#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 -0.28 -0.04 1.61 1.04 -1.26 -5.15 113.70 109.63 1v6f s SER 2 Ca 0.00 0.94 -0.18 0.00 0.48 0.00 0.00 55.95 57.19 1v6f s SER 2 Cb 0.00 1.14 -0.05 0.00 0.10 0.00 0.00 66.02 67.21 1v6f s SER 2 CO 0.00 -0.22 0.49 -0.55 0.98 0.00 0.00 173.24 173.94 1v6f s SER 3 N 2.27 6.82 -0.30 7.02 0.15 -1.26 -5.06 113.70 123.35 1v6f s SER 3 Ca -0.04 0.97 -0.07 0.00 0.70 0.00 0.00 55.95 57.52 1v6f s SER 3 Cb -0.11 -2.30 0.17 0.00 -1.71 0.00 0.00 66.02 62.07 1v6f s SER 3 CO -0.12 0.14 0.71 -0.83 1.20 0.00 0.00 173.24 174.34 1v6f s GLY 4 N -0.20 -0.75 -0.31 9.45 0.00 -1.26 -5.04 107.32 109.21 1v6f s GLY 4 Ca 0.27 2.24 0.12 0.00 0.00 0.00 0.00 44.72 47.34 1v6f s GLY 4 CO 0.13 3.34 1.13 1.44 0.00 0.00 0.00 173.10 179.14 1v6f n SER 5 N 5.39 3.63 -0.31 1.64 7.64 -1.26 -4.89 113.62 125.46 1v6f n SER 5 Ca -0.06 -3.16 0.14 0.00 1.01 0.00 0.00 58.87 56.80 1v6f n SER 5 Cb 0.51 -0.42 0.29 0.00 -1.01 0.00 0.00 64.21 63.59 1v6f n SER 5 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1v6f h SER 6 N 2.44 -0.20 0.00 6.43 0.02 -2.05 -3.46 113.55 116.72 1v6f h SER 6 Ca 0.17 0.23 0.00 0.00 -0.84 0.00 0.00 61.79 61.35 1v6f h SER 6 Cb 1.34 0.36 0.00 0.00 0.14 0.00 0.00 62.40 64.24 1v6f h SER 6 CO 0.58 -0.25 0.00 0.61 -1.14 0.00 0.00 176.83 176.63 1v6f n GLY 7 N -1.42 -1.09 3.59 -3.77 0.00 -1.26 -5.14 105.19 96.10 1v6f n GLY 7 Ca 0.22 0.50 -0.30 0.00 0.00 0.00 0.00 46.02 46.44 1v6f n GLY 7 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1v6f s SER 8 N -4.00 4.49 -0.46 1.61 0.01 -1.26 -5.10 113.70 108.99 1v6f s SER 8 Ca 0.00 -0.37 -0.09 0.00 1.31 0.00 0.00 55.95 56.80 1v6f s SER 8 Cb 0.00 -0.89 0.11 0.00 0.21 0.00 0.00 66.02 65.45 1v6f s SER 8 CO 0.00 0.17 0.33 -1.61 0.41 0.00 0.00 173.24 172.55 1v6f s GLU 9 N -2.27 2.52 -0.44 12.44 8.01 -1.26 -4.94 118.70 132.76 1v6f s GLU 9 Ca 0.22 -1.70 0.05 0.00 0.01 0.00 0.00 54.97 53.55 1v6f s GLU 9 Cb -0.11 -3.91 0.42 0.00 -4.31 0.00 0.00 34.13 26.22 1v6f s GLU 9 CO 0.15 -1.15 1.21 0.45 0.01 0.00 0.00 175.26 175.93 1v6f n SER 10 N 4.92 5.02 -4.37 -0.19 2.88 -1.26 -5.07 113.62 115.56 1v6f n SER 10 Ca -0.09 -3.74 -0.29 0.00 -1.33 0.00 0.00 58.87 53.43 1v6f n SER 10 Cb 0.41 -0.49 0.25 0.00 -0.75 0.00 0.00 64.21 63.63 1v6f n SER 10 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1v6f n LEU 11 N -0.54 -1.99 -3.83 2.46 4.32 -1.26 -5.00 117.00 111.15 1v6f n LEU 11 Ca 0.42 -0.23 -0.30 0.00 -0.02 0.00 0.00 56.01 55.87 1v6f n LEU 11 Cb 0.70 -1.16 -0.14 0.00 -1.62 0.00 0.00 43.42 41.19 1v6f n LEU 11 CO 0.37 -3.38 -0.30 -0.69 -1.22 0.00 0.00 177.39 172.17 1v6f s VAL 12 N -2.34 1.56 0.18 4.08 1.01 -1.23 -4.95 120.40 118.72 1v6f s VAL 12 Ca 0.66 -2.11 -0.03 0.00 0.00 0.00 0.00 61.98 60.50 1v6f s VAL 12 Cb -0.22 -2.14 -0.05 0.00 0.00 0.00 0.00 36.38 33.96 1v6f s VAL 12 CO 0.65 -0.71 0.40 0.54 0.00 0.00 0.00 175.10 175.98 1v6f s VAL 13 N 0.96 5.17 0.22 2.92 0.11 -1.26 -4.15 120.40 124.37 1v6f s VAL 13 Ca 0.12 -0.13 0.05 0.00 -2.93 0.00 0.00 61.98 59.10 1v6f s VAL 13 Cb -0.20 -3.68 -0.02 0.00 -1.53 0.00 0.00 36.38 30.95 1v6f s VAL 13 CO -0.12 -0.09 0.19 0.00 -3.33 0.00 0.00 175.10 171.74 1v6f s ASP 15 N -2.57 5.37 -0.25 0.00 1.11 -1.26 -4.91 116.67 114.16 1v6f s ASP 15 Ca 0.26 -0.59 -0.09 0.00 0.18 0.00 0.00 52.55 52.31 1v6f s ASP 15 Cb 0.01 -0.53 -0.04 0.00 1.07 0.00 0.00 42.92 43.43 1v6f s ASP 15 CO 0.19 -0.77 0.12 0.68 1.18 0.00 0.00 175.17 176.56 1v6f s VAL 16 N -2.43 4.81 0.11 -1.27 -7.23 -1.26 -1.37 120.40 111.76 1v6f s VAL 16 Ca 0.52 -0.01 -0.33 0.00 -1.81 0.00 0.00 61.98 60.36 1v6f s VAL 16 Cb -0.07 -3.25 -0.12 0.00 0.56 0.00 0.00 36.38 33.50 1v6f s VAL 16 CO 0.31 0.33 1.76 0.00 -0.31 0.00 0.00 175.10 177.19 1v6f n ALA 17 N 4.71 1.83 -0.16 1.32 0.00 0.08 -4.78 120.51 123.52 1v6f n ALA 17 Ca -0.15 0.36 -0.03 0.00 0.00 0.00 0.00 53.44 53.61 1v6f n ALA 17 Cb 0.52 -2.50 0.04 0.00 0.00 0.00 0.00 19.45 17.51 1v6f n ALA 17 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 1v6f h GLU 18 N 7.71 0.02 -1.01 0.00 4.11 -1.97 0.27 114.58 123.71 1v6f h GLU 18 Ca -0.46 -0.00 0.25 0.00 0.07 0.00 0.00 59.36 59.22 1v6f h GLU 18 Cb 1.24 -0.00 -0.08 0.00 0.50 0.00 0.00 28.75 30.40 1v6f h GLU 18 CO 0.93 0.01 0.66 -0.44 0.07 0.00 0.00 179.01 180.25 1v6f h ASP 19 N 0.02 0.37 0.00 3.06 5.19 -1.96 -1.99 116.42 121.12 1v6f h ASP 19 Ca 0.24 0.06 -0.04 0.00 -0.62 0.00 0.00 57.03 56.67 1v6f h ASP 19 Cb 0.37 -0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.87 1v6f h ASP 19 CO -0.49 0.10 -0.24 0.25 -3.12 0.00 0.00 179.24 175.73 1v6f h LEU 20 N 0.34 0.00 -0.98 1.55 5.85 -1.06 -3.37 115.31 117.64 1v6f h LEU 20 Ca 0.55 -0.65 0.16 0.00 0.84 0.00 0.00 57.88 58.77 1v6f h LEU 20 Cb 1.48 0.00 -0.16 0.00 0.37 0.00 0.00 40.66 42.35 1v6f h LEU 20 CO -0.22 0.97 -0.37 0.52 -0.34 0.00 0.00 178.44 179.00 1v6f n VAL 21 N -4.62 -0.51 -0.36 1.05 0.31 0.64 0.14 118.33 114.98 1v6f n VAL 21 Ca -0.12 2.29 0.27 0.00 -0.01 0.00 0.00 64.34 66.77 1v6f n VAL 21 Cb 0.40 -3.04 0.53 0.00 -0.91 0.00 0.00 33.84 30.82 1v6f n VAL 21 CO 0.00 0.00 0.00 1.05 -1.32 0.00 0.00 176.83 176.56 1v6f h GLU 22 N 0.00 0.27 -0.41 5.55 4.11 -1.55 0.88 114.58 123.43 1v6f h GLU 22 Ca 0.35 -0.02 -0.12 0.00 0.07 0.00 0.00 59.36 59.65 1v6f h GLU 22 Cb 0.60 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 1v6f h GLU 22 CO -0.98 0.18 -0.21 0.87 0.07 0.00 0.00 179.01 178.95 1v6f h LYS 23 N 0.28 0.82 -0.03 1.06 1.57 0.99 -2.63 116.57 118.63 1v6f h LYS 23 Ca 0.73 -0.33 -0.03 0.00 -1.87 0.00 0.00 60.65 59.15 1v6f h LYS 23 Cb 1.87 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 34.14 1v6f h LYS 23 CO -0.50 0.95 -0.10 -0.07 -0.57 0.00 0.00 179.45 179.16 1v6f h LEU 24 N 0.71 0.14 -0.54 2.94 3.38 0.95 -3.01 115.31 119.89 1v6f h LEU 24 Ca 0.10 -0.62 0.11 0.00 0.09 0.00 0.00 57.88 57.55 1v6f h LEU 24 Cb 0.73 -0.04 -0.09 0.00 0.09 0.00 0.00 40.66 41.35 1v6f h LEU 24 CO 0.06 0.74 -0.01 0.03 0.09 0.00 0.00 178.44 179.35 1v6f h ARG 25 N -0.45 0.10 -0.84 1.13 3.08 -0.69 0.21 114.38 116.92 1v6f h ARG 25 Ca -0.00 -0.01 0.04 0.00 0.07 0.00 0.00 59.98 60.08 1v6f h ARG 25 Cb 0.73 -0.02 -0.05 0.00 0.08 0.00 0.00 29.97 30.71 1v6f h ARG 25 CO 0.02 0.07 0.55 0.87 -1.07 0.00 0.00 179.97 180.41 1v6f h LYS 26 N 0.11 1.00 -0.49 0.04 1.79 -1.53 -2.71 116.57 114.77 1v6f h LYS 26 Ca 0.27 -0.06 0.09 0.00 -2.18 0.00 0.00 60.65 58.78 1v6f h LYS 26 Cb 0.42 -0.23 -0.10 0.00 -1.58 0.00 0.00 32.23 30.74 1v6f h LYS 26 CO -0.46 0.66 -0.32 0.35 -1.08 0.00 0.00 179.45 178.60 1v6f h PHE 27 N 1.03 -0.89 -0.49 -1.35 3.04 -0.80 0.78 116.94 118.25 1v6f h PHE 27 Ca 0.34 0.06 0.02 0.00 3.98 0.00 0.00 57.97 62.37 1v6f h PHE 27 Cb 0.05 0.46 -0.03 0.00 2.56 0.00 0.00 35.95 38.99 1v6f h PHE 27 CO -0.00 -0.38 0.29 0.00 -2.02 0.00 0.00 178.31 176.20 1v6f h ARG 28 N -0.20 0.56 -1.08 1.11 2.47 -1.42 -2.08 114.38 113.75 1v6f h ARG 28 Ca 0.20 -0.03 -0.50 0.00 -1.26 0.00 0.00 59.98 58.39 1v6f h ARG 28 Cb 0.54 -0.13 -0.25 0.00 -1.65 0.00 0.00 29.97 28.48 1v6f h ARG 28 CO -0.61 0.37 0.64 1.19 0.56 0.00 0.00 179.97 182.13 1v6f n PHE 29 N -4.81 2.65 -2.21 3.04 3.72 -0.26 -4.96 117.46 114.63 1v6f n PHE 29 Ca 0.03 -2.14 -0.42 0.00 -0.05 0.00 0.00 57.45 54.87 1v6f n PHE 29 Cb 0.07 -1.06 -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 -2.98 4.25 -0.24 -1.08 1.70 0.25 -4.89 118.95 115.96 1v6f s ARG 30 Ca 0.51 1.96 0.01 0.00 -0.47 0.00 0.00 55.73 57.74 1v6f s ARG 30 Cb 0.41 -3.71 0.29 0.00 -0.57 0.00 0.00 34.95 31.37 1v6f s ARG 30 CO 0.04 -0.67 1.58 0.36 -1.08 0.00 0.00 175.30 175.54 1v6f n LYS 31 N 6.03 1.64 -4.15 3.89 -0.00 -1.26 -4.89 118.16 119.41 1v6f n LYS 31 Ca 0.14 -1.44 -0.24 0.00 -0.00 0.00 0.00 58.31 56.78 1v6f n LYS 31 Cb 0.44 -1.56 -0.07 0.00 -0.00 0.00 0.00 35.03 33.83 1v6f n LYS 31 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.40 176.19 1v6f s GLU 32 N -1.60 2.26 -0.19 -1.58 0.41 -1.26 -5.07 118.70 111.67 1v6f s GLU 32 Ca 0.28 -1.69 -0.03 0.00 -0.41 0.00 0.00 54.97 53.12 1v6f s GLU 32 Cb 0.23 -2.06 -0.11 0.00 -1.78 0.00 0.00 34.13 30.40 1v6f s GLU 32 CO 0.04 0.04 -0.20 2.41 -0.49 0.00 0.00 175.26 177.05 1v6f n THR 33 N -1.14 1.10 -0.40 3.63 -1.04 -1.26 -5.02 114.28 110.14 1v6f n THR 33 Ca -0.02 -0.37 -0.24 0.00 -2.04 0.00 0.00 64.05 61.38 1v6f n THR 33 Cb 0.63 -1.40 0.22 0.00 -1.82 0.00 0.00 70.33 67.96 1v6f n THR 33 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1v6f n HIS 34 N -3.38 -2.87 -2.29 -1.42 1.44 -1.26 -5.01 115.22 100.43 1v6f n HIS 34 Ca -0.36 -0.36 -0.27 0.00 -2.01 0.00 0.00 57.72 54.73 1v6f n HIS 34 Cb 0.83 -1.39 0.15 0.00 0.12 0.00 0.00 29.99 29.70 1v6f n HIS 34 CO 0.00 0.00 0.00 -0.80 -2.81 0.00 0.00 176.34 172.73 1v6f s ASN 35 N -2.46 3.66 -0.02 4.39 -0.87 -1.26 -4.82 114.94 113.56 1v6f s ASN 35 Ca 0.52 -0.13 -0.29 0.00 -1.57 0.00 0.00 52.86 51.39 1v6f s ASN 35 Cb -0.10 -0.04 0.10 0.00 -0.02 0.00 0.00 41.25 41.19 1v6f s ASN 35 CO 0.46 -2.34 0.86 0.00 -2.57 0.00 0.00 177.10 173.51 1v6f s ALA 36 N -3.52 -1.81 -0.23 0.60 0.00 -1.26 -0.62 121.76 114.92 1v6f s ALA 36 Ca 0.71 1.09 -0.07 0.00 0.00 0.00 0.00 51.96 53.69 1v6f s ALA 36 Cb -0.04 0.22 0.11 0.00 0.00 0.00 0.00 23.12 23.41 1v6f s ALA 36 CO 0.49 -0.60 0.47 0.00 0.00 0.00 0.00 175.76 176.12 1v6f s ALA 37 N -2.65 -1.38 -0.22 0.00 0.00 -0.78 -3.20 121.76 113.55 1v6f s ALA 37 Ca 0.02 1.64 -0.06 0.00 0.00 0.00 0.00 51.96 53.56 1v6f s ALA 37 Cb -0.01 -1.48 -0.02 0.00 0.00 0.00 0.00 23.12 21.61 1v6f s ALA 37 CO -0.06 -0.86 0.02 0.42 0.00 0.00 0.00 175.76 175.28 1v6f s ILE 38 N 2.68 4.00 -0.09 0.00 1.01 -0.96 -0.83 121.20 127.02 1v6f s ILE 38 Ca -0.00 -0.29 -0.05 0.00 0.00 0.00 0.00 60.65 60.31 1v6f s ILE 38 Cb -0.12 -2.83 -0.04 0.00 0.01 0.00 0.00 42.46 39.48 1v6f s ILE 38 CO -0.15 0.40 0.11 -0.63 0.00 0.00 0.00 174.94 174.68 1v6f s ILE 39 N 1.21 5.15 0.18 2.92 1.01 -0.93 -0.41 121.20 130.33 1v6f s ILE 39 Ca 0.03 -0.01 0.02 0.00 0.00 0.00 0.00 60.65 60.70 1v6f s ILE 39 Cb -0.15 -3.26 -0.05 0.00 0.01 0.00 0.00 42.46 39.02 1v6f s ILE 39 CO 0.02 0.55 -0.01 -0.04 0.00 0.00 0.00 174.94 175.46 1v6f s MET 40 N -1.19 1.15 0.24 2.79 -1.94 -0.15 -0.51 119.30 119.68 1v6f s MET 40 Ca 0.17 -1.55 -0.21 0.00 -1.71 0.00 0.00 55.69 52.39 1v6f s MET 40 Cb -0.12 -0.36 0.06 0.00 2.01 0.00 0.00 34.83 36.43 1v6f s MET 40 CO 0.07 -0.11 0.94 -1.59 -0.01 0.00 0.00 175.02 174.32 1v6f s LYS 41 N -3.89 1.56 -0.07 2.03 0.00 -1.12 -2.23 119.74 116.01 1v6f s LYS 41 Ca 0.24 -0.97 0.04 0.00 0.00 0.00 0.00 55.97 55.29 1v6f s LYS 41 Cb 0.06 0.46 -0.00 0.00 0.00 0.00 0.00 37.83 38.34 1v6f s LYS 41 CO 0.04 -0.73 -0.21 0.42 0.00 0.00 0.00 175.35 174.88 1v6f s ILE 42 N -2.54 1.74 0.62 3.79 1.01 -1.26 -1.69 121.20 122.87 1v6f s ILE 42 Ca 0.18 -0.87 -0.02 0.00 0.00 0.00 0.00 60.65 59.93 1v6f s ILE 42 Cb -0.03 -1.50 0.05 0.00 0.01 0.00 0.00 42.46 40.98 1v6f s ILE 42 CO 0.06 0.49 0.88 -0.62 0.00 0.00 0.00 174.94 175.76 1v6f s ASP 43 N 0.14 5.07 0.04 3.58 2.15 -1.26 -4.97 116.67 121.42 1v6f s ASP 43 Ca -0.09 0.20 -0.17 0.00 0.43 0.00 0.00 52.55 52.92 1v6f s ASP 43 Cb -0.14 -0.98 -0.26 0.00 -0.30 0.00 0.00 42.92 41.23 1v6f s ASP 43 CO 0.05 -1.35 1.11 0.07 -0.17 0.00 0.00 175.17 174.88 1v6f h LYS 44 N -0.23 0.56 0.00 4.34 2.10 -1.99 -3.01 116.57 118.34 1v6f h LYS 44 Ca -0.43 -0.67 -0.12 0.00 -2.00 0.00 0.00 60.65 57.43 1v6f h LYS 44 Cb 1.31 0.21 -0.02 0.00 -0.90 0.00 0.00 32.23 32.82 1v6f h LYS 44 CO 0.56 1.28 -0.87 0.22 -2.00 0.00 0.00 179.45 178.63 1v6f h ASP 45 N 0.15 0.00 -0.18 7.07 3.58 -2.00 -3.35 116.42 121.69 1v6f h ASP 45 Ca -0.13 -0.27 0.05 0.00 0.42 0.00 0.00 57.03 57.10 1v6f h ASP 45 Cb 1.65 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.69 1v6f h ASP 45 CO 0.19 1.12 0.40 -0.33 -2.88 0.00 0.00 179.24 177.74 1v6f h GLU 46 N -1.00 0.00 -5.25 0.28 4.39 -1.99 -3.43 114.58 107.58 1v6f h GLU 46 Ca -0.18 0.00 -0.33 0.00 0.34 0.00 0.00 59.36 59.20 1v6f h GLU 46 Cb 0.91 0.00 -0.20 0.00 -0.10 0.00 0.00 28.75 29.35 1v6f h GLU 46 CO -0.11 0.00 -0.47 2.89 -1.16 0.00 0.00 179.01 180.16 1v6f n ARG 47 N -3.22 -1.06 -3.76 2.33 -4.01 -1.14 -4.82 116.66 100.98 1v6f n ARG 47 Ca 0.02 0.07 -0.13 0.00 -1.04 0.00 0.00 57.85 56.77 1v6f n ARG 47 Cb 0.50 -2.90 -0.10 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 -4.58 0.81 -0.16 2.89 2.96 -1.26 -4.59 118.68 114.75 1v6f s LEU 48 Ca 0.43 0.39 -0.29 0.00 -0.22 0.00 0.00 54.13 54.44 1v6f s LEU 48 Cb -0.25 1.18 -0.04 0.00 0.50 0.00 0.00 46.19 47.58 1v6f s LEU 48 CO 0.53 -0.26 1.67 -0.69 -1.32 0.00 0.00 176.35 176.28 1v6f s VAL 49 N -0.51 3.60 0.40 1.68 1.01 -0.47 -4.04 120.40 122.07 1v6f s VAL 49 Ca -0.06 0.69 0.07 0.00 0.00 0.00 0.00 61.98 62.68 1v6f s VAL 49 Cb -0.04 -3.57 -0.08 0.00 0.00 0.00 0.00 36.38 32.70 1v6f s VAL 49 CO 0.02 -0.19 0.00 0.68 0.00 0.00 0.00 175.10 175.61 1v6f s VAL 50 N 5.01 2.00 -0.10 2.92 -7.23 -0.68 -0.74 120.40 121.57 1v6f s VAL 50 Ca 0.74 -2.02 -0.30 0.00 -1.81 0.00 0.00 61.98 58.60 1v6f s VAL 50 Cb -0.28 -2.97 -0.02 0.00 0.56 0.00 0.00 36.38 33.66 1v6f s VAL 50 CO 0.30 -0.02 1.24 -0.22 -0.31 0.00 0.00 175.10 176.09 1v6f s LEU 51 N -3.70 4.24 -0.13 1.32 1.98 -1.26 -2.81 118.68 118.32 1v6f s LEU 51 Ca 0.35 1.77 -0.17 0.00 -2.89 0.00 0.00 54.13 53.19 1v6f s LEU 51 Cb 0.09 -3.55 -0.25 0.00 0.66 0.00 0.00 46.19 43.14 1v6f s LEU 51 CO 0.18 -0.67 0.48 -0.78 -1.89 0.00 0.00 176.35 173.67 1v6f h ASP 52 N 7.82 0.28 -5.69 3.68 1.82 -1.12 -3.48 116.42 119.72 1v6f h ASP 52 Ca -0.31 -0.80 0.30 0.00 -0.39 0.00 0.00 57.03 55.83 1v6f h ASP 52 Cb 1.14 -0.09 -0.11 0.00 0.68 0.00 0.00 39.33 40.94 1v6f h ASP 52 CO 0.92 1.58 0.76 -1.83 -1.61 0.00 0.00 179.24 179.06 1v6f s GLU 53 N -2.44 0.55 -0.05 0.28 -1.05 -1.18 -5.00 118.70 109.81 1v6f s GLU 53 Ca -0.22 -0.30 0.01 0.00 -0.15 0.00 0.00 54.97 54.30 1v6f s GLU 53 Cb 0.04 0.19 0.02 0.00 -0.44 0.00 0.00 34.13 33.94 1v6f s GLU 53 CO 0.72 -0.25 -0.03 -1.21 0.95 0.00 0.00 175.26 175.44 1v6f s GLU 54 N -2.58 0.71 0.10 -4.83 2.02 -1.26 -2.19 118.70 110.67 1v6f s GLU 54 Ca 0.14 -0.04 0.08 0.00 0.02 0.00 0.00 54.97 55.16 1v6f s GLU 54 Cb 0.04 -0.80 -0.04 0.00 0.10 0.00 0.00 34.13 33.42 1v6f s GLU 54 CO -0.03 -0.13 -0.12 -0.51 0.02 0.00 0.00 175.26 174.49 1v6f s LEU 55 N 1.11 2.95 0.10 1.80 1.43 -0.01 -4.99 118.68 121.07 1v6f s LEU 55 Ca -0.08 -0.43 0.08 0.00 -1.03 0.00 0.00 54.13 52.67 1v6f s LEU 55 Cb -0.14 -1.75 -0.03 0.00 0.03 0.00 0.00 46.19 44.29 1v6f s LEU 55 CO -0.01 0.18 -0.20 -1.61 0.23 0.00 0.00 176.35 174.94 1v6f s GLU 56 N -2.17 1.09 -0.92 1.70 2.02 -1.26 -1.86 118.70 117.30 1v6f s GLU 56 Ca 0.20 -1.14 -0.26 0.00 0.02 0.00 0.00 54.97 53.79 1v6f s GLU 56 Cb -0.11 -1.33 0.04 0.00 0.10 0.00 0.00 34.13 32.83 1v6f s GLU 56 CO 0.13 0.31 0.52 0.41 0.02 0.00 0.00 175.26 176.64 1v6f n GLY 57 N 1.09 -0.67 3.81 -1.39 0.00 0.21 -4.86 105.19 103.38 1v6f n GLY 57 Ca -0.20 0.27 -0.27 0.00 0.00 0.00 0.00 46.02 45.83 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 -3.79 1.86 0.27 1.61 -7.23 -1.26 -4.85 120.40 107.01 1v6f s VAL 58 Ca 0.36 -1.67 0.09 0.00 -1.81 0.00 0.00 61.98 58.95 1v6f s VAL 58 Cb -0.20 -2.53 -0.05 0.00 0.56 0.00 0.00 36.38 34.15 1v6f s VAL 58 CO 0.75 0.00 -0.14 -0.44 -0.31 0.00 0.00 175.10 174.96 1v6f s SER 59 N -4.04 3.20 0.04 4.85 0.01 -1.26 -4.74 113.70 111.76 1v6f s SER 59 Ca 0.32 -1.09 0.16 0.00 1.31 0.00 0.00 55.95 56.65 1v6f s SER 59 Cb 0.01 -0.24 0.67 0.00 0.21 0.00 0.00 66.02 66.67 1v6f s SER 59 CO 0.18 -0.13 1.50 -0.81 0.41 0.00 0.00 173.24 174.39 1v6f n PRO 60 N -0.58 0.03 -0.04 12.44 -0.04 -1.26 -0.62 135.00 144.93 1v6f n PRO 60 Ca -0.06 0.28 -0.05 0.00 -0.04 0.00 0.00 63.50 63.63 1v6f n PRO 60 Cb 0.61 -1.56 -0.14 0.00 -0.04 0.00 0.00 33.50 32.38 1v6f n PRO 60 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1v6f n ASP 61 N -1.61 0.46 0.00 3.54 5.75 -1.26 -3.92 116.55 119.51 1v6f n ASP 61 Ca 0.03 0.21 0.03 0.00 -0.01 0.00 0.00 54.79 55.05 1v6f n ASP 61 Cb 0.18 0.57 -0.11 0.00 -1.03 0.00 0.00 41.12 40.73 1v6f n ASP 61 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1v6f n GLU 62 N -2.83 0.65 0.37 0.11 1.02 -1.01 -4.34 120.64 114.60 1v6f n GLU 62 Ca -0.20 0.03 -0.17 0.00 -0.02 0.00 0.00 57.16 56.79 1v6f n GLU 62 Cb 1.00 -1.66 -0.09 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 0.00 -0.78 -1.30 -4.62 5.85 -1.05 -2.76 115.31 110.65 1v6f h LEU 63 Ca -0.17 0.00 0.32 0.00 0.84 0.00 0.00 57.88 58.87 1v6f h LEU 63 Cb 1.46 0.20 -0.11 0.00 0.37 0.00 0.00 40.66 42.58 1v6f h LEU 63 CO 0.02 -0.51 0.70 0.07 -0.34 0.00 0.00 178.44 178.38 1v6f h LYS 64 N -1.01 0.31 -0.58 1.25 2.10 -1.77 0.75 116.57 117.62 1v6f h LYS 64 Ca -0.09 -0.02 0.04 0.00 -2.00 0.00 0.00 60.65 58.58 1v6f h LYS 64 Cb 0.73 -0.07 -0.03 0.00 -0.90 0.00 0.00 32.23 31.96 1v6f h LYS 64 CO 0.16 0.20 0.38 -0.44 -2.00 0.00 0.00 179.45 177.75 1v6f h ASP 65 N 0.31 0.54 -0.30 7.07 3.32 -1.68 0.73 116.42 126.42 1v6f h ASP 65 Ca 0.68 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.72 1v6f h ASP 65 Cb 1.79 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 41.22 1v6f h ASP 65 CO -0.38 0.37 0.00 -0.62 -1.72 0.00 0.00 179.24 176.88 1v6f n GLU 66 N -4.47 2.60 -4.38 3.56 -0.58 0.26 -4.86 120.64 112.77 1v6f n GLU 66 Ca 0.07 -1.45 -0.28 0.00 -0.42 0.00 0.00 57.16 55.08 1v6f n GLU 66 Cb 0.17 -1.71 -0.13 0.00 -0.57 0.00 0.00 31.44 29.20 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 -1.24 2.33 0.09 -4.62 1.43 0.25 -5.09 118.68 111.83 1v6f s LEU 67 Ca 0.26 -0.76 -0.31 0.00 -1.03 0.00 0.00 54.13 52.29 1v6f s LEU 67 Cb 0.18 -1.15 -0.07 0.00 0.03 0.00 0.00 46.19 45.18 1v6f s LEU 67 CO 0.10 0.15 1.38 -2.16 0.23 0.00 0.00 176.35 176.05 1v6f s PRO 68 N -2.12 4.32 -0.25 1.29 0.04 -1.26 -4.92 135.00 132.10 1v6f s PRO 68 Ca 0.14 2.03 0.13 0.00 0.04 0.00 0.00 61.00 63.34 1v6f s PRO 68 Cb -0.10 -3.32 0.77 0.00 0.04 0.00 0.00 34.50 31.90 1v6f s PRO 68 CO 0.06 -0.45 1.73 -0.85 0.04 0.00 0.00 177.00 177.53 1v6f n GLU 69 N 4.21 4.39 0.00 4.56 0.28 -1.26 -4.28 120.64 128.53 1v6f n GLU 69 Ca 0.12 -3.12 0.00 0.00 -0.16 0.00 0.00 57.16 53.99 1v6f n GLU 69 Cb 0.43 -2.21 0.00 0.00 1.43 0.00 0.00 31.44 31.09 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 0.29 1.61 -4.29 3.44 1.74 -1.26 -4.70 116.66 113.49 1v6f n ARG 70 Ca 0.30 0.00 -0.23 0.00 -0.77 0.00 0.00 57.85 57.15 1v6f n ARG 70 Cb 1.21 -0.77 -0.12 0.00 -1.02 0.00 0.00 32.46 31.76 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 -1.54 1.14 0.10 5.56 -0.21 -1.26 -2.86 119.66 120.59 1v6f s GLN 71 Ca 0.00 -1.21 -0.31 0.00 0.02 0.00 0.00 55.36 53.86 1v6f s GLN 71 Cb 0.00 -1.33 -0.08 0.00 1.00 0.00 0.00 33.01 32.61 1v6f s GLN 71 CO 0.00 0.30 1.37 -1.25 -2.12 0.00 0.00 175.29 173.59 1v6f s PRO 72 N -2.14 4.33 0.10 2.91 0.04 -1.26 -4.41 135.00 134.58 1v6f s PRO 72 Ca 0.08 2.04 0.03 0.00 0.04 0.00 0.00 61.00 63.19 1v6f s PRO 72 Cb -0.09 -3.28 -0.04 0.00 0.04 0.00 0.00 34.50 31.14 1v6f s PRO 72 CO 0.05 -0.43 -0.10 0.50 0.04 0.00 0.00 177.00 177.06 1v6f s ARG 73 N 1.18 0.87 -0.10 4.56 6.06 -0.16 -4.99 118.95 126.37 1v6f s ARG 73 Ca 0.64 -1.22 -0.10 0.00 -2.50 0.00 0.00 55.73 52.55 1v6f s ARG 73 Cb -0.36 -0.49 -0.05 0.00 0.06 0.00 0.00 34.95 34.11 1v6f s ARG 73 CO 0.30 0.07 0.23 -0.06 -2.50 0.00 0.00 175.30 173.33 1v6f s PHE 74 N -2.74 3.60 -0.15 5.12 0.08 -0.95 -2.26 117.98 120.69 1v6f s PHE 74 Ca 0.08 0.64 -0.07 0.00 0.12 0.00 0.00 56.93 57.70 1v6f s PHE 74 Cb -0.01 -2.09 0.06 0.00 -0.57 0.00 0.00 43.02 40.40 1v6f s PHE 74 CO -0.01 0.62 0.34 0.42 -0.10 0.00 0.00 175.22 176.49 1v6f s ILE 75 N -0.75 -0.13 -0.45 0.64 1.09 -1.21 -0.98 121.20 119.41 1v6f s ILE 75 Ca 0.17 0.14 -0.06 0.00 -1.10 0.00 0.00 60.65 59.80 1v6f s ILE 75 Cb -0.13 -0.52 0.12 0.00 -1.06 0.00 0.00 42.46 40.87 1v6f s ILE 75 CO 0.06 0.06 0.29 -0.69 -0.10 0.00 0.00 174.94 174.55 1v6f s VAL 76 N 1.58 3.79 0.24 2.92 1.01 0.46 -1.43 120.40 128.96 1v6f s VAL 76 Ca -0.08 -1.93 0.03 0.00 0.00 0.00 0.00 61.98 60.00 1v6f s VAL 76 Cb -0.10 -3.54 -0.03 0.00 0.00 0.00 0.00 36.38 32.71 1v6f s VAL 76 CO -0.11 -0.74 0.38 -0.47 0.00 0.00 0.00 175.10 174.16 1v6f s TYR 77 N 1.23 3.47 -0.36 5.22 5.04 -1.12 -2.26 117.35 128.56 1v6f s TYR 77 Ca 0.07 0.11 0.00 0.00 -2.44 0.00 0.00 57.07 54.82 1v6f s TYR 77 Cb -0.25 -1.68 0.12 0.00 0.35 0.00 0.00 41.96 40.51 1v6f s TYR 77 CO -0.02 0.39 0.16 0.45 -1.34 0.00 0.00 175.55 175.19 1v6f s SER 78 N -3.76 3.80 1.01 4.32 0.15 -1.19 -2.33 113.70 115.70 1v6f s SER 78 Ca 0.36 -2.08 -0.12 0.00 0.70 0.00 0.00 55.95 54.80 1v6f s SER 78 Cb -0.10 -0.90 0.19 0.00 -1.71 0.00 0.00 66.02 63.51 1v6f s SER 78 CO 0.30 -0.35 1.09 -0.47 1.20 0.00 0.00 173.24 175.02 1v6f s TYR 79 N 1.07 2.08 -0.43 3.44 5.04 -1.24 -4.61 117.35 122.69 1v6f s TYR 79 Ca 0.14 0.97 0.01 0.00 -2.44 0.00 0.00 57.07 55.75 1v6f s TYR 79 Cb -0.21 -3.27 0.12 0.00 0.35 0.00 0.00 41.96 38.95 1v6f s TYR 79 CO -0.13 -2.94 0.19 0.21 -1.34 0.00 0.00 175.55 171.54 1v6f s LYS 80 N -4.97 1.88 -0.69 4.97 2.20 -1.26 -3.47 119.74 118.41 1v6f s LYS 80 Ca 0.65 -2.07 -0.23 0.00 -0.36 0.00 0.00 55.97 53.96 1v6f s LYS 80 Cb -0.19 -3.42 0.07 0.00 -1.51 0.00 0.00 37.83 32.78 1v6f s LYS 80 CO 0.58 -1.04 1.01 -0.47 -0.36 0.00 0.00 175.35 175.06 1v6f s TYR 81 N 0.65 2.66 0.07 4.03 6.14 0.69 -4.94 117.35 126.65 1v6f s TYR 81 Ca 0.12 -0.56 -0.22 0.00 0.64 0.00 0.00 57.07 57.05 1v6f s TYR 81 Cb -0.22 -4.33 -0.06 0.00 0.42 0.00 0.00 41.96 37.77 1v6f s TYR 81 CO -0.05 -1.69 0.65 -1.14 0.64 0.00 0.00 175.55 173.97 1v6f s GLN 82 N 4.16 4.36 -0.20 4.97 2.00 -1.26 -1.75 119.66 131.94 1v6f s GLN 82 Ca 0.24 0.88 -0.10 0.00 -2.00 0.00 0.00 55.36 54.39 1v6f s GLN 82 Cb -0.15 -3.29 -0.05 0.00 0.80 0.00 0.00 33.01 30.32 1v6f s GLN 82 CO 0.09 0.51 0.12 -1.01 -0.50 0.00 0.00 175.29 174.50 1v6f s HIS 83 N -0.74 3.36 0.36 1.67 3.76 0.16 -4.97 115.29 118.89 1v6f s HIS 83 Ca 0.32 0.26 0.19 0.00 -0.15 0.00 0.00 55.06 55.68 1v6f s HIS 83 Cb -0.20 -2.17 1.26 0.00 1.11 0.00 0.00 32.58 32.58 1v6f s HIS 83 CO 0.21 0.22 1.60 -0.44 -0.85 0.00 0.00 174.74 175.48 1v6f h ASP 84 N 6.84 0.32 -0.80 1.40 5.19 -1.97 0.79 116.42 128.19 1v6f h ASP 84 Ca -0.40 0.25 0.16 0.00 -0.62 0.00 0.00 57.03 56.42 1v6f h ASP 84 Cb 1.16 0.25 -0.10 0.00 0.18 0.00 0.00 39.33 40.82 1v6f h ASP 84 CO 0.73 -0.37 0.34 -0.78 -3.12 0.00 0.00 179.24 176.04 1v6f h ASP 85 N 0.07 0.32 0.00 6.45 1.82 -2.04 -3.46 116.42 119.58 1v6f h ASP 85 Ca 0.81 0.12 0.00 0.00 -0.39 0.00 0.00 57.03 57.57 1v6f h ASP 85 Cb 2.07 0.09 0.00 0.00 0.68 0.00 0.00 39.33 42.17 1v6f h ASP 85 CO -0.74 0.10 0.00 0.61 -1.61 0.00 0.00 179.24 177.60 1v6f n GLY 86 N -1.33 2.64 3.78 -0.78 0.00 0.28 -5.14 105.19 104.64 1v6f n GLY 86 Ca 0.16 -0.32 -0.36 0.00 0.00 0.00 0.00 46.02 45.51 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 3.72 -0.07 1.61 3.52 -1.25 -4.71 118.95 121.78 1v6f s ARG 87 Ca 0.00 1.58 -0.04 0.00 -0.13 0.00 0.00 55.73 57.14 1v6f s ARG 87 Cb 0.00 -2.23 0.03 0.00 -1.56 0.00 0.00 34.95 31.19 1v6f s ARG 87 CO 0.00 -0.54 0.16 0.54 -0.81 0.00 0.00 175.30 174.65 1v6f s VAL 88 N -1.74 -0.03 0.19 7.11 0.11 -1.26 0.37 120.40 125.14 1v6f s VAL 88 Ca 0.66 0.12 0.08 0.00 -2.93 0.00 0.00 61.98 59.91 1v6f s VAL 88 Cb -0.23 -0.25 -0.04 0.00 -1.53 0.00 0.00 36.38 34.32 1v6f s VAL 88 CO 0.27 0.05 -0.16 -0.55 -3.33 0.00 0.00 175.10 171.38 1v6f s SER 89 N 0.85 2.61 -0.58 3.54 0.15 -0.71 -4.96 113.70 114.59 1v6f s SER 89 Ca -0.06 -0.95 -0.02 0.00 0.70 0.00 0.00 55.95 55.62 1v6f s SER 89 Cb -0.08 -0.14 0.15 0.00 -1.71 0.00 0.00 66.02 64.23 1v6f s SER 89 CO -0.04 -0.11 0.38 -0.31 1.20 0.00 0.00 173.24 174.35 1v6f s TYR 90 N -2.57 3.42 -0.01 3.44 2.02 -1.26 -0.22 117.35 122.17 1v6f s TYR 90 Ca 0.19 -2.73 -0.30 0.00 -0.37 0.00 0.00 57.07 53.86 1v6f s TYR 90 Cb -0.03 -3.16 -0.06 0.00 -0.40 0.00 0.00 41.96 38.32 1v6f s TYR 90 CO 0.07 -0.85 1.45 -1.25 -1.57 0.00 0.00 175.55 173.40 1v6f s PRO 91 N 0.10 4.25 -0.07 -1.71 0.04 -1.23 -4.81 135.00 131.57 1v6f s PRO 91 Ca 0.16 2.02 -0.30 0.00 0.04 0.00 0.00 61.00 62.91 1v6f s PRO 91 Cb -0.21 -3.65 -0.02 0.00 0.04 0.00 0.00 34.50 30.66 1v6f s PRO 91 CO -0.03 -0.64 1.10 -0.51 0.04 0.00 0.00 177.00 176.95 1v6f s LEU 92 N 2.73 4.27 0.11 -3.56 2.01 -1.26 -3.69 118.68 119.29 1v6f s LEU 92 Ca 0.66 1.68 0.06 0.00 0.01 0.00 0.00 54.13 56.53 1v6f s LEU 92 Cb -0.32 -3.56 -0.04 0.00 0.01 0.00 0.00 46.19 42.29 1v6f s LEU 92 CO 0.27 -0.50 -0.14 0.00 1.01 0.00 0.00 176.35 176.99 1v6f s PHE 94 N -1.96 3.27 -0.57 0.00 2.19 0.22 -2.81 117.98 118.33 1v6f s PHE 94 Ca 0.07 -1.11 -0.18 0.00 0.33 0.00 0.00 56.93 56.03 1v6f s PHE 94 Cb -0.06 -2.78 0.10 0.00 -1.31 0.00 0.00 43.02 38.96 1v6f s PHE 94 CO 0.03 -0.74 0.66 0.42 1.83 0.00 0.00 175.22 177.41 1v6f s ILE 95 N 1.54 4.89 -0.76 3.12 1.01 -0.51 -0.51 121.20 129.98 1v6f s ILE 95 Ca 0.03 -0.98 -0.25 0.00 0.00 0.00 0.00 60.65 59.45 1v6f s ILE 95 Cb -0.22 -4.43 0.04 0.00 0.01 0.00 0.00 42.46 37.87 1v6f s ILE 95 CO 0.05 -1.02 1.24 0.12 0.00 0.00 0.00 174.94 175.33 1v6f s PHE 96 N 2.51 2.41 -0.86 3.97 5.36 0.14 -3.31 117.98 128.20 1v6f s PHE 96 Ca 0.11 -0.28 -0.25 0.00 -0.96 0.00 0.00 56.93 55.55 1v6f s PHE 96 Cb -0.24 -4.56 0.03 0.00 -0.34 0.00 0.00 43.02 37.91 1v6f s PHE 96 CO 0.07 -1.96 1.42 0.45 -1.46 0.00 0.00 175.22 173.73 1v6f s SER 97 N 3.87 6.20 -0.39 6.13 0.15 -0.96 -1.69 113.70 127.02 1v6f s SER 97 Ca 0.34 -0.84 -0.02 0.00 0.70 0.00 0.00 55.95 56.12 1v6f s SER 97 Cb -0.09 -2.56 0.10 0.00 -1.71 0.00 0.00 66.02 61.76 1v6f s SER 97 CO 0.10 -1.78 0.16 -0.94 1.20 0.00 0.00 173.24 171.99 1v6f s SER 98 N 4.74 5.16 -0.05 5.45 1.04 -0.64 -0.99 113.70 128.39 1v6f s SER 98 Ca 0.43 -1.97 -0.30 0.00 0.48 0.00 0.00 55.95 54.60 1v6f s SER 98 Cb -0.05 -1.79 -0.05 0.00 0.10 0.00 0.00 66.02 64.23 1v6f s SER 98 CO 0.04 -0.49 1.49 -2.16 0.98 0.00 0.00 173.24 173.09 1v6f s PRO 99 N 1.12 4.23 0.61 4.02 0.04 -1.22 -3.93 135.00 139.87 1v6f s PRO 99 Ca 0.07 2.01 0.27 0.00 0.04 0.00 0.00 61.00 63.40 1v6f s PRO 99 Cb -0.22 -3.78 1.32 0.00 0.04 0.00 0.00 34.50 31.86 1v6f s PRO 99 CO -0.04 -0.72 1.73 0.28 0.04 0.00 0.00 177.00 178.29 1v6f h VAL 100 N 5.29 0.21 0.00 -0.36 2.07 -1.13 0.32 116.25 122.66 1v6f h VAL 100 Ca -0.36 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.16 1v6f h VAL 100 Cb 1.16 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 31.40 1v6f h VAL 100 CO 0.94 0.00 0.00 0.61 0.02 0.00 0.00 177.57 179.14 1v6f n GLY 101 N -1.50 1.51 3.87 2.17 0.00 -1.26 -4.82 105.19 105.15 1v6f n GLY 101 Ca 0.09 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.90 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 -3.94 3.85 0.13 0.00 -2.85 -1.26 -5.00 119.74 110.66 1v6f s LYS 103 Ca 0.36 0.54 -0.12 0.00 -1.00 0.00 0.00 55.97 55.75 1v6f s LYS 103 Cb -0.08 -2.40 -0.06 0.00 -2.06 0.00 0.00 37.83 33.24 1v6f s LYS 103 CO 0.27 0.01 1.46 -1.00 0.10 0.00 0.00 175.35 176.18 1v6f h PRO 104 N 1.54 0.86 -0.74 1.78 0.13 -1.99 -2.43 132.00 131.15 1v6f h PRO 104 Ca -0.47 -0.45 0.22 0.00 -0.87 0.00 0.00 66.00 64.42 1v6f h PRO 104 Cb 1.18 0.02 -0.03 0.00 0.13 0.00 0.00 31.00 32.30 1v6f h PRO 104 CO 0.64 1.10 0.68 1.49 -0.23 0.00 0.00 178.00 181.68 1v6f h GLU 105 N 0.66 0.00 0.07 0.86 4.81 -2.02 -0.30 114.58 118.66 1v6f h GLU 105 Ca 0.06 0.00 -0.37 0.00 -0.13 0.00 0.00 59.36 58.92 1v6f h GLU 105 Cb 0.94 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.28 1v6f h GLU 105 CO 0.09 0.00 -2.12 1.04 -0.73 0.00 0.00 179.01 177.28 1v6f n GLN 106 N -3.83 0.70 -0.36 1.92 1.13 -1.14 -4.04 117.38 111.76 1v6f n GLN 106 Ca 0.15 0.25 0.27 0.00 -1.94 0.00 0.00 57.00 55.74 1v6f n GLN 106 Cb 0.94 -1.64 0.56 0.00 0.11 0.00 0.00 30.24 30.21 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 -0.09 0.28 -0.21 -1.09 1.08 -0.56 0.46 115.11 114.98 1v6f h GLN 107 Ca -0.48 -0.02 -0.21 0.00 -1.45 0.00 0.00 58.65 56.49 1v6f h GLN 107 Cb 1.91 -0.06 0.01 0.00 -0.05 0.00 0.00 27.48 29.29 1v6f h GLN 107 CO -0.02 0.18 -0.69 0.52 -0.95 0.00 0.00 178.83 177.88 1v6f h MET 108 N 0.28 0.83 -0.86 1.46 0.00 -1.62 0.58 114.93 115.60 1v6f h MET 108 Ca 0.66 -0.61 0.00 0.00 0.00 0.00 0.00 59.70 59.75 1v6f h MET 108 Cb 1.85 0.11 -0.04 0.00 0.00 0.00 0.00 31.60 33.52 1v6f h MET 108 CO -0.33 1.23 0.54 1.98 0.00 0.00 0.00 176.91 180.33 1v6f h MET 109 N 0.59 1.15 0.08 1.72 1.85 -0.27 -1.88 114.93 118.18 1v6f h MET 109 Ca -0.03 -0.09 -0.31 0.00 -0.61 0.00 0.00 59.70 58.67 1v6f h MET 109 Cb 1.31 -0.25 -0.02 0.00 0.43 0.00 0.00 31.60 33.07 1v6f h MET 109 CO 0.15 0.79 -1.62 1.88 -0.40 0.00 0.00 176.91 177.71 1v6f h TYR 110 N 1.18 0.31 0.08 1.39 -1.99 -1.26 -3.17 116.97 113.50 1v6f h TYR 110 Ca 0.31 -0.23 -0.00 0.00 2.00 0.00 0.00 58.73 60.81 1v6f h TYR 110 Cb -0.09 -0.01 -0.00 0.00 2.00 0.00 0.00 36.73 38.63 1v6f h TYR 110 CO -0.01 1.33 -0.05 0.00 -0.00 0.00 0.00 178.16 179.43 1v6f h ALA 111 N 0.59 -0.91 -0.74 3.88 0.00 0.33 0.53 119.26 122.93 1v6f h ALA 111 Ca -0.27 -0.02 0.07 0.00 0.00 0.00 0.00 54.91 54.69 1v6f h ALA 111 Cb 2.00 0.18 -0.06 0.00 0.00 0.00 0.00 17.79 19.91 1v6f h ALA 111 CO 0.13 -0.91 0.42 0.78 0.00 0.00 0.00 179.25 179.67 1v6f h GLY 112 N -0.12 1.12 1.03 0.00 0.00 -1.55 -1.97 103.07 101.57 1v6f h GLY 112 Ca -0.01 -0.29 -0.02 0.00 0.00 0.00 0.00 47.33 47.01 1v6f h GLY 112 CO 0.01 0.16 0.42 1.76 0.00 0.00 0.00 176.54 178.88 1v6f h SER 113 N 0.75 1.06 -0.01 0.19 0.02 -1.52 -3.12 113.55 110.91 1v6f h SER 113 Ca 0.34 -0.12 0.02 0.00 -0.84 0.00 0.00 61.79 61.19 1v6f h SER 113 Cb 0.25 -0.27 -0.05 0.00 0.14 0.00 0.00 62.40 62.47 1v6f h SER 113 CO -0.21 0.88 -0.50 0.50 -1.14 0.00 0.00 176.83 176.36 1v6f h LYS 114 N 1.16 -0.59 -0.69 3.45 3.64 0.86 -2.36 116.57 122.03 1v6f h LYS 114 Ca 0.28 0.04 0.09 0.00 -1.27 0.00 0.00 60.65 59.79 1v6f h LYS 114 Cb 0.09 0.14 -0.10 0.00 -0.41 0.00 0.00 32.23 31.94 1v6f h LYS 114 CO -0.04 -0.40 -0.34 -1.71 -2.27 0.00 0.00 179.45 174.70 1v6f n ASN 115 N -5.23 -0.58 -0.17 4.20 2.85 -1.15 0.85 115.26 116.02 1v6f n ASN 115 Ca -0.07 1.22 -0.06 0.00 -0.11 0.00 0.00 54.58 55.56 1v6f n ASN 115 Cb 0.37 -0.22 0.00 0.00 1.24 0.00 0.00 39.78 41.17 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 -0.18 -0.43 1.20 3.64 -1.52 -1.10 116.57 118.18 1v6f h LYS 116 Ca 0.18 0.01 0.09 0.00 -1.27 0.00 0.00 60.65 59.66 1v6f h LYS 116 Cb 0.35 0.04 -0.09 0.00 -0.41 0.00 0.00 32.23 32.12 1v6f h LYS 116 CO -0.67 -0.12 -0.26 -0.07 -2.27 0.00 0.00 179.45 176.07 1v6f h LEU 117 N -0.19 -0.86 -1.56 5.20 4.07 0.58 0.34 115.31 122.89 1v6f h LEU 117 Ca 0.21 0.18 0.31 0.00 0.08 0.00 0.00 57.88 58.66 1v6f h LEU 117 Cb 0.54 0.44 -0.04 0.00 1.08 0.00 0.00 40.66 42.68 1v6f h LEU 117 CO -0.62 -0.27 1.02 0.58 -1.08 0.00 0.00 178.44 178.07 1v6f h VAL 118 N -0.17 0.14 0.11 1.22 2.07 -0.62 0.72 116.25 119.73 1v6f h VAL 118 Ca 0.20 0.00 -0.36 0.00 0.82 0.00 0.00 66.70 67.36 1v6f h VAL 118 Cb 0.49 0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 30.45 1v6f h VAL 118 CO -0.53 0.00 -1.99 0.00 0.02 0.00 0.00 177.57 175.07 1v6f n GLN 119 N -3.59 0.74 -0.22 1.57 1.13 0.11 0.11 117.38 117.23 1v6f n GLN 119 Ca 0.23 0.26 -0.07 0.00 -1.94 0.00 0.00 57.00 55.48 1v6f n GLN 119 Cb 1.36 -1.71 0.06 0.00 0.11 0.00 0.00 30.24 30.06 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 0.06 1.26 -0.01 5.09 2.02 0.14 -2.31 112.91 119.17 1v6f h THR 120 Ca -0.42 -1.04 0.00 0.00 0.77 0.00 0.00 66.41 65.73 1v6f h THR 120 Cb 2.03 0.66 0.00 0.00 -1.74 0.00 0.00 68.15 69.10 1v6f h THR 120 CO 0.08 0.39 -0.12 0.00 0.37 0.00 0.00 175.52 176.24 1v6f n ALA 121 N -2.47 2.81 -3.33 6.16 0.00 0.60 -4.66 120.51 119.62 1v6f n ALA 121 Ca 0.04 -0.33 -0.17 0.00 0.00 0.00 0.00 53.44 52.99 1v6f n ALA 121 Cb 0.29 -1.27 0.08 0.00 0.00 0.00 0.00 19.45 18.55 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 -0.70 -6.25 -3.64 0.00 1.02 -0.87 -4.77 120.64 105.42 1v6f n GLU 122 Ca 0.15 0.75 -0.36 0.00 -0.02 0.00 0.00 57.16 57.69 1v6f n GLU 122 Cb 0.30 -5.50 -0.06 0.00 -0.02 0.00 0.00 31.44 26.16 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 -6.09 4.39 -0.13 -4.62 1.43 0.12 -5.00 118.68 108.77 1v6f s LEU 123 Ca 0.15 0.73 0.08 0.00 -1.03 0.00 0.00 54.13 54.07 1v6f s LEU 123 Cb -0.07 -2.71 -0.14 0.00 0.03 0.00 0.00 46.19 43.30 1v6f s LEU 123 CO 0.65 0.25 -0.01 0.35 0.23 0.00 0.00 176.35 177.83 1v6f n THR 124 N 1.27 0.87 -3.95 5.49 -2.24 -1.26 -4.70 114.28 109.77 1v6f n THR 124 Ca -0.11 -0.48 -0.35 0.00 -2.27 0.00 0.00 64.05 60.83 1v6f n THR 124 Cb 0.53 -0.77 -0.11 0.00 -2.10 0.00 0.00 70.33 67.88 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 -2.31 3.87 -0.13 -0.78 3.01 -1.26 -4.57 119.74 117.57 1v6f s LYS 125 Ca -0.10 -0.39 -0.01 0.00 -1.01 0.00 0.00 55.97 54.46 1v6f s LYS 125 Cb 0.04 -3.25 0.03 0.00 -1.01 0.00 0.00 37.83 33.65 1v6f s LYS 125 CO 0.47 0.12 -0.05 0.08 0.51 0.00 0.00 175.35 176.49 1v6f s VAL 126 N 0.78 0.92 -0.02 3.17 1.01 -1.12 -0.61 120.40 124.52 1v6f s VAL 126 Ca 0.03 -0.36 0.07 0.00 0.00 0.00 0.00 61.98 61.73 1v6f s VAL 126 Cb -0.13 -1.05 -0.02 0.00 0.00 0.00 0.00 36.38 35.18 1v6f s VAL 126 CO 0.02 0.23 -0.24 -0.36 0.00 0.00 0.00 175.10 174.75 1v6f s PHE 127 N 1.73 2.19 -0.11 5.22 0.08 0.33 -4.65 117.98 122.78 1v6f s PHE 127 Ca 0.03 -0.45 0.03 0.00 0.12 0.00 0.00 56.93 56.66 1v6f s PHE 127 Cb -0.14 -1.42 -0.00 0.00 -0.57 0.00 0.00 43.02 40.89 1v6f s PHE 127 CO -0.08 -0.06 -0.21 -2.00 -0.10 0.00 0.00 175.22 172.77 1v6f s GLU 128 N -0.51 3.12 -0.15 0.44 2.12 -1.26 0.26 118.70 122.71 1v6f s GLU 128 Ca 0.08 -0.84 -0.05 0.00 0.36 0.00 0.00 54.97 54.52 1v6f s GLU 128 Cb -0.10 -2.38 -0.03 0.00 0.26 0.00 0.00 34.13 31.87 1v6f s GLU 128 CO -0.00 0.17 0.01 0.96 -0.54 0.00 0.00 175.26 175.85 1v6f s ILE 129 N 0.39 4.30 0.46 -3.70 -4.36 -0.68 -4.94 121.20 112.66 1v6f s ILE 129 Ca -0.16 -0.22 0.21 0.00 -0.26 0.00 0.00 60.65 60.22 1v6f s ILE 129 Cb -0.17 -2.89 0.24 0.00 1.25 0.00 0.00 42.46 40.89 1v6f s ILE 129 CO 0.07 0.50 2.06 0.08 0.24 0.00 0.00 174.94 177.89 1v6f h ARG 130 N 6.40 0.00 -3.18 0.37 0.11 -1.88 -1.71 114.38 114.49 1v6f h ARG 130 Ca -0.37 0.00 -0.15 0.00 0.10 0.00 0.00 59.98 59.56 1v6f h ARG 130 Cb 1.18 0.00 -0.23 0.00 1.11 0.00 0.00 29.97 32.03 1v6f h ARG 130 CO 0.64 0.13 -0.40 -0.80 0.10 0.00 0.00 179.97 179.64 1v6f s ASN 131 N -6.61 -0.18 0.52 0.08 -0.87 -1.25 -0.52 114.94 106.10 1v6f s ASN 131 Ca -0.04 0.26 0.25 0.00 -1.57 0.00 0.00 52.86 51.76 1v6f s ASN 131 Cb 0.15 0.40 1.37 0.00 -0.02 0.00 0.00 41.25 43.15 1v6f s ASN 131 CO 0.64 -0.24 1.95 0.71 -2.57 0.00 0.00 177.10 177.60 1v6f h THR 132 N 4.43 0.69 -0.80 1.60 1.35 -1.87 -0.31 112.91 118.01 1v6f h THR 132 Ca -0.28 -0.02 0.04 0.00 -0.55 0.00 0.00 66.41 65.59 1v6f h THR 132 Cb 1.19 0.62 -0.05 0.00 -1.73 0.00 0.00 68.15 68.18 1v6f h THR 132 CO 0.37 0.01 0.50 -0.33 -0.25 0.00 0.00 175.52 175.83 1v6f h GLU 133 N 0.07 0.95 -0.98 4.72 4.39 -1.95 -1.92 114.58 119.85 1v6f h GLU 133 Ca 0.32 -0.06 0.16 0.00 0.34 0.00 0.00 59.36 60.12 1v6f h GLU 133 Cb 1.18 -0.21 -0.09 0.00 -0.10 0.00 0.00 28.75 29.53 1v6f h GLU 133 CO -0.02 0.63 0.61 -0.44 -1.16 0.00 0.00 179.01 178.63 1v6f h ASP 134 N 0.98 0.79 -0.28 1.42 5.19 -1.46 -3.37 116.42 119.70 1v6f h ASP 134 Ca 0.32 0.07 -0.06 0.00 -0.62 0.00 0.00 57.03 56.74 1v6f h ASP 134 Cb 0.03 -0.08 -0.02 0.00 0.18 0.00 0.00 39.33 39.44 1v6f h ASP 134 CO -0.12 0.36 0.33 -0.11 -3.12 0.00 0.00 179.24 176.57 1v6f n LEU 135 N -4.66 1.26 -4.22 1.55 0.00 -0.72 -4.65 117.00 105.55 1v6f n LEU 135 Ca 0.21 -1.38 -0.13 0.00 0.00 0.00 0.00 56.01 54.70 1v6f n LEU 135 Cb 0.49 -1.49 -0.10 0.00 0.00 0.00 0.00 43.42 42.32 1v6f n LEU 135 CO 0.25 -2.49 -0.36 0.42 0.00 0.00 0.00 177.39 175.22 1v6f s THR 136 N 12.59 0.75 0.15 1.96 -4.23 -1.25 -4.28 115.64 121.32 1v6f s THR 136 Ca 0.98 -1.98 -0.26 0.00 -1.18 0.00 0.00 61.69 59.26 1v6f s THR 136 Cb -0.24 -1.96 0.00 0.00 1.34 0.00 0.00 72.50 71.64 1v6f s THR 136 CO 0.16 -0.63 1.59 -0.08 -0.54 0.00 0.00 174.62 175.13 1v6f h GLU 137 N 2.78 -0.34 -0.20 3.99 4.81 -1.89 0.35 114.58 124.08 1v6f h GLU 137 Ca -0.36 0.02 0.04 0.00 -0.13 0.00 0.00 59.36 58.93 1v6f h GLU 137 Cb 1.19 0.08 -0.03 0.00 0.63 0.00 0.00 28.75 30.61 1v6f h GLU 137 CO 0.63 -0.23 -0.02 1.49 -0.73 0.00 0.00 179.01 180.15 1v6f h GLU 138 N -0.36 0.04 -0.85 1.92 4.81 -1.97 -1.79 114.58 116.38 1v6f h GLU 138 Ca 0.12 -0.00 0.06 0.00 -0.13 0.00 0.00 59.36 59.41 1v6f h GLU 138 Cb 0.57 -0.01 -0.05 0.00 0.63 0.00 0.00 28.75 29.89 1v6f h GLU 138 CO -0.47 0.02 0.56 2.35 -0.73 0.00 0.00 179.01 180.74 1v6f h TRP 139 N 0.04 0.97 0.52 0.92 7.01 -1.62 -1.15 115.95 122.64 1v6f h TRP 139 Ca 0.10 0.02 -0.03 0.00 2.11 0.00 0.00 58.89 61.10 1v6f h TRP 139 Cb 0.13 -0.32 0.00 0.00 -2.10 0.00 0.00 29.16 26.88 1v6f h TRP 139 CO -0.19 0.52 -0.26 1.25 -2.79 0.00 0.00 178.44 176.97 1v6f h LEU 140 N 0.96 -0.61 -2.16 0.65 5.85 0.50 -2.49 115.31 118.01 1v6f h LEU 140 Ca 0.36 0.02 0.06 0.00 0.84 0.00 0.00 57.88 59.16 1v6f h LEU 140 Cb 0.19 0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.37 1v6f h LEU 140 CO -0.13 -0.43 0.29 0.03 -0.34 0.00 0.00 178.44 177.86 1v6f h ARG 141 N -0.71 0.00 -0.60 1.25 3.08 -1.29 -0.18 114.38 115.93 1v6f h ARG 141 Ca -0.07 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 59.91 1v6f h ARG 141 Cb 0.55 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.57 1v6f h ARG 141 CO 0.11 0.00 0.09 1.49 -1.07 0.00 0.00 179.97 180.60 1v6f h GLU 142 N 0.00 1.00 -0.48 0.04 4.57 -0.78 0.27 114.58 119.20 1v6f h GLU 142 Ca 0.10 -0.27 -0.10 0.00 -1.18 0.00 0.00 59.36 57.90 1v6f h GLU 142 Cb 0.67 -0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 29.13 1v6f h GLU 142 CO -0.00 0.95 -0.10 0.87 -1.18 0.00 0.00 179.01 179.54 1v6f h LYS 143 N 0.91 0.88 -0.02 1.92 1.79 -0.65 0.23 116.57 121.64 1v6f h LYS 143 Ca 0.18 -0.30 -0.24 0.00 -2.18 0.00 0.00 60.65 58.11 1v6f h LYS 143 Cb 0.43 -0.07 0.01 0.00 -1.58 0.00 0.00 32.23 31.03 1v6f h LYS 143 CO 0.01 0.94 -0.96 -0.07 -1.08 0.00 0.00 179.45 178.30 1v6f h LEU 144 N 0.79 0.72 -0.10 2.94 3.38 -1.39 -3.32 115.31 118.34 1v6f h LEU 144 Ca 0.13 -0.56 -0.19 0.00 0.09 0.00 0.00 57.88 57.35 1v6f h LEU 144 Cb 0.62 -0.22 0.01 0.00 0.09 0.00 0.00 40.66 41.16 1v6f h LEU 144 CO 0.04 1.36 -0.69 1.23 0.09 0.00 0.00 178.44 180.47 1v6f h GLY 145 N 0.85 0.72 -3.40 0.83 0.00 -0.36 -3.27 103.07 98.43 1v6f h GLY 145 Ca -0.09 -1.06 -0.09 0.00 0.00 0.00 0.00 47.33 46.09 1v6f h GLY 145 CO 0.18 0.94 -0.12 1.44 0.00 0.00 0.00 176.54 178.97 1v6f n SER 146 N -4.07 5.36 -1.67 0.19 7.64 0.81 -4.90 113.62 116.97 1v6f n SER 146 Ca -0.08 -2.47 0.00 0.00 1.01 0.00 0.00 58.87 57.33 1v6f n SER 146 Cb 0.70 -1.24 0.00 0.00 -1.01 0.00 0.00 64.21 62.67 1v6f n SER 146 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1v6f n GLY 147 N 1.82 -4.72 3.77 0.23 0.00 -1.23 -4.88 105.19 100.19 1v6f n GLY 147 Ca 0.17 -0.68 -0.39 0.00 0.00 0.00 0.00 46.02 45.13 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 -3.72 4.15 -0.33 1.61 0.04 -1.26 -4.70 135.00 130.79 1v6f s PRO 148 Ca 0.00 1.93 -0.09 0.00 0.04 0.00 0.00 61.00 62.88 1v6f s PRO 148 Cb 0.00 -2.80 0.01 0.00 0.04 0.00 0.00 34.50 31.75 1v6f s PRO 148 CO 0.00 -0.27 0.15 0.45 0.04 0.00 0.00 177.00 177.38 1v6f s SER 149 N -0.96 5.52 -0.36 6.66 0.15 -1.26 -5.05 113.70 118.39 1v6f s SER 149 Ca 0.55 -0.72 -0.02 0.00 0.70 0.00 0.00 55.95 56.45 1v6f s SER 149 Cb -0.33 -1.98 0.08 0.00 -1.71 0.00 0.00 66.02 62.08 1v6f s SER 149 CO 0.42 -0.26 0.12 -0.94 1.20 0.00 0.00 173.24 173.78 1v6f s SER 150 N 1.57 5.11 0.00 5.45 1.04 -1.26 -2.80 113.70 122.81 1v6f s SER 150 Ca 0.03 -1.71 0.31 0.00 0.48 0.00 0.00 55.95 55.07 1v6f s SER 150 Cb -0.18 -1.78 1.87 0.00 0.10 0.00 0.00 66.02 66.03 1v6f s SER 150 CO 0.06 -0.42 2.20 0.61 0.98 0.00 0.00 173.24 176.66