#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j6y n MET 2 N 0.00 1.87 -2.80 -1.40 0.00 -1.26 -4.95 117.12 108.58 1j6y n MET 2 Ca 0.00 -0.03 -0.42 0.00 0.00 0.00 0.00 57.70 57.25 1j6y n MET 2 Cb 0.00 -1.18 -0.03 0.00 0.00 0.00 0.00 33.22 32.00 1j6y n MET 2 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1j6y s ALA 3 N -2.31 3.48 -0.08 3.04 0.00 -1.26 -4.60 121.76 120.04 1j6y s ALA 3 Ca -0.03 0.18 -0.06 0.00 0.00 0.00 0.00 51.96 52.05 1j6y s ALA 3 Cb 0.03 -3.32 0.02 0.00 0.00 0.00 0.00 23.12 19.85 1j6y s ALA 3 CO 0.30 -0.65 0.12 0.43 0.00 0.00 0.00 175.76 175.96 1j6y n SER 4 N 5.19 -4.22 0.00 0.00 7.64 -1.26 -5.08 113.62 115.89 1j6y n SER 4 Ca 0.06 1.35 0.00 0.00 1.01 0.00 0.00 58.87 61.30 1j6y n SER 4 Cb 0.49 -4.61 0.00 0.00 -1.01 0.00 0.00 64.21 59.08 1j6y n SER 4 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 1j6y n ARG 5 N 1.50 0.00 0.33 1.43 1.85 -1.26 -4.93 116.66 115.57 1j6y n ARG 5 Ca -0.20 0.00 0.11 0.00 -1.00 0.00 0.00 57.85 56.76 1j6y n ARG 5 Cb 0.30 0.00 0.58 0.00 -1.05 0.00 0.00 32.46 32.29 1j6y n ARG 5 CO 0.00 0.00 0.00 0.22 -0.01 0.00 0.00 177.63 177.84 1j6y h ASP 6 N 0.00 0.00 -1.63 2.89 3.58 -1.96 -3.43 116.42 115.87 1j6y h ASP 6 Ca 0.00 0.00 -0.48 0.00 0.42 0.00 0.00 57.03 56.97 1j6y h ASP 6 Cb 0.00 0.00 0.16 0.00 1.72 0.00 0.00 39.33 41.21 1j6y h ASP 6 CO 0.00 0.00 -1.12 1.67 -2.88 0.00 0.00 179.24 176.91 1j6y n GLN 7 N -2.74 0.00 -3.83 0.28 7.27 -1.26 -4.94 117.38 112.16 1j6y n GLN 7 Ca -0.01 0.00 -0.30 0.00 0.07 0.00 0.00 57.00 56.76 1j6y n GLN 7 Cb 0.54 -0.81 -0.15 0.00 2.41 0.00 0.00 30.24 32.22 1j6y n GLN 7 CO 0.00 0.00 0.00 0.54 0.07 0.00 0.00 177.06 177.67 1j6y s VAL 8 N -1.63 1.21 0.71 1.69 0.11 0.60 -4.87 120.40 118.22 1j6y s VAL 8 Ca 0.42 -1.37 -0.11 0.00 -2.93 0.00 0.00 61.98 57.99 1j6y s VAL 8 Cb -0.32 -1.76 0.02 0.00 -1.53 0.00 0.00 36.38 32.78 1j6y s VAL 8 CO 0.58 -0.44 1.07 -0.54 -3.33 0.00 0.00 175.10 172.44 1j6y s LYS 9 N 1.48 2.83 0.00 1.54 1.02 -1.25 -2.71 119.74 122.65 1j6y s LYS 9 Ca 0.04 0.76 0.00 0.00 0.02 0.00 0.00 55.97 56.79 1j6y s LYS 9 Cb -0.18 -1.99 0.00 0.00 -0.52 0.00 0.00 37.83 35.14 1j6y s LYS 9 CO -0.15 -1.12 0.00 0.00 -0.92 0.00 0.00 175.35 173.16 1j6y n ALA 10 N -3.12 0.00 -2.51 5.17 0.00 -1.11 -4.92 120.51 114.02 1j6y n ALA 10 Ca 0.07 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.25 1j6y n ALA 10 Cb 0.55 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.92 1j6y n ALA 10 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1j6y s SER 11 N 0.00 2.83 -0.05 0.00 1.04 -0.96 0.66 113.70 117.22 1j6y s SER 11 Ca 0.00 -1.73 -0.31 0.00 0.48 0.00 0.00 55.95 54.40 1j6y s SER 11 Cb 0.00 0.59 0.12 0.00 0.10 0.00 0.00 66.02 66.83 1j6y s SER 11 CO 0.00 -0.99 1.35 -1.38 0.98 0.00 0.00 173.24 173.21 1j6y s HIS 12 N -3.19 -0.01 0.29 5.02 -3.43 -1.20 -1.73 115.29 111.04 1j6y s HIS 12 Ca 0.23 -0.05 0.03 0.00 -0.80 0.00 0.00 55.06 54.47 1j6y s HIS 12 Cb 0.02 0.53 -0.04 0.00 -1.43 0.00 0.00 32.58 31.66 1j6y s HIS 12 CO 0.16 -0.15 0.18 0.42 -2.00 0.00 0.00 174.74 173.34 1j6y s ILE 13 N -2.14 0.22 0.06 -5.38 1.01 -0.96 -4.63 121.20 109.38 1j6y s ILE 13 Ca 0.20 -2.00 0.01 0.00 0.00 0.00 0.00 60.65 58.86 1j6y s ILE 13 Cb 0.04 -2.51 -0.03 0.00 0.01 0.00 0.00 42.46 39.97 1j6y s ILE 13 CO -0.04 0.00 -0.05 -0.22 0.00 0.00 0.00 174.94 174.63 1j6y s LEU 14 N -3.34 2.41 0.00 2.97 2.96 -1.26 -2.61 118.68 119.81 1j6y s LEU 14 Ca 0.37 -0.84 0.00 0.00 -0.22 0.00 0.00 54.13 53.44 1j6y s LEU 14 Cb 0.05 0.01 0.00 0.00 0.50 0.00 0.00 46.19 46.74 1j6y s LEU 14 CO 0.18 -0.42 0.16 0.00 -1.32 0.00 0.00 176.35 174.95 1j6y n ILE 15 N 0.55 0.00 -0.85 6.68 3.06 -1.09 -2.97 119.36 124.74 1j6y n ILE 15 Ca -0.17 -0.44 0.00 0.00 -2.50 0.00 0.00 62.75 59.65 1j6y n ILE 15 Cb 0.59 1.04 0.00 0.00 0.54 0.00 0.00 39.64 41.81 1j6y n ILE 15 CO 0.00 0.00 0.00 2.29 -2.50 0.00 0.00 176.55 176.34 1j6y n LYS 16 N -0.56 -2.29 0.00 9.51 2.85 -1.26 -4.63 118.16 121.77 1j6y n LYS 16 Ca 0.00 1.75 0.00 0.00 -1.05 0.00 0.00 58.31 59.01 1j6y n LYS 16 Cb 0.01 -2.11 0.00 0.00 -0.65 0.00 0.00 35.03 32.28 1j6y n LYS 16 CO 0.00 0.00 0.00 -2.39 -0.05 0.00 0.00 177.40 174.96 1j6y n HIS 17 N -1.69 0.00 -0.05 5.58 1.44 -1.26 -4.73 115.22 114.50 1j6y n HIS 17 Ca 0.00 0.00 -0.13 0.00 -2.01 0.00 0.00 57.72 55.58 1j6y n HIS 17 Cb 0.17 0.00 -0.01 0.00 0.12 0.00 0.00 29.99 30.27 1j6y n HIS 17 CO 0.00 0.00 0.00 1.96 -2.81 0.00 0.00 176.34 175.49 1j6y h GLN 18 N 0.00 0.77 0.00 -1.40 4.20 -1.49 -3.45 115.11 113.74 1j6y h GLN 18 Ca 0.00 -0.48 0.00 0.00 0.06 0.00 0.00 58.65 58.23 1j6y h GLN 18 Cb 0.00 0.05 0.00 0.00 0.30 0.00 0.00 27.48 27.83 1j6y h GLN 18 CO 0.00 1.11 0.00 0.41 -0.67 0.00 0.00 178.83 179.68 1j6y n GLY 19 N 0.32 2.58 0.61 3.46 0.00 -1.26 -3.24 105.19 107.66 1j6y n GLY 19 Ca -0.04 -0.13 0.05 0.00 0.00 0.00 0.00 46.02 45.90 1j6y n GLY 19 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1j6y n SER 20 N 1.31 1.18 -3.48 1.61 3.41 -1.26 -5.07 113.62 111.32 1j6y n SER 20 Ca 0.00 -2.65 -0.17 0.00 -0.26 0.00 0.00 58.87 55.78 1j6y n SER 20 Cb 0.00 -0.35 -0.03 0.00 -0.26 0.00 0.00 64.21 63.57 1j6y n SER 20 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1j6y n ARG 21 N -0.50 1.28 -0.08 4.33 1.74 -1.20 -5.04 116.66 117.19 1j6y n ARG 21 Ca 0.09 -1.99 0.12 0.00 -0.77 0.00 0.00 57.85 55.30 1j6y n ARG 21 Cb 0.78 0.48 0.18 0.00 -1.02 0.00 0.00 32.46 32.87 1j6y n ARG 21 CO 0.00 0.00 0.00 2.89 -1.52 0.00 0.00 177.63 179.00 1j6y n ARG 22 N -0.79 2.34 -1.81 5.56 1.85 -1.26 -5.02 116.66 117.54 1j6y n ARG 22 Ca -0.10 -1.99 0.00 0.00 -1.00 0.00 0.00 57.85 54.77 1j6y n ARG 22 Cb 0.35 -1.48 0.00 0.00 -1.05 0.00 0.00 32.46 30.28 1j6y n ARG 22 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 1j6y n LYS 23 N 1.31 0.00 -1.28 2.89 5.02 -1.26 -5.01 118.16 119.83 1j6y n LYS 23 Ca 0.17 0.00 -0.27 0.00 -2.02 0.00 0.00 58.31 56.18 1j6y n LYS 23 Cb 0.58 0.00 0.13 0.00 -0.02 0.00 0.00 35.03 35.72 1j6y n LYS 23 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1j6y n ALA 24 N -3.00 5.80 -2.28 7.82 0.00 -1.26 -4.88 120.51 122.71 1j6y n ALA 24 Ca 0.00 -3.21 -0.05 0.00 0.00 0.00 0.00 53.44 50.18 1j6y n ALA 24 Cb 0.00 -1.48 -0.01 0.00 0.00 0.00 0.00 19.45 17.96 1j6y n ALA 24 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1j6y n SER 25 N -1.03 -2.03 -4.09 0.00 7.64 -1.26 -4.87 113.62 107.98 1j6y n SER 25 Ca 0.58 0.34 -0.33 0.00 1.01 0.00 0.00 58.87 60.48 1j6y n SER 25 Cb 1.16 -1.86 -0.15 0.00 -1.01 0.00 0.00 64.21 62.35 1j6y n SER 25 CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 1j6y s TRP 26 N -2.12 3.24 -0.88 1.43 0.23 -1.26 -4.96 118.94 114.62 1j6y s TRP 26 Ca 0.00 -2.22 0.26 0.00 -2.03 0.00 0.00 56.10 52.12 1j6y s TRP 26 Cb 0.00 -1.96 0.79 0.00 0.03 0.00 0.00 33.47 32.33 1j6y s TRP 26 CO 0.00 -0.86 1.64 0.36 0.96 0.00 0.00 176.95 179.05 1j6y n LYS 27 N 4.47 0.10 -0.02 4.98 0.00 -1.26 -4.17 118.16 122.27 1j6y n LYS 27 Ca -0.14 0.05 -0.14 0.00 -0.00 0.00 0.00 58.31 58.08 1j6y n LYS 27 Cb 0.43 -1.59 -0.10 0.00 -0.00 0.00 0.00 35.03 33.77 1j6y n LYS 27 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.40 176.96 1j6y h ASP 28 N 0.00 -1.66 -0.26 -5.58 3.32 -2.00 -3.09 116.42 107.15 1j6y h ASP 28 Ca 0.00 0.20 -0.57 0.00 0.02 0.00 0.00 57.03 56.68 1j6y h ASP 28 Cb 0.59 0.65 -0.01 0.00 0.22 0.00 0.00 39.33 40.78 1j6y h ASP 28 CO 0.00 -0.46 2.03 -0.81 -1.72 0.00 0.00 179.24 178.28 1j6y n PRO 29 N -5.29 1.94 -2.27 3.56 -0.04 -1.26 -4.94 135.00 126.69 1j6y n PRO 29 Ca -0.06 -2.33 -0.41 0.00 -0.04 0.00 0.00 63.50 60.66 1j6y n PRO 29 Cb 0.36 -3.30 -0.03 0.00 -0.04 0.00 0.00 33.50 30.49 1j6y n PRO 29 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1j6y s GLU 30 N 5.10 4.42 0.00 0.54 2.02 -1.17 -4.52 118.70 125.09 1j6y s GLU 30 Ca 0.59 1.98 0.00 0.00 0.02 0.00 0.00 54.97 57.56 1j6y s GLU 30 Cb 0.08 -3.22 0.00 0.00 0.10 0.00 0.00 34.13 31.09 1j6y s GLU 30 CO 0.09 -0.22 0.00 0.41 0.02 0.00 0.00 175.26 175.56 1j6y n GLY 31 N 2.45 -0.66 3.05 -1.39 0.00 -1.26 -5.07 105.19 102.31 1j6y n GLY 31 Ca 0.06 0.37 -0.17 0.00 0.00 0.00 0.00 46.02 46.28 1j6y n GLY 31 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1j6y n LYS 32 N 0.00 -2.26 0.00 1.61 0.00 -1.26 -4.92 118.16 111.33 1j6y n LYS 32 Ca 0.00 1.92 0.00 0.00 0.00 0.00 0.00 58.31 60.23 1j6y n LYS 32 Cb 0.00 -4.61 0.00 0.00 0.00 0.00 0.00 35.03 30.42 1j6y n LYS 32 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.40 178.91 1j6y n ILE 33 N -0.26 0.00 -3.62 3.15 0.00 -1.26 -5.12 119.36 112.25 1j6y n ILE 33 Ca 0.06 0.00 -0.37 0.00 0.00 0.00 0.00 62.75 62.43 1j6y n ILE 33 Cb 0.53 0.00 -0.06 0.00 0.00 0.00 0.00 39.64 40.10 1j6y n ILE 33 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 176.55 176.04 1j6y s ILE 34 N -1.33 5.23 0.13 9.51 1.10 -1.26 -5.05 121.20 129.53 1j6y s ILE 34 Ca 0.00 0.59 -0.30 0.00 -0.51 0.00 0.00 60.65 60.43 1j6y s ILE 34 Cb 0.00 -3.60 -0.07 0.00 0.15 0.00 0.00 42.46 38.93 1j6y s ILE 34 CO 0.00 0.55 1.25 -0.76 -2.11 0.00 0.00 174.94 173.87 1j6y s LEU 35 N -0.71 4.40 0.00 8.50 1.02 -1.26 -5.03 118.68 125.60 1j6y s LEU 35 Ca 0.20 2.20 0.00 0.00 0.02 0.00 0.00 54.13 56.54 1j6y s LEU 35 Cb -0.14 -3.59 0.00 0.00 0.02 0.00 0.00 46.19 42.47 1j6y s LEU 35 CO 0.08 -0.48 0.00 1.07 0.02 0.00 0.00 176.35 177.04 1j6y n THR 36 N 3.29 0.00 -2.23 5.49 5.66 -1.26 -4.97 114.28 120.27 1j6y n THR 36 Ca 0.08 0.00 -0.41 0.00 -3.05 0.00 0.00 64.05 60.67 1j6y n THR 36 Cb 0.44 -0.82 -0.03 0.00 -1.55 0.00 0.00 70.33 68.37 1j6y n THR 36 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 1j6y s THR 37 N 0.00 2.96 0.50 1.09 2.01 -1.26 -4.94 115.64 115.99 1j6y s THR 37 Ca 0.00 0.97 0.06 0.00 0.31 0.00 0.00 61.69 63.03 1j6y s THR 37 Cb 0.00 -3.62 0.01 0.00 0.01 0.00 0.00 72.50 68.90 1j6y s THR 37 CO 0.00 0.23 0.34 0.42 -0.69 0.00 0.00 174.62 174.92 1j6y s THR 38 N -1.15 1.93 0.00 -0.82 -4.23 -1.26 -1.37 115.64 108.73 1j6y s THR 38 Ca 0.48 -1.53 0.00 0.00 -1.18 0.00 0.00 61.69 59.46 1j6y s THR 38 Cb -0.37 -2.45 0.00 0.00 1.34 0.00 0.00 72.50 71.01 1j6y s THR 38 CO 0.49 0.00 0.46 0.54 -0.54 0.00 0.00 174.62 175.57 1j6y n ARG 39 N -1.60 0.00 -0.18 3.99 1.74 -1.26 0.15 116.66 119.50 1j6y n ARG 39 Ca -0.01 0.34 -0.08 0.00 -0.77 0.00 0.00 57.85 57.33 1j6y n ARG 39 Cb 0.64 -0.96 -0.06 0.00 -1.02 0.00 0.00 32.46 31.06 1j6y n ARG 39 CO 0.00 0.00 0.00 1.49 -1.52 0.00 0.00 177.63 177.60 1j6y h GLU 40 N 0.00 -0.12 -0.99 5.56 4.57 -1.99 0.63 114.58 122.24 1j6y h GLU 40 Ca 0.00 0.01 0.35 0.00 -1.18 0.00 0.00 59.36 58.54 1j6y h GLU 40 Cb 0.00 0.03 -0.17 0.00 -0.16 0.00 0.00 28.75 28.45 1j6y h GLU 40 CO 0.00 -0.08 0.45 0.00 -1.18 0.00 0.00 179.01 178.20 1j6y h ALA 41 N -0.28 1.89 0.54 2.92 0.00 -1.92 0.37 119.26 122.78 1j6y h ALA 41 Ca 0.07 0.25 -0.03 0.00 0.00 0.00 0.00 54.91 55.21 1j6y h ALA 41 Cb 0.32 0.31 0.01 0.00 0.00 0.00 0.00 17.79 18.43 1j6y h ALA 41 CO -0.48 -0.75 -0.26 0.00 0.00 0.00 0.00 179.25 177.76 1j6y h ALA 42 N 1.93 -0.73 -0.14 0.00 0.00 0.72 1.13 119.26 122.18 1j6y h ALA 42 Ca 0.76 -0.17 0.04 0.00 0.00 0.00 0.00 54.91 55.54 1j6y h ALA 42 Cb 1.84 0.28 -0.01 0.00 0.00 0.00 0.00 17.79 19.91 1j6y h ALA 42 CO -0.73 -0.90 0.11 -0.24 0.00 0.00 0.00 179.25 177.49 1j6y h VAL 43 N -0.76 0.73 0.03 0.00 3.04 0.63 0.59 116.25 120.52 1j6y h VAL 43 Ca -0.07 0.00 -0.12 0.00 -1.01 0.00 0.00 66.70 65.50 1j6y h VAL 43 Cb 0.57 0.92 0.01 0.00 -2.01 0.00 0.00 31.29 30.78 1j6y h VAL 43 CO 0.12 0.00 -0.47 -0.08 -1.01 0.00 0.00 177.57 176.13 1j6y h GLU 44 N 0.00 0.27 -0.68 4.17 4.22 0.34 0.22 114.58 123.12 1j6y h GLU 44 Ca 0.06 -0.33 -0.05 0.00 0.08 0.00 0.00 59.36 59.12 1j6y h GLU 44 Cb 0.29 0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.61 1j6y h GLU 44 CO -0.00 1.06 0.21 0.37 -2.18 0.00 0.00 179.01 178.47 1j6y h GLN 45 N -0.36 1.05 -0.06 1.92 -0.00 0.25 -2.35 115.11 115.54 1j6y h GLN 45 Ca -0.07 -0.21 -0.19 0.00 -0.00 0.00 0.00 58.65 58.18 1j6y h GLN 45 Cb 1.25 -0.16 -0.00 0.00 0.00 0.00 0.00 27.48 28.57 1j6y h GLN 45 CO 0.09 0.90 -0.76 1.25 0.00 0.00 0.00 178.83 180.31 1j6y h LEU 46 N 1.01 0.47 -0.95 -2.39 5.85 0.11 -2.99 115.31 116.42 1j6y h LEU 46 Ca 0.22 -0.32 0.20 0.00 0.84 0.00 0.00 57.88 58.82 1j6y h LEU 46 Cb 0.29 -0.14 -0.11 0.00 0.37 0.00 0.00 40.66 41.07 1j6y h LEU 46 CO -0.01 1.07 0.53 0.50 -0.34 0.00 0.00 178.44 180.19 1j6y h LYS 47 N 0.26 0.62 -0.27 1.25 3.64 -0.01 0.49 116.57 122.55 1j6y h LYS 47 Ca -0.04 -0.04 -0.16 0.00 -1.27 0.00 0.00 60.65 59.15 1j6y h LYS 47 Cb 1.34 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 33.02 1j6y h LYS 47 CO 0.13 0.41 -0.48 0.66 -2.27 0.00 0.00 179.45 177.90 1j6y h SER 48 N 0.64 0.79 0.36 4.20 4.64 -1.41 -0.08 113.55 122.69 1j6y h SER 48 Ca 0.56 -0.39 -0.02 0.00 -0.47 0.00 0.00 61.79 61.48 1j6y h SER 48 Cb 0.93 -0.22 0.00 0.00 -0.31 0.00 0.00 62.40 62.80 1j6y h SER 48 CO -0.42 1.13 -0.18 -0.29 -0.87 0.00 0.00 176.83 176.21 1j6y h ILE 49 N 0.57 0.65 -0.64 0.95 -0.00 -0.11 1.65 117.51 120.58 1j6y h ILE 49 Ca 0.03 -0.29 0.07 0.00 -0.00 0.00 0.00 64.86 64.67 1j6y h ILE 49 Cb 1.04 0.80 -0.04 0.00 -0.00 0.00 0.00 36.82 38.62 1j6y h ILE 49 CO 0.10 0.06 0.43 -0.09 -0.00 0.00 0.00 178.15 178.64 1j6y h ARG 50 N -0.65 0.60 0.50 2.19 2.43 -0.31 1.10 114.38 120.23 1j6y h ARG 50 Ca -0.05 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.06 1j6y h ARG 50 Cb 0.47 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 29.89 1j6y h ARG 50 CO 0.08 0.40 -0.24 1.49 -1.51 0.00 0.00 179.97 180.19 1j6y h GLU 51 N 0.62 -0.65 -0.59 0.20 4.57 -0.38 0.78 114.58 119.12 1j6y h GLU 51 Ca 0.28 0.04 0.10 0.00 -1.18 0.00 0.00 59.36 58.60 1j6y h GLU 51 Cb 0.31 0.15 -0.07 0.00 -0.16 0.00 0.00 28.75 28.98 1j6y h GLU 51 CO -0.09 -0.40 0.20 -0.44 -1.18 0.00 0.00 179.01 177.10 1j6y h ASP 52 N -1.15 0.17 0.33 1.04 3.32 0.29 1.05 116.42 121.47 1j6y h ASP 52 Ca -0.07 0.08 -0.04 0.00 0.02 0.00 0.00 57.03 57.03 1j6y h ASP 52 Cb 0.55 0.08 -0.01 0.00 0.22 0.00 0.00 39.33 40.17 1j6y h ASP 52 CO 0.11 0.11 -0.18 0.40 -1.72 0.00 0.00 179.24 177.96 1j6y h ILE 53 N 0.37 0.83 0.62 0.35 2.04 0.13 -2.94 117.51 118.89 1j6y h ILE 53 Ca 0.30 -0.68 -0.03 0.00 1.00 0.00 0.00 64.86 65.45 1j6y h ILE 53 Cb 0.39 1.40 0.01 0.00 -0.74 0.00 0.00 36.82 37.88 1j6y h ILE 53 CO -0.32 0.17 -0.30 0.58 0.00 0.00 0.00 178.15 178.29 1j6y h VAL 54 N 0.00 0.00 -2.95 1.67 2.07 0.79 -3.43 116.25 114.40 1j6y h VAL 54 Ca -0.00 -0.27 -0.63 0.00 0.82 0.00 0.00 66.70 66.62 1j6y h VAL 54 Cb 0.39 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 30.08 1j6y h VAL 54 CO 0.02 0.00 -0.36 -0.44 0.02 0.00 0.00 177.57 176.82 1j6y s SER 55 N -4.21 6.53 0.00 0.57 0.01 0.56 -4.84 113.70 112.31 1j6y s SER 55 Ca -0.12 0.62 0.00 0.00 1.31 0.00 0.00 55.95 57.76 1j6y s SER 55 Cb 0.01 -2.16 0.00 0.00 0.21 0.00 0.00 66.02 64.09 1j6y s SER 55 CO 0.36 0.30 0.00 0.61 0.41 0.00 0.00 173.24 174.92 1j6y n GLY 56 N 2.34 -1.91 2.54 3.44 0.00 -1.26 -4.64 105.19 105.70 1j6y n GLY 56 Ca -0.16 -0.73 -0.09 0.00 0.00 0.00 0.00 46.02 45.04 1j6y n GLY 56 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1j6y n LYS 57 N 0.82 0.97 0.00 1.61 4.81 -1.26 -4.67 118.16 120.43 1j6y n LYS 57 Ca 0.00 -0.70 0.00 0.00 -0.87 0.00 0.00 58.31 56.74 1j6y n LYS 57 Cb 0.00 -1.97 0.00 0.00 0.02 0.00 0.00 35.03 33.08 1j6y n LYS 57 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1j6y n ALA 58 N 3.66 0.00 -1.59 3.14 0.00 -1.26 -5.03 120.51 119.42 1j6y n ALA 58 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.65 1j6y n ALA 58 Cb 0.20 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.65 1j6y n ALA 58 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1j6y n ASN 59 N -1.59 0.00 0.00 0.00 4.13 -1.26 -5.05 115.26 111.49 1j6y n ASN 59 Ca 0.00 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.26 1j6y n ASN 59 Cb 0.00 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.24 1j6y n ASN 59 CO 0.00 0.00 0.00 0.33 0.28 0.00 0.00 177.26 177.87 1j6y n PHE 60 N 0.00 0.00 0.00 3.10 -0.00 -1.26 -5.00 117.46 114.30 1j6y n PHE 60 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.45 1j6y n PHE 60 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 39.48 1j6y n PHE 60 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.76 177.15 1j6y n GLU 61 N -0.03 0.00 -0.33 -4.13 -0.58 -1.26 -1.42 120.64 112.89 1j6y n GLU 61 Ca 0.00 0.00 0.19 0.00 -0.42 0.00 0.00 57.16 56.93 1j6y n GLU 61 Cb 0.00 -0.53 0.36 0.00 -0.57 0.00 0.00 31.44 30.71 1j6y n GLU 61 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 1j6y h GLU 62 N 0.00 0.03 -0.84 3.49 5.08 -1.97 1.37 114.58 121.74 1j6y h GLU 62 Ca 0.00 -0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.38 1j6y h GLU 62 Cb 0.00 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.20 1j6y h GLU 62 CO 0.00 0.02 0.55 -0.24 -1.00 0.00 0.00 179.01 178.34 1j6y h VAL 63 N 0.04 1.18 0.00 3.13 3.04 -1.95 -0.08 116.25 121.60 1j6y h VAL 63 Ca 0.66 -0.38 -0.00 0.00 -1.01 0.00 0.00 66.70 65.97 1j6y h VAL 63 Cb 1.47 -0.02 -0.00 0.00 -2.01 0.00 0.00 31.29 30.73 1j6y h VAL 63 CO -0.85 0.20 -0.01 0.00 -1.01 0.00 0.00 177.57 175.90 1j6y h ALA 64 N 1.33 1.05 0.13 3.17 0.00 0.30 1.02 119.26 126.27 1j6y h ALA 64 Ca 0.32 -0.01 -0.36 0.00 0.00 0.00 0.00 54.91 54.86 1j6y h ALA 64 Cb -0.07 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1j6y h ALA 64 CO -0.09 0.01 -1.96 1.15 0.00 0.00 0.00 179.25 178.36 1j6y h THR 65 N 0.00 0.67 0.00 0.00 2.02 -0.39 -3.29 112.91 111.92 1j6y h THR 65 Ca -0.00 -2.36 -0.02 0.00 0.77 0.00 0.00 66.41 64.80 1j6y h THR 65 Cb 0.15 2.54 -0.00 0.00 -1.74 0.00 0.00 68.15 69.09 1j6y h THR 65 CO 0.00 0.90 -1.60 -1.14 0.37 0.00 0.00 175.52 174.05 1j6y n ARG 66 N -3.51 0.64 0.00 6.66 0.63 -0.62 -4.13 116.66 116.33 1j6y n ARG 66 Ca -0.31 -0.05 0.13 0.00 -0.92 0.00 0.00 57.85 56.70 1j6y n ARG 66 Cb 1.05 -1.65 0.35 0.00 0.45 0.00 0.00 32.46 32.65 1j6y n ARG 66 CO 0.00 0.00 0.00 1.55 -2.51 0.00 0.00 177.63 176.67 1j6y n VAL 67 N -2.47 0.00 -3.38 5.15 3.14 0.35 -4.90 118.33 116.22 1j6y n VAL 67 Ca -0.04 -0.32 -0.34 0.00 -2.96 0.00 0.00 64.34 60.68 1j6y n VAL 67 Cb 0.60 0.85 -0.06 0.00 -1.06 0.00 0.00 33.84 34.17 1j6y n VAL 67 CO 0.00 0.00 0.00 -0.94 -6.46 0.00 0.00 176.83 169.43 1j6y s SER 68 N -2.07 6.74 0.20 6.55 1.04 -1.16 -3.72 113.70 121.28 1j6y s SER 68 Ca 0.32 1.02 -0.20 0.00 0.48 0.00 0.00 55.95 57.57 1j6y s SER 68 Cb 0.20 -2.26 0.16 0.00 0.10 0.00 0.00 66.02 64.22 1j6y s SER 68 CO 0.35 0.03 1.57 -0.78 0.98 0.00 0.00 173.24 175.39 1j6y h ASP 69 N 3.13 -1.27 0.00 7.02 1.82 -1.82 -3.42 116.42 121.88 1j6y h ASP 69 Ca -0.48 0.26 0.00 0.00 -0.39 0.00 0.00 57.03 56.42 1j6y h ASP 69 Cb 1.18 0.65 0.00 0.00 0.68 0.00 0.00 39.33 41.84 1j6y h ASP 69 CO 0.67 -0.30 0.00 0.00 -1.61 0.00 0.00 179.24 178.00 1j6y h SER 71 N 0.00 -1.71 -0.93 0.00 0.87 -1.97 1.40 113.55 111.21 1j6y h SER 71 Ca 0.00 0.25 0.22 0.00 -1.23 0.00 0.00 61.79 61.03 1j6y h SER 71 Cb 0.00 0.73 -0.07 0.00 -0.44 0.00 0.00 62.40 62.62 1j6y h SER 71 CO 0.00 -0.37 0.62 0.28 -0.53 0.00 0.00 176.83 176.83 1j6y h SER 72 N -0.32 0.36 -1.00 6.23 0.02 -1.91 0.84 113.55 117.77 1j6y h SER 72 Ca 0.12 0.04 0.21 0.00 -0.84 0.00 0.00 61.79 61.32 1j6y h SER 72 Cb 0.58 -0.02 -0.11 0.00 0.14 0.00 0.00 62.40 62.98 1j6y h SER 72 CO -0.64 0.13 0.61 0.00 -1.14 0.00 0.00 176.83 175.79 1j6y h ALA 73 N 1.60 1.75 0.00 3.77 0.00 0.18 2.53 119.26 129.08 1j6y h ALA 73 Ca 0.48 0.09 -0.11 0.00 0.00 0.00 0.00 54.91 55.38 1j6y h ALA 73 Cb 1.30 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.03 1j6y h ALA 73 CO -0.17 -0.15 -0.51 -0.22 0.00 0.00 0.00 179.25 178.19 1j6y h LYS 74 N 0.68 0.00 -1.02 0.00 3.64 0.11 -3.03 116.57 116.95 1j6y h LYS 74 Ca 0.60 0.00 -0.60 0.00 -1.27 0.00 0.00 60.65 59.38 1j6y h LYS 74 Cb 1.04 0.00 -0.38 0.00 -0.41 0.00 0.00 32.23 32.48 1j6y h LYS 74 CO -0.41 0.51 -0.26 -2.13 -2.27 0.00 0.00 179.45 174.90 1j6y n ARG 75 N -3.80 3.30 0.10 1.90 0.63 0.70 -4.72 116.66 114.78 1j6y n ARG 75 Ca -0.01 -3.97 0.10 0.00 -0.92 0.00 0.00 57.85 53.05 1j6y n ARG 75 Cb 0.55 -2.28 0.43 0.00 0.45 0.00 0.00 32.46 31.62 1j6y n ARG 75 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1j6y n GLY 76 N -0.71 -1.05 0.00 5.14 0.00 0.67 -4.31 105.19 104.93 1j6y n GLY 76 Ca 0.48 0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.59 1j6y n GLY 76 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j6y n GLY 77 N -0.46 1.69 3.22 -0.02 0.00 -1.26 -4.57 105.19 103.80 1j6y n GLY 77 Ca 0.01 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.90 1j6y n GLY 77 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1j6y s ASP 78 N -1.00 0.46 -0.08 1.61 1.47 -1.26 -3.23 116.67 114.65 1j6y s ASP 78 Ca 0.00 -1.44 -0.04 0.00 1.18 0.00 0.00 52.55 52.25 1j6y s ASP 78 Cb 0.00 0.38 -0.02 0.00 -0.34 0.00 0.00 42.92 42.94 1j6y s ASP 78 CO 0.00 -0.86 0.19 -0.07 0.68 0.00 0.00 175.17 175.11 1j6y h LEU 79 N 2.53 -0.13 0.00 2.11 4.07 -0.08 -3.47 115.31 120.34 1j6y h LEU 79 Ca -0.35 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.62 1j6y h LEU 79 Cb 1.25 0.03 0.00 0.00 1.08 0.00 0.00 40.66 43.02 1j6y h LEU 79 CO 0.52 0.32 0.00 0.61 -1.08 0.00 0.00 178.44 178.81 1j6y n GLY 80 N 1.38 1.97 3.43 0.83 0.00 -0.94 -4.94 105.19 106.92 1j6y n GLY 80 Ca -0.02 -0.60 -0.13 0.00 0.00 0.00 0.00 46.02 45.28 1j6y n GLY 80 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1j6y s SER 81 N -4.00 -0.58 0.00 1.61 1.04 -1.26 -2.75 113.70 107.76 1j6y s SER 81 Ca 0.00 1.09 0.00 0.00 0.48 0.00 0.00 55.95 57.52 1j6y s SER 81 Cb 0.00 1.09 0.00 0.00 0.10 0.00 0.00 66.02 67.21 1j6y s SER 81 CO 0.00 -0.19 0.00 2.22 0.98 0.00 0.00 173.24 176.25 1j6y n PHE 82 N 3.04 0.00 0.00 5.02 -1.74 -1.10 -4.91 117.46 117.77 1j6y n PHE 82 Ca -0.15 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.74 1j6y n PHE 82 Cb 0.56 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.56 1j6y n PHE 82 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 1j6y n GLY 83 N 0.00 2.15 2.63 4.97 0.00 -1.26 0.22 105.19 113.89 1j6y n GLY 83 Ca 0.00 -0.45 -0.41 0.00 0.00 0.00 0.00 46.02 45.16 1j6y n GLY 83 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1j6y n ARG 84 N 0.00 4.37 0.00 1.61 5.12 -1.26 -3.97 116.66 122.52 1j6y n ARG 84 Ca 0.00 -3.61 0.00 0.00 -1.93 0.00 0.00 57.85 52.31 1j6y n ARG 84 Cb 0.00 -2.70 0.00 0.00 -1.16 0.00 0.00 32.46 28.60 1j6y n ARG 84 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1j6y n GLY 85 N 1.90 0.26 3.49 -0.13 0.00 -1.26 -5.15 105.19 104.29 1j6y n GLY 85 Ca 0.53 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.32 1j6y n GLY 85 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1j6y s GLN 86 N 0.00 1.72 -0.10 1.61 -0.21 -1.25 -4.98 119.66 116.44 1j6y s GLN 86 Ca 0.00 -1.96 -0.07 0.00 0.02 0.00 0.00 55.36 53.36 1j6y s GLN 86 Cb 0.00 -1.03 0.03 0.00 1.00 0.00 0.00 33.01 33.01 1j6y s GLN 86 CO 0.00 -0.16 0.13 -1.33 -2.12 0.00 0.00 175.29 171.82 1j6y n MET 87 N -0.75 -3.13 0.00 2.91 2.81 -1.26 -4.36 117.12 113.35 1j6y n MET 87 Ca -0.03 2.46 0.00 0.00 -1.81 0.00 0.00 57.70 58.32 1j6y n MET 87 Cb 0.67 -3.14 0.00 0.00 -0.71 0.00 0.00 33.22 30.03 1j6y n MET 87 CO 0.00 0.00 0.00 0.94 1.51 0.00 0.00 175.97 178.42 1j6y n GLN 88 N 2.09 1.31 0.10 0.03 -0.06 -1.26 -4.32 117.38 115.27 1j6y n GLN 88 Ca -0.23 0.00 -0.03 0.00 -2.00 0.00 0.00 57.00 54.74 1j6y n GLN 88 Cb 0.35 0.00 -0.01 0.00 -4.06 0.00 0.00 30.24 26.52 1j6y n GLN 88 CO 0.00 0.00 0.00 0.87 -0.20 0.00 0.00 177.06 177.73 1j6y h LYS 89 N 0.00 0.00 0.00 3.69 1.57 -1.99 -3.29 116.57 116.55 1j6y h LYS 89 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1j6y h LYS 89 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1j6y h LYS 89 CO 0.00 0.79 0.00 -0.35 -0.57 0.00 0.00 179.45 179.32 1j6y n PRO 90 N -3.40 0.00 -0.32 3.15 -0.04 -1.26 -2.94 135.00 130.18 1j6y n PRO 90 Ca 0.00 0.00 -0.07 0.00 -0.04 0.00 0.00 63.50 63.39 1j6y n PRO 90 Cb 0.82 -0.28 -0.04 0.00 -0.04 0.00 0.00 33.50 33.96 1j6y n PRO 90 CO 0.00 0.00 0.00 0.35 -0.04 0.00 0.00 175.50 175.81 1j6y h PHE 91 N 0.00 -1.44 -0.71 0.54 3.04 -1.91 -1.80 116.94 114.67 1j6y h PHE 91 Ca 0.00 0.10 0.06 0.00 3.98 0.00 0.00 57.97 62.12 1j6y h PHE 91 Cb 0.00 0.75 -0.09 0.00 2.56 0.00 0.00 35.95 39.17 1j6y h PHE 91 CO 0.00 -0.40 -0.42 -1.91 -2.02 0.00 0.00 178.31 173.56 1j6y n GLU 92 N -5.38 -0.31 0.33 1.11 2.13 -1.24 0.28 120.64 117.56 1j6y n GLU 92 Ca 0.04 1.36 0.14 0.00 0.66 0.00 0.00 57.16 59.36 1j6y n GLU 92 Cb 0.34 -2.01 0.75 0.00 0.27 0.00 0.00 31.44 30.79 1j6y n GLU 92 CO 0.00 0.00 0.00 1.05 -0.41 0.00 0.00 177.13 177.77 1j6y h GLU 93 N 0.00 0.00 0.18 5.31 -0.00 -1.22 0.33 114.58 119.18 1j6y h GLU 93 Ca 0.11 0.00 -0.01 0.00 -0.00 0.00 0.00 59.36 59.47 1j6y h GLU 93 Cb 0.29 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.04 1j6y h GLU 93 CO -0.67 0.00 -0.08 0.00 -0.00 0.00 0.00 179.01 178.26 1j6y h ALA 94 N 1.24 -0.24 0.00 1.06 0.00 0.43 0.34 119.26 122.09 1j6y h ALA 94 Ca 0.00 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 54.64 1j6y h ALA 94 Cb 0.75 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 1j6y h ALA 94 CO 0.00 -0.27 -0.42 1.15 0.00 0.00 0.00 179.25 179.71 1j6y h THR 95 N -0.97 1.17 0.00 0.00 2.02 -0.42 -0.17 112.91 114.53 1j6y h THR 95 Ca -0.02 -1.53 -0.10 0.00 0.77 0.00 0.00 66.41 65.53 1j6y h THR 95 Cb 0.45 1.85 -0.01 0.00 -1.74 0.00 0.00 68.15 68.70 1j6y h THR 95 CO 0.04 0.42 -0.47 1.88 0.37 0.00 0.00 175.52 177.76 1j6y h TYR 96 N 0.00 0.00 0.14 3.16 0.05 -0.47 -3.28 116.97 116.58 1j6y h TYR 96 Ca -0.00 0.00 -0.28 0.00 0.05 0.00 0.00 58.73 58.49 1j6y h TYR 96 Cb 0.82 0.00 0.01 0.00 1.01 0.00 0.00 36.73 38.57 1j6y h TYR 96 CO 0.00 0.47 -1.39 0.00 -1.05 0.00 0.00 178.16 176.19 1j6y h ALA 97 N 1.53 0.10 -2.31 3.88 0.00 -0.39 -3.44 119.26 118.63 1j6y h ALA 97 Ca -0.00 -1.02 -0.57 0.00 0.00 0.00 0.00 54.91 53.31 1j6y h ALA 97 Cb 1.19 0.39 -0.06 0.00 0.00 0.00 0.00 17.79 19.31 1j6y h ALA 97 CO 0.06 0.78 0.49 -1.17 0.00 0.00 0.00 179.25 179.41 1j6y s LEU 98 N -7.56 4.18 -0.60 0.00 2.96 -0.13 -4.98 118.68 112.57 1j6y s LEU 98 Ca -0.17 1.29 0.06 0.00 -0.22 0.00 0.00 54.13 55.09 1j6y s LEU 98 Cb 0.04 -3.36 0.25 0.00 0.50 0.00 0.00 46.19 43.62 1j6y s LEU 98 CO 0.81 -0.45 0.70 1.17 -1.32 0.00 0.00 176.35 177.26 1j6y n LYS 99 N 5.32 2.20 -1.43 1.98 4.81 -1.26 -4.80 118.16 124.97 1j6y n LYS 99 Ca 0.07 -4.42 -0.12 0.00 -0.87 0.00 0.00 58.31 52.97 1j6y n LYS 99 Cb 0.48 -2.08 -0.05 0.00 0.02 0.00 0.00 35.03 33.41 1j6y n LYS 99 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 1j6y n VAL 100 N 0.97 -0.04 0.51 3.15 0.31 -1.26 -4.70 118.33 117.28 1j6y n VAL 100 Ca 0.28 0.00 0.06 0.00 -0.01 0.00 0.00 64.34 64.67 1j6y n VAL 100 Cb 0.43 -1.22 -0.07 0.00 -0.91 0.00 0.00 33.84 32.07 1j6y n VAL 100 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1j6y n GLY 101 N -0.27 -0.22 0.00 2.92 0.00 -1.26 -4.07 105.19 102.29 1j6y n GLY 101 Ca -0.13 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.55 1j6y n GLY 101 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1j6y n ASP 102 N -1.37 0.00 0.00 1.61 8.00 -1.26 -5.10 116.55 118.43 1j6y n ASP 102 Ca 0.02 -0.34 0.00 0.00 0.71 0.00 0.00 54.79 55.17 1j6y n ASP 102 Cb 0.21 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.31 1j6y n ASP 102 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 1j6y n ILE 103 N 0.00 0.00 0.00 0.53 5.41 -1.26 -4.76 119.36 119.28 1j6y n ILE 103 Ca 0.00 0.13 0.00 0.00 1.00 0.00 0.00 62.75 63.88 1j6y n ILE 103 Cb 0.00 -1.08 0.00 0.00 -0.71 0.00 0.00 39.64 37.85 1j6y n ILE 103 CO 0.00 0.00 0.00 -1.20 0.00 0.00 0.00 176.55 175.35 1j6y n SER 104 N -1.76 0.00 -3.29 4.38 7.64 -1.26 -4.38 113.62 114.96 1j6y n SER 104 Ca 0.00 0.00 -0.16 0.00 1.01 0.00 0.00 58.87 59.72 1j6y n SER 104 Cb 0.00 0.00 0.15 0.00 -1.01 0.00 0.00 64.21 63.35 1j6y n SER 104 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1j6y n ASP 105 N 0.00 -2.99 -4.71 6.43 2.03 -1.26 -4.54 116.55 111.51 1j6y n ASP 105 Ca 0.00 -0.45 -0.43 0.00 0.52 0.00 0.00 54.79 54.43 1j6y n ASP 105 Cb 0.00 -0.63 -0.03 0.00 -0.72 0.00 0.00 41.12 39.74 1j6y n ASP 105 CO 0.00 0.00 0.00 2.30 -1.92 0.00 0.00 177.20 177.58 1j6y n ILE 106 N -4.40 0.31 -3.68 5.18 -0.00 -1.26 -4.69 119.36 110.81 1j6y n ILE 106 Ca 0.07 -0.08 -0.35 0.00 -0.00 0.00 0.00 62.75 62.39 1j6y n ILE 106 Cb 0.31 -1.88 -0.08 0.00 -0.00 0.00 0.00 39.64 37.99 1j6y n ILE 106 CO 0.00 0.00 0.00 -0.69 -0.00 0.00 0.00 176.55 175.86 1j6y s VAL 107 N 0.77 4.08 -0.76 7.28 1.01 0.26 -4.87 120.40 128.16 1j6y s VAL 107 Ca 0.73 -3.70 -0.24 0.00 0.00 0.00 0.00 61.98 58.76 1j6y s VAL 107 Cb -0.54 -3.57 0.06 0.00 0.00 0.00 0.00 36.38 32.33 1j6y s VAL 107 CO 0.38 -1.03 1.17 1.51 0.00 0.00 0.00 175.10 177.12 1j6y s ASP 108 N -0.08 6.25 0.00 3.32 1.47 -1.24 0.67 116.67 127.07 1j6y s ASP 108 Ca 0.25 -0.94 0.00 0.00 1.18 0.00 0.00 52.55 53.03 1j6y s ASP 108 Cb -0.10 -2.49 0.00 0.00 -0.34 0.00 0.00 42.92 39.99 1j6y s ASP 108 CO -0.11 -1.57 0.00 1.07 0.68 0.00 0.00 175.17 175.24 1j6y n THR 109 N 6.19 0.00 0.00 2.11 5.66 0.72 -4.88 114.28 124.08 1j6y n THR 109 Ca 0.06 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.06 1j6y n THR 109 Cb 0.48 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.26 1j6y n THR 109 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 1j6y n ASP 110 N -0.26 0.00 0.09 1.09 2.03 -1.26 0.18 116.55 118.42 1j6y n ASP 110 Ca 0.00 0.00 -0.01 0.00 0.52 0.00 0.00 54.79 55.30 1j6y n ASP 110 Cb 0.00 0.00 -0.04 0.00 -0.72 0.00 0.00 41.12 40.36 1j6y n ASP 110 CO 0.00 0.00 0.00 -1.28 -1.92 0.00 0.00 177.20 174.00 1j6y h SER 111 N 0.00 0.00 0.00 1.67 0.87 -1.98 -3.50 113.55 110.61 1j6y h SER 111 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1j6y h SER 111 Cb 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 1j6y h SER 111 CO 0.00 0.68 0.00 0.61 -0.53 0.00 0.00 176.83 177.59 1j6y n GLY 112 N 1.30 -0.53 3.67 5.77 0.00 0.47 -4.80 105.19 111.08 1j6y n GLY 112 Ca -0.01 -0.15 -0.38 0.00 0.00 0.00 0.00 46.02 45.48 1j6y n GLY 112 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1j6y s VAL 113 N -0.19 5.21 0.16 1.61 -7.23 -1.24 0.26 120.40 118.97 1j6y s VAL 113 Ca 0.00 0.68 0.01 0.00 -1.81 0.00 0.00 61.98 60.86 1j6y s VAL 113 Cb 0.00 -3.71 -0.00 0.00 0.56 0.00 0.00 36.38 33.22 1j6y s VAL 113 CO 0.00 0.26 0.04 1.41 -0.31 0.00 0.00 175.10 176.50 1j6y n HIS 114 N 4.45 0.15 -3.45 2.82 -0.00 0.21 -2.67 115.22 116.73 1j6y n HIS 114 Ca -0.09 -0.94 -0.17 0.00 -0.00 0.00 0.00 57.72 56.52 1j6y n HIS 114 Cb 0.51 -0.03 -0.11 0.00 -0.00 0.00 0.00 29.99 30.36 1j6y n HIS 114 CO 0.00 0.00 0.00 0.96 -0.00 0.00 0.00 176.34 177.30 1j6y s ILE 115 N -1.98 -0.37 0.95 1.59 -4.36 -1.07 -0.57 121.20 115.37 1j6y s ILE 115 Ca 0.06 -0.27 -0.13 0.00 -0.26 0.00 0.00 60.65 60.04 1j6y s ILE 115 Cb 0.00 -0.82 0.16 0.00 1.25 0.00 0.00 42.46 43.05 1j6y s ILE 115 CO 0.04 -0.31 1.14 -0.63 0.24 0.00 0.00 174.94 175.42 1j6y s ILE 116 N 2.35 1.97 -0.30 8.37 1.09 -1.26 -2.27 121.20 131.16 1j6y s ILE 116 Ca 0.09 0.00 -0.12 0.00 -1.10 0.00 0.00 60.65 59.52 1j6y s ILE 116 Cb -0.15 -2.72 0.16 0.00 -1.06 0.00 0.00 42.46 38.69 1j6y s ILE 116 CO -0.21 0.00 0.86 -0.75 -0.10 0.00 0.00 174.94 174.74 1j6y s LYS 117 N -5.29 0.38 0.00 2.79 2.20 -0.71 -4.30 119.74 114.82 1j6y s LYS 117 Ca 0.65 0.88 0.00 0.00 -0.36 0.00 0.00 55.97 57.14 1j6y s LYS 117 Cb -0.14 0.52 0.00 0.00 -1.51 0.00 0.00 37.83 36.70 1j6y s LYS 117 CO 0.54 -0.21 0.00 0.54 -0.36 0.00 0.00 175.35 175.86 1j6y n ARG 118 N 5.22 0.00 0.00 4.03 1.74 -1.26 -2.26 116.66 124.13 1j6y n ARG 118 Ca -0.08 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.00 1j6y n ARG 118 Cb 0.52 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.96 1j6y n ARG 118 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 1j6y n THR 119 N -0.83 0.00 0.00 0.55 -1.04 -1.26 -4.93 114.28 106.77 1j6y n THR 119 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1j6y n THR 119 Cb 0.00 -0.60 0.00 0.00 -1.82 0.00 0.00 70.33 67.91 1j6y n THR 119 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43