 3.99 4.81 -1.89 -0.50 114.58 121.84 1v6f h GLU 137 Ca -0.33 0.06 0.16 0.00 -0.13 0.00 0.00 59.36 59.12 1v6f h GLU 137 Cb 1.21 0.20 -0.09 0.00 0.63 0.00 0.00 28.75 30.70 1v6f h GLU 137 CO 0.53 -0.58 0.62 1.49 -0.73 0.00 0.00 179.01 180.34 1v6f h GLU 138 N -0.90 0.80 -0.68 1.92 4.22 -1.97 -0.39 114.58 117.57 1v6f h GLU 138 Ca -0.04 -0.05 -0.02 0.00 0.08 0.00 0.00 59.36 59.33 1v6f h GLU 138 Cb 0.81 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.85 1v6f h GLU 138 CO -0.11 0.53 0.34 2.35 -2.18 0.00 0.00 179.01 179.93 1v6f h TRP 139 N 0.82 0.97 0.47 0.92 7.01 -1.68 -2.39 115.95 122.07 1v6f h TRP 139 Ca 0.53 -0.04 -0.02 0.00 2.11 0.00 0.00 58.89 61.47 1v6f h TRP 139 Cb 0.74 -0.30 -0.01 0.00 -2.10 0.00 0.00 29.16 27.49 1v6f h TRP 139 CO -0.00 0.72 -0.41 -0.07 -2.79 0.00 0.00 178.44 175.89 1v6f h LEU 140 N 0.94 -1.09 -1.97 0.65 3.38 0.55 -1.59 115.31 116.18 1v6f h LEU 140 Ca 0.23 0.08 0.17 0.00 0.09 0.00 0.00 57.88 58.45 1v6f h LEU 140 Cb 0.10 0.35 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 1v6f h LEU 140 CO -0.03 -0.56 0.51 0.03 0.09 0.00 0.00 178.44 178.48 1v6f h ARG 141 N -0.86 0.00 -0.25 1.13 3.08 -1.47 0.05 114.38 116.07 1v6f h ARG 141 Ca -0.06 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 59.96 1v6f h ARG 141 Cb 0.73 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.77 1v6f h ARG 141 CO -0.01 0.00 0.03 1.49 -1.07 0.00 0.00 179.97 180.41 1v6f h GLU 142 N 0.00 0.41 -0.44 0.04 4.57 -0.77 -0.38 114.58 118.01 1v6f h GLU 142 Ca 0.28 -0.11 -0.07 0.00 -1.18 0.00 0.00 59.36 58.28 1v6f h GLU 142 Cb 1.29 -0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 29.82 1v6f h GLU 142 CO -0.00 0.55 0.02 0.87 -1.18 0.00 0.00 179.01 179.26 1v6f h LYS 143 N 0.21 0.76 -0.71 1.92 1.79 -0.43 -2.50 116.57 117.61 1v6f h LYS 143 Ca 0.07 -0.23 -0.05 0.00 -2.18 0.00 0.00 60.65 58.26 1v6f h LYS 143 Cb 0.34 -0.07 -0.03 0.00 -1.58 0.00 0.00 32.23 30.89 1v6f h LYS 143 CO 0.01 0.82 0.24 -0.07 -1.08 0.00 0.00 179.45 179.37 1v6f h LEU 144 N 0.61 1.01 -5.65 2.94 3.38 -1.35 -3.22 115.31 113.02 1v6f h LEU 144 Ca 0.13 -0.17 -0.67 0.00 0.09 0.00 0.00 57.88 57.26 1v6f h LEU 144 Cb 0.46 -0.26 -0.37 0.00 0.09 0.00 0.00 40.66 40.58 1v6f h LEU 144 CO 0.02 0.92 -0.05 0.61 0.09 0.00 0.00 178.44 180.03 1v6f n GLY 145 N -0.85 5.79 3.01 0.83 0.00 -0.16 -4.95 105.19 108.87 1v6f n GLY 145 Ca 0.06 -2.72 -0.32 0.00 0.00 0.00 0.00 46.02 43.04 1v6f n GLY 145 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1v6f s SER 146 N -2.71 4.71 0.00 1.61 1.04 -0.96 -4.82 113.70 112.57 1v6f s SER 146 Ca 0.45 -2.74 0.00 0.00 0.48 0.00 0.00 55.95 54.15 1v6f s SER 146 Cb 0.25 -1.71 0.00 0.00 0.10 0.00 0.00 66.02 64.66 1v6f s SER 146 CO -0.13 -0.32 0.00 0.61 0.98 0.00 0.00 173.24 174.38 1v6f n GLY 147 N 3.54 -2.34 0.00 7.32 0.00 -1.26 -4.63 105.19 107.82 1v6f n GLY 147 Ca 0.05 -1.25 0.04 0.00 0.00 0.00 0.00 46.02 44.86 1v6f n GLY 147 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1v6f n PRO 148 N -0.76 0.49 -1.76 1.61 -0.04 -1.26 -4.72 135.00 128.55 1v6f n PRO 148 Ca 0.00 0.00 -0.37 0.00 -0.04 0.00 0.00 63.50 63.09 1v6f n PRO 148 Cb 0.00 -1.28 -0.03 0.00 -0.04 0.00 0.00 33.50 32.15 1v6f n PRO 148 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1v6f s SER 149 N -1.79 4.80 0.07 3.54 0.01 -1.26 -4.91 113.70 114.16 1v6f s SER 149 Ca 0.13 0.78 -0.31 0.00 1.31 0.00 0.00 55.95 57.87 1v6f s SER 149 Cb 0.06 -2.51 -0.09 0.00 0.21 0.00 0.00 66.02 63.69 1v6f s SER 149 CO 0.10 -2.66 1.76 -0.55 0.41 0.00 0.00 173.24 172.30 1v6f s SER 150 N 10.43 6.53 0.00 2.44 0.15 -1.26 -5.06 113.70 126.93 1v6f s SER 150 Ca 0.85 2.58 0.00 0.00 0.70 0.00 0.00 55.95 60.07 1v6f s SER 150 Cb -0.15 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.60 1v6f s SER 150 CO 0.24 -0.96 0.00 0.61 1.20 0.00 0.00 173.24 174.33