#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 -3.54 0.00 -0.41 1.56 -1.26 -4.97 117.12 108.51 1j6y n MET 2 Ca 0.00 0.78 0.00 0.00 -0.27 0.00 0.00 57.70 58.21 1j6y n MET 2 Cb 0.00 -5.56 0.00 0.00 2.15 0.00 0.00 33.22 29.81 1j6y n MET 2 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1j6y n ALA 3 N -3.70 2.00 -3.75 -5.12 0.00 -1.26 -5.13 120.51 103.56 1j6y n ALA 3 Ca -0.16 -0.07 -0.10 0.00 0.00 0.00 0.00 53.44 53.12 1j6y n ALA 3 Cb 0.64 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.06 1j6y n ALA 3 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1j6y n SER 4 N -2.35 0.74 -2.23 0.00 7.64 -1.26 -5.18 113.62 110.97 1j6y n SER 4 Ca 0.00 -1.80 -0.10 0.00 1.01 0.00 0.00 58.87 57.98 1j6y n SER 4 Cb 0.00 0.43 -0.03 0.00 -1.01 0.00 0.00 64.21 63.60 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 -0.31 0.34 0.24 1.43 1.85 -1.26 -5.00 116.66 113.94 1j6y n ARG 5 Ca -0.01 -1.78 0.16 0.00 -1.00 0.00 0.00 57.85 55.22 1j6y n ARG 5 Cb 0.22 1.60 0.79 0.00 -1.05 0.00 0.00 32.46 34.02 1j6y n ARG 5 CO 0.00 0.00 0.00 -0.44 -0.01 0.00 0.00 177.63 177.18 1j6y h ASP 6 N 1.18 0.00 -2.58 2.89 3.32 -2.02 -3.48 116.42 115.73 1j6y h ASP 6 Ca -0.15 0.00 0.30 0.00 0.02 0.00 0.00 57.03 57.19 1j6y h ASP 6 Cb 0.70 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 40.17 1j6y h ASP 6 CO 0.21 0.00 -0.49 1.67 -1.72 0.00 0.00 179.24 178.91 1j6y n GLN 7 N -2.68 -2.28 -3.48 3.56 7.27 -1.26 -4.90 117.38 113.61 1j6y n GLN 7 Ca -0.01 1.57 -0.11 0.00 0.07 0.00 0.00 57.00 58.52 1j6y n GLN 7 Cb 0.14 -2.80 -0.10 0.00 2.41 0.00 0.00 30.24 29.89 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 -2.34 -0.54 0.55 1.69 0.11 0.39 -4.96 120.40 115.29 1j6y s VAL 8 Ca 0.00 0.02 -0.00 0.00 -2.93 0.00 0.00 61.98 59.07 1j6y s VAL 8 Cb 0.00 -0.71 0.03 0.00 -1.53 0.00 0.00 36.38 34.16 1j6y s VAL 8 CO 0.00 -0.06 0.78 -0.54 -3.33 0.00 0.00 175.10 171.95 1j6y s LYS 9 N 2.51 2.64 0.00 1.54 1.02 -1.26 -1.67 119.74 124.51 1j6y s LYS 9 Ca 0.07 -0.62 0.00 0.00 0.02 0.00 0.00 55.97 55.44 1j6y s LYS 9 Cb -0.14 -2.46 0.00 0.00 -0.52 0.00 0.00 37.83 34.71 1j6y s LYS 9 CO -0.14 -0.67 0.00 0.00 -0.92 0.00 0.00 175.35 173.62 1j6y n ALA 10 N -2.36 0.00 -2.37 5.17 0.00 -1.17 -4.90 120.51 114.88 1j6y n ALA 10 Ca 0.06 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.27 1j6y n ALA 10 Cb 0.59 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.98 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 4.61 -0.08 0.00 1.04 -1.15 -2.11 113.70 116.01 1j6y s SER 11 Ca 0.00 -0.99 -0.32 0.00 0.48 0.00 0.00 55.95 55.12 1j6y s SER 11 Cb 0.00 -0.48 0.13 0.00 0.10 0.00 0.00 66.02 65.77 1j6y s SER 11 CO 0.00 -0.59 1.23 -1.38 0.98 0.00 0.00 173.24 173.48 1j6y s HIS 12 N -2.57 -0.09 0.06 5.02 -3.43 -1.20 -2.49 115.29 110.59 1j6y s HIS 12 Ca 0.43 -0.00 0.03 0.00 -0.80 0.00 0.00 55.06 54.71 1j6y s HIS 12 Cb 0.02 0.54 -0.03 0.00 -1.43 0.00 0.00 32.58 31.68 1j6y s HIS 12 CO 0.24 -0.28 -0.09 0.42 -2.00 0.00 0.00 174.74 173.04 1j6y s ILE 13 N -2.47 0.67 -0.10 -5.38 1.01 -1.04 -4.82 121.20 109.06 1j6y s ILE 13 Ca 0.12 -1.25 -0.00 0.00 0.00 0.00 0.00 60.65 59.52 1j6y s ILE 13 Cb 0.02 -0.85 -0.03 0.00 0.01 0.00 0.00 42.46 41.62 1j6y s ILE 13 CO -0.04 -0.42 -0.08 -0.22 0.00 0.00 0.00 174.94 174.17 1j6y s LEU 14 N -1.82 3.05 -0.42 2.97 2.96 0.07 -1.70 118.68 123.78 1j6y s LEU 14 Ca -0.05 -0.13 0.00 0.00 -0.22 0.00 0.00 54.13 53.73 1j6y s LEU 14 Cb -0.08 -1.68 0.11 0.00 0.50 0.00 0.00 46.19 45.04 1j6y s LEU 14 CO 0.00 0.27 0.18 -0.63 -1.32 0.00 0.00 176.35 174.85 1j6y s ILE 15 N -0.27 2.88 1.10 6.68 1.01 0.18 -3.84 121.20 128.95 1j6y s ILE 15 Ca 0.03 -2.41 -0.17 0.00 0.00 0.00 0.00 60.65 58.11 1j6y s ILE 15 Cb -0.13 -3.01 0.16 0.00 0.01 0.00 0.00 42.46 39.48 1j6y s ILE 15 CO 0.03 -0.69 0.20 0.29 0.00 0.00 0.00 174.94 174.76 1j6y n LYS 16 N 4.18 -2.19 -3.06 2.79 5.02 -1.26 -3.49 118.16 120.15 1j6y n LYS 16 Ca 0.02 -0.64 0.00 0.00 -2.02 0.00 0.00 58.31 55.67 1j6y n LYS 16 Cb 0.40 -1.60 0.00 0.00 -0.02 0.00 0.00 35.03 33.82 1j6y n LYS 16 CO 0.00 0.00 0.00 -2.39 -0.52 0.00 0.00 177.40 174.49 1j6y n HIS 17 N -4.53 0.00 0.45 2.13 1.44 -1.26 -4.43 115.22 109.02 1j6y n HIS 17 Ca 0.04 0.00 0.05 0.00 -2.01 0.00 0.00 57.72 55.80 1j6y n HIS 17 Cb 0.50 0.00 0.26 0.00 0.12 0.00 0.00 29.99 30.86 1j6y n HIS 17 CO 0.00 0.00 0.00 1.04 -2.81 0.00 0.00 176.34 174.57 1j6y n GLN 18 N 0.00 0.08 0.00 -1.40 1.13 -1.24 -4.13 117.38 111.81 1j6y n GLN 18 Ca 0.00 0.25 0.00 0.00 -1.94 0.00 0.00 57.00 55.31 1j6y n GLN 18 Cb 0.00 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 28.85 1j6y n GLN 18 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1j6y n GLY 19 N -0.35 -1.31 2.69 1.08 0.00 -1.26 -4.78 105.19 101.26 1j6y n GLY 19 Ca 0.04 0.18 -0.05 0.00 0.00 0.00 0.00 46.02 46.19 1j6y n GLY 19 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1j6y n SER 20 N -0.25 -1.64 -3.66 1.61 7.64 -1.26 -5.14 113.62 110.92 1j6y n SER 20 Ca 0.00 -2.41 -0.12 0.00 1.01 0.00 0.00 58.87 57.35 1j6y n SER 20 Cb 0.00 1.32 -0.08 0.00 -1.01 0.00 0.00 64.21 64.44 1j6y n SER 20 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 1j6y s ARG 21 N 0.16 0.69 0.73 1.43 6.06 -1.26 -5.07 118.95 121.69 1j6y s ARG 21 Ca 0.23 0.90 -0.07 0.00 -2.50 0.00 0.00 55.73 54.29 1j6y s ARG 21 Cb 0.27 0.29 0.08 0.00 0.06 0.00 0.00 34.95 35.65 1j6y s ARG 21 CO -0.15 -0.10 1.04 1.03 -2.50 0.00 0.00 175.30 174.62 1j6y s ARG 22 N 0.61 2.04 0.05 5.12 0.52 -1.26 -4.66 118.95 121.37 1j6y s ARG 22 Ca -0.02 -0.31 0.01 0.00 -0.52 0.00 0.00 55.73 54.88 1j6y s ARG 22 Cb -0.05 -2.15 -0.04 0.00 0.52 0.00 0.00 34.95 33.23 1j6y s ARG 22 CO -0.03 -1.35 0.15 0.21 0.02 0.00 0.00 175.30 174.29 1j6y s LYS 23 N -5.30 3.21 0.12 3.54 2.36 -1.26 -4.91 119.74 117.49 1j6y s LYS 23 Ca 0.62 -0.51 0.00 0.00 -2.55 0.00 0.00 55.97 53.52 1j6y s LYS 23 Cb -0.10 -2.92 0.00 0.00 -1.05 0.00 0.00 37.83 33.76 1j6y s LYS 23 CO 0.45 0.61 0.00 0.00 1.55 0.00 0.00 175.35 177.96 1j6y n ALA 24 N 0.54 -2.40 -3.64 3.13 0.00 -1.26 -4.69 120.51 112.18 1j6y n ALA 24 Ca -0.08 0.30 -0.04 0.00 0.00 0.00 0.00 53.44 53.62 1j6y n ALA 24 Cb 0.52 -1.07 -0.07 0.00 0.00 0.00 0.00 19.45 18.83 1j6y n ALA 24 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1j6y s SER 25 N -0.33 -0.68 -0.44 0.00 0.15 -1.26 -4.71 113.70 106.42 1j6y s SER 25 Ca 0.00 1.10 0.05 0.00 0.70 0.00 0.00 55.95 57.80 1j6y s SER 25 Cb 0.00 1.27 0.30 0.00 -1.71 0.00 0.00 66.02 65.89 1j6y s SER 25 CO 0.00 -0.17 1.11 0.79 1.20 0.00 0.00 173.24 176.17 1j6y n TRP 26 N 3.90 -2.55 0.00 3.44 7.02 -1.25 -5.01 117.44 122.99 1j6y n TRP 26 Ca -0.19 -1.79 0.00 0.00 -1.02 0.00 0.00 57.50 54.50 1j6y n TRP 26 Cb 0.58 1.54 0.00 0.00 -2.42 0.00 0.00 31.31 31.01 1j6y n TRP 26 CO 0.00 0.00 0.00 1.63 -2.02 0.00 0.00 177.69 177.30 1j6y n LYS 27 N 0.73 0.00 -0.13 -0.99 4.76 -1.26 -3.96 118.16 117.31 1j6y n LYS 27 Ca 0.05 0.00 -0.07 0.00 -2.87 0.00 0.00 58.31 55.42 1j6y n LYS 27 Cb 0.69 0.00 -0.05 0.00 -1.84 0.00 0.00 35.03 33.83 1j6y n LYS 27 CO 0.00 0.00 0.00 -0.44 -1.37 0.00 0.00 177.40 175.59 1j6y h ASP 28 N 0.00 -1.08 -3.96 4.39 3.32 -2.04 -3.39 116.42 113.66 1j6y h ASP 28 Ca 0.00 0.15 -0.47 0.00 0.02 0.00 0.00 57.03 56.73 1j6y h ASP 28 Cb 0.00 0.46 0.00 0.00 0.22 0.00 0.00 39.33 40.01 1j6y h ASP 28 CO 0.00 -0.19 0.38 -2.16 -1.72 0.00 0.00 179.24 175.55 1j6y s PRO 29 N -4.41 4.27 0.00 3.56 0.04 -1.25 -5.02 135.00 132.18 1j6y s PRO 29 Ca -0.07 1.39 0.00 0.00 0.04 0.00 0.00 61.00 62.35 1j6y s PRO 29 Cb 0.05 -2.52 0.00 0.00 0.04 0.00 0.00 34.50 32.07 1j6y s PRO 29 CO 0.34 -0.02 0.00 0.39 0.04 0.00 0.00 177.00 177.74 1j6y n GLU 30 N -0.05 0.00 -3.77 4.56 1.02 -1.26 -3.75 120.64 117.39 1j6y n GLU 30 Ca 0.05 0.00 -0.03 0.00 -0.02 0.00 0.00 57.16 57.16 1j6y n GLU 30 Cb 0.51 -0.09 -0.01 0.00 -0.02 0.00 0.00 31.44 31.83 1j6y n GLU 30 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1j6y s GLY 31 N -1.31 -0.19 0.18 0.62 0.00 -1.26 -4.77 107.32 100.60 1j6y s GLY 31 Ca 0.00 0.07 -0.13 0.00 0.00 0.00 0.00 44.72 44.66 1j6y s GLY 31 CO 0.00 0.25 0.64 0.58 0.00 0.00 0.00 173.10 174.57 1j6y n LYS 32 N -0.50 0.57 0.00 2.90 0.00 -1.26 -5.10 118.16 114.77 1j6y n LYS 32 Ca -0.06 -1.20 0.00 0.00 -0.00 0.00 0.00 58.31 57.05 1j6y n LYS 32 Cb 0.61 1.56 0.00 0.00 -0.00 0.00 0.00 35.03 37.20 1j6y n LYS 32 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.40 176.51 1j6y n ILE 33 N -0.44 0.00 -2.62 0.58 2.08 -1.26 -4.67 119.36 113.03 1j6y n ILE 33 Ca -0.03 0.45 -0.02 0.00 0.56 0.00 0.00 62.75 63.70 1j6y n ILE 33 Cb 0.40 -1.06 -0.02 0.00 -0.75 0.00 0.00 39.64 38.21 1j6y n ILE 33 CO 0.00 0.00 0.00 -0.38 0.56 0.00 0.00 176.55 176.73 1j6y n ILE 34 N -0.24 -7.89 -1.50 1.39 5.41 -1.26 -4.72 119.36 110.56 1j6y n ILE 34 Ca 0.00 1.70 -0.48 0.00 1.00 0.00 0.00 62.75 64.97 1j6y n ILE 34 Cb 0.00 -4.64 -0.03 0.00 -0.71 0.00 0.00 39.64 34.26 1j6y n ILE 34 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 1j6y n LEU 35 N 2.03 0.25 0.00 1.39 7.99 -1.26 -4.83 117.00 122.57 1j6y n LEU 35 Ca -0.17 1.15 0.00 0.00 -0.01 0.00 0.00 56.01 56.98 1j6y n LEU 35 Cb 0.27 -1.10 0.00 0.00 -0.11 0.00 0.00 43.42 42.48 1j6y n LEU 35 CO 0.16 -2.14 0.00 0.35 -1.51 0.00 0.00 177.39 174.25 1j6y n THR 36 N 0.40 0.00 0.22 -5.08 -2.24 -1.26 -4.99 114.28 101.33 1j6y n THR 36 Ca 0.15 0.00 0.07 0.00 -2.27 0.00 0.00 64.05 62.00 1j6y n THR 36 Cb 0.26 -0.92 0.24 0.00 -2.10 0.00 0.00 70.33 67.81 1j6y n THR 36 CO 0.00 0.00 0.00 1.07 -0.57 0.00 0.00 175.07 175.57 1j6y n THR 37 N -0.46 0.99 -0.93 4.28 5.66 -1.26 -4.96 114.28 117.59 1j6y n THR 37 Ca 0.00 -0.74 0.08 0.00 -3.05 0.00 0.00 64.05 60.34 1j6y n THR 37 Cb 0.00 0.16 -0.03 0.00 -1.55 0.00 0.00 70.33 68.91 1j6y n THR 37 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 1j6y n THR 38 N 0.83 0.00 -0.05 1.09 -2.24 -1.26 -0.68 114.28 111.97 1j6y n THR 38 Ca 0.17 0.22 -0.18 0.00 -2.27 0.00 0.00 64.05 61.99 1j6y n THR 38 Cb 0.55 -0.44 -0.13 0.00 -2.10 0.00 0.00 70.33 68.21 1j6y n THR 38 CO 0.00 0.00 0.00 0.08 -0.57 0.00 0.00 175.07 174.58 1j6y h ARG 39 N -1.18 0.08 -0.37 -0.78 0.11 -1.90 0.04 114.38 110.37 1j6y h ARG 39 Ca -0.04 -0.13 -0.04 0.00 0.10 0.00 0.00 59.98 59.87 1j6y h ARG 39 Cb 1.17 0.05 -0.01 0.00 1.11 0.00 0.00 29.97 32.29 1j6y h ARG 39 CO 0.02 1.06 0.07 1.49 0.10 0.00 0.00 179.97 182.71 1j6y h GLU 40 N -0.81 0.62 0.00 0.08 4.81 -2.01 -1.69 114.58 115.58 1j6y h GLU 40 Ca -0.17 -0.16 -0.06 0.00 -0.13 0.00 0.00 59.36 58.84 1j6y h GLU 40 Cb 1.29 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.59 1j6y h GLU 40 CO -0.03 0.67 -0.26 0.00 -0.73 0.00 0.00 179.01 178.66 1j6y h ALA 41 N 0.92 1.21 0.62 2.92 0.00 -1.70 -2.96 119.26 120.26 1j6y h ALA 41 Ca 0.11 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 1j6y h ALA 41 Cb 0.35 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.11 1j6y h ALA 41 CO 0.01 0.33 -0.30 0.00 0.00 0.00 0.00 179.25 179.29 1j6y h ALA 42 N 1.74 -1.02 -1.07 0.00 0.00 0.12 -1.87 119.26 117.15 1j6y h ALA 42 Ca -0.00 -0.18 0.28 0.00 0.00 0.00 0.00 54.91 55.01 1j6y h ALA 42 Cb 0.61 0.32 -0.09 0.00 0.00 0.00 0.00 17.79 18.63 1j6y h ALA 42 CO 0.03 -0.96 0.70 0.28 0.00 0.00 0.00 179.25 179.30 1j6y h VAL 43 N -0.98 0.49 0.44 0.00 2.07 -1.42 0.17 116.25 117.02 1j6y h VAL 43 Ca -0.08 -0.11 -0.02 0.00 0.82 0.00 0.00 66.70 67.31 1j6y h VAL 43 Cb 0.64 0.14 -0.00 0.00 -1.52 0.00 0.00 31.29 30.55 1j6y h VAL 43 CO 0.14 0.06 -0.24 -0.33 0.02 0.00 0.00 177.57 177.22 1j6y h GLU 44 N 0.32 -0.60 -0.90 1.57 4.39 -1.32 0.48 114.58 118.53 1j6y h GLU 44 Ca 0.60 0.04 0.21 0.00 0.34 0.00 0.00 59.36 60.54 1j6y h GLU 44 Cb 1.65 0.14 -0.07 0.00 -0.10 0.00 0.00 28.75 30.37 1j6y h GLU 44 CO -0.26 -0.40 0.60 0.37 -1.16 0.00 0.00 179.01 178.16 1j6y h GLN 45 N -0.63 0.38 -0.25 2.33 4.15 0.12 0.47 115.11 121.68 1j6y h GLN 45 Ca -0.05 -0.02 -0.16 0.00 0.77 0.00 0.00 58.65 59.19 1j6y h GLN 45 Cb 0.50 -0.08 -0.01 0.00 0.21 0.00 0.00 27.48 28.10 1j6y h GLN 45 CO 0.07 0.25 -0.49 1.25 -1.93 0.00 0.00 178.83 177.99 1j6y h LEU 46 N 0.39 0.73 0.31 -2.39 7.12 0.16 -1.94 115.31 119.67 1j6y h LEU 46 Ca 0.47 -0.37 -0.01 0.00 0.13 0.00 0.00 57.88 58.10 1j6y h LEU 46 Cb 1.19 -0.21 -0.02 0.00 -0.53 0.00 0.00 40.66 41.10 1j6y h LEU 46 CO -0.17 1.10 -0.33 0.50 -0.13 0.00 0.00 178.44 179.41 1j6y h LYS 47 N 0.53 -0.61 -0.44 1.25 1.63 0.47 -1.31 116.57 118.09 1j6y h LYS 47 Ca 0.03 0.04 0.10 0.00 -0.85 0.00 0.00 60.65 59.97 1j6y h LYS 47 Cb 1.04 0.14 -0.02 0.00 -0.60 0.00 0.00 32.23 32.79 1j6y h LYS 47 CO 0.10 -0.41 0.31 0.77 -3.45 0.00 0.00 179.45 176.77 1j6y h SER 48 N -0.64 0.14 0.00 4.20 0.02 -1.52 -2.67 113.55 113.08 1j6y h SER 48 Ca -0.04 0.00 0.01 0.00 -0.84 0.00 0.00 61.79 60.93 1j6y h SER 48 Cb 0.56 -0.03 -0.04 0.00 0.14 0.00 0.00 62.40 63.03 1j6y h SER 48 CO -0.05 0.08 -0.36 0.40 -1.14 0.00 0.00 176.83 175.76 1j6y h ILE 49 N 0.15 0.00 -0.83 3.27 1.08 -0.42 2.29 117.51 123.05 1j6y h ILE 49 Ca 0.21 0.00 0.21 0.00 -0.39 0.00 0.00 64.86 64.88 1j6y h ILE 49 Cb 0.62 0.00 -0.14 0.00 -3.07 0.00 0.00 36.82 34.23 1j6y h ILE 49 CO -0.03 0.00 0.13 -0.09 -0.69 0.00 0.00 178.15 177.47 1j6y h ARG 50 N -0.46 0.16 0.78 2.37 2.43 -1.15 1.68 114.38 120.18 1j6y h ARG 50 Ca 0.01 -0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.13 1j6y h ARG 50 Cb 0.49 -0.04 0.01 0.00 -0.42 0.00 0.00 29.97 30.01 1j6y h ARG 50 CO -0.24 0.10 -0.37 1.49 -1.51 0.00 0.00 179.97 179.44 1j6y h GLU 51 N 0.16 -1.00 -0.49 0.20 4.57 -0.94 0.57 114.58 117.65 1j6y h GLU 51 Ca 0.49 0.07 0.10 0.00 -1.18 0.00 0.00 59.36 58.84 1j6y h GLU 51 Cb 0.94 0.23 -0.10 0.00 -0.16 0.00 0.00 28.75 29.66 1j6y h GLU 51 CO -0.67 -0.67 -0.27 -0.44 -1.18 0.00 0.00 179.01 175.78 1j6y h ASP 52 N -1.22 -0.93 -0.26 1.04 5.19 0.54 2.65 116.42 123.43 1j6y h ASP 52 Ca -0.11 0.19 0.07 0.00 -0.62 0.00 0.00 57.03 56.57 1j6y h ASP 52 Cb 0.80 0.47 -0.01 0.00 0.18 0.00 0.00 39.33 40.77 1j6y h ASP 52 CO 0.18 -0.28 0.22 0.40 -3.12 0.00 0.00 179.24 176.63 1j6y h ILE 53 N -0.16 0.66 0.02 0.35 1.08 0.26 -2.85 117.51 116.87 1j6y h ILE 53 Ca 0.22 0.00 -0.00 0.00 -0.39 0.00 0.00 64.86 64.69 1j6y h ILE 53 Cb 0.51 0.84 0.00 0.00 -3.07 0.00 0.00 36.82 35.10 1j6y h ILE 53 CO -0.58 0.00 -0.01 0.58 -0.69 0.00 0.00 178.15 177.45 1j6y h VAL 54 N 0.00 0.00 -2.84 1.67 2.07 0.94 -3.46 116.25 114.63 1j6y h VAL 54 Ca 0.12 -0.27 -0.64 0.00 0.82 0.00 0.00 66.70 66.74 1j6y h VAL 54 Cb 0.56 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 30.27 1j6y h VAL 54 CO -0.00 0.00 -0.38 -0.44 0.02 0.00 0.00 177.57 176.77 1j6y s SER 55 N -3.65 6.53 0.00 0.57 0.01 0.55 -4.91 113.70 112.80 1j6y s SER 55 Ca -0.00 0.62 0.00 0.00 1.31 0.00 0.00 55.95 57.88 1j6y s SER 55 Cb 0.00 -2.12 0.00 0.00 0.21 0.00 0.00 66.02 64.11 1j6y s SER 55 CO 0.01 0.32 0.00 0.61 0.41 0.00 0.00 173.24 174.59 1j6y n GLY 56 N 1.56 1.05 2.21 3.44 0.00 -1.26 -4.24 105.19 107.96 1j6y n GLY 56 Ca -0.15 -1.09 -0.11 0.00 0.00 0.00 0.00 46.02 44.68 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 2.94 1.52 0.05 1.61 4.81 -1.26 -4.37 118.16 123.46 1j6y n LYS 57 Ca 0.00 -0.82 0.10 0.00 -0.87 0.00 0.00 58.31 56.72 1j6y n LYS 57 Cb 0.00 -1.94 0.42 0.00 0.02 0.00 0.00 35.03 33.53 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 2.86 1.81 -0.24 3.14 0.00 -1.26 -4.98 120.51 121.84 1j6y n ALA 58 Ca 0.33 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.76 1j6y n ALA 58 Cb 0.56 -1.34 0.00 0.00 0.00 0.00 0.00 19.45 18.67 1j6y n ALA 58 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1j6y n ASN 59 N -1.82 0.00 0.00 0.00 2.85 -1.26 -4.83 115.26 110.20 1j6y n ASN 59 Ca 0.04 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.51 1j6y n ASN 59 Cb 0.24 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.26 1j6y n ASN 59 CO 0.00 0.00 0.00 0.33 -2.11 0.00 0.00 177.26 175.48 1j6y n PHE 60 N 12.47 0.00 0.00 1.20 -0.00 -1.26 -4.95 117.46 124.92 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 -0.10 0.00 -0.50 -4.13 1.02 -1.26 -0.99 120.64 114.68 1j6y n GLU 61 Ca 0.00 0.04 0.41 0.00 -0.02 0.00 0.00 57.16 57.59 1j6y n GLU 61 Cb 0.00 -0.67 0.70 0.00 -0.02 0.00 0.00 31.44 31.44 1j6y n GLU 61 CO 0.00 0.00 0.00 1.05 1.18 0.00 0.00 177.13 179.36 1j6y h GLU 62 N 0.00 0.02 -0.69 3.49 4.11 -1.94 2.10 114.58 121.67 1j6y h GLU 62 Ca 0.00 -0.00 0.01 0.00 0.07 0.00 0.00 59.36 59.43 1j6y h GLU 62 Cb 0.00 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.21 1j6y h GLU 62 CO 0.00 0.02 0.45 0.28 0.07 0.00 0.00 179.01 179.83 1j6y h VAL 63 N 0.02 1.18 0.31 -1.06 2.07 -1.84 -1.19 116.25 115.74 1j6y h VAL 63 Ca 0.88 -0.34 -0.02 0.00 0.82 0.00 0.00 66.70 68.04 1j6y h VAL 63 Cb 2.92 0.17 0.00 0.00 -1.52 0.00 0.00 31.29 32.86 1j6y h VAL 63 CO -0.38 0.18 -0.15 0.00 0.02 0.00 0.00 177.57 177.23 1j6y h ALA 64 N 1.56 -0.41 -1.31 1.67 0.00 0.52 -0.69 119.26 120.59 1j6y h ALA 64 Ca 0.25 -0.13 0.38 0.00 0.00 0.00 0.00 54.91 55.41 1j6y h ALA 64 Cb -0.10 0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.80 1j6y h ALA 64 CO -0.05 -0.40 1.07 1.79 0.00 0.00 0.00 179.25 181.65 1j6y h THR 65 N -1.07 0.19 0.00 0.00 1.35 -1.30 0.17 112.91 112.25 1j6y h THR 65 Ca -0.04 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.82 1j6y h THR 65 Cb 0.40 0.22 0.00 0.00 -1.73 0.00 0.00 68.15 67.04 1j6y h THR 65 CO 0.07 0.00 0.00 -1.14 -0.25 0.00 0.00 175.52 174.20 1j6y n ARG 66 N -3.84 0.00 -2.28 4.72 0.63 -0.46 -4.37 116.66 111.05 1j6y n ARG 66 Ca 0.29 0.43 -0.41 0.00 -0.92 0.00 0.00 57.85 57.25 1j6y n ARG 66 Cb 1.48 -0.93 0.01 0.00 0.45 0.00 0.00 32.46 33.46 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 -2.06 5.51 -3.83 5.15 3.14 -0.28 -4.96 118.33 121.01 1j6y n VAL 67 Ca 0.00 -4.99 -0.24 0.00 -2.96 0.00 0.00 64.34 56.16 1j6y n VAL 67 Cb 0.00 -1.90 0.00 0.00 -1.06 0.00 0.00 33.84 30.88 1j6y n VAL 67 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 1j6y n SER 68 N 1.19 2.58 -3.57 6.55 3.41 0.54 -0.75 113.62 123.57 1j6y n SER 68 Ca 0.54 -2.71 -0.41 0.00 -0.26 0.00 0.00 58.87 56.03 1j6y n SER 68 Cb 0.26 -0.05 -0.01 0.00 -0.26 0.00 0.00 64.21 64.15 1j6y n SER 68 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1j6y n ASP 69 N -1.86 6.52 0.00 4.04 2.03 -1.26 -4.37 116.55 121.64 1j6y n ASP 69 Ca -0.01 -2.88 0.00 0.00 0.52 0.00 0.00 54.79 52.42 1j6y n ASP 69 Cb 0.57 -1.53 0.00 0.00 -0.72 0.00 0.00 41.12 39.44 1j6y n ASP 69 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1j6y h SER 71 N 0.00 0.07 -0.74 0.00 0.87 -1.99 2.26 113.55 114.02 1j6y h SER 71 Ca 0.00 0.18 0.11 0.00 -1.23 0.00 0.00 61.79 60.86 1j6y h SER 71 Cb 0.00 0.23 -0.05 0.00 -0.44 0.00 0.00 62.40 62.14 1j6y h SER 71 CO 0.00 -0.11 0.49 0.28 -0.53 0.00 0.00 176.83 176.96 1j6y h SER 72 N 0.25 0.52 -0.99 6.23 0.02 -1.52 0.96 113.55 119.02 1j6y h SER 72 Ca 0.54 0.02 0.27 0.00 -0.84 0.00 0.00 61.79 61.78 1j6y h SER 72 Cb 1.07 -0.09 -0.06 0.00 0.14 0.00 0.00 62.40 63.46 1j6y h SER 72 CO -0.61 0.30 0.69 0.00 -1.14 0.00 0.00 176.83 176.06 1j6y h ALA 73 N 1.64 2.66 0.04 3.77 0.00 0.36 2.90 119.26 130.63 1j6y h ALA 73 Ca 0.35 -0.00 -0.24 0.00 0.00 0.00 0.00 54.91 55.01 1j6y h ALA 73 Cb 0.59 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 1j6y h ALA 73 CO -0.12 -0.97 -1.18 -0.22 0.00 0.00 0.00 179.25 176.75 1j6y h LYS 74 N 0.16 0.08 -2.24 0.00 3.64 0.10 -3.36 116.57 114.95 1j6y h LYS 74 Ca 0.50 -0.14 -0.58 0.00 -1.27 0.00 0.00 60.65 59.17 1j6y h LYS 74 Cb 1.69 0.05 -0.42 0.00 -0.41 0.00 0.00 32.23 33.15 1j6y h LYS 74 CO -0.10 1.00 -0.72 -2.13 -2.27 0.00 0.00 179.45 175.23 1j6y n ARG 75 N -3.36 2.85 0.01 1.90 0.63 0.73 -4.86 116.66 114.56 1j6y n ARG 75 Ca -0.05 -4.63 0.06 0.00 -0.92 0.00 0.00 57.85 52.31 1j6y n ARG 75 Cb 0.98 -2.15 0.25 0.00 0.45 0.00 0.00 32.46 31.99 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 -0.07 -0.89 0.00 5.14 0.00 0.80 -4.17 105.19 106.00 1j6y n GLY 76 Ca 0.30 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.30 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 -0.42 -0.75 3.30 -0.02 0.00 -1.26 -4.60 105.19 101.45 1j6y n GLY 77 Ca 0.02 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.91 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 -1.67 -0.37 0.58 1.61 -4.77 -1.26 -3.25 116.67 107.55 1j6y s ASP 78 Ca 0.00 0.57 0.33 0.00 -3.30 0.00 0.00 52.55 50.14 1j6y s ASP 78 Cb 0.00 0.64 1.37 0.00 -1.09 0.00 0.00 42.92 43.84 1j6y s ASP 78 CO 0.00 -0.28 1.66 0.17 0.70 0.00 0.00 175.17 177.42 1j6y h LEU 79 N 4.74 0.00 0.00 2.11 8.10 -1.73 -3.45 115.31 125.08 1j6y h LEU 79 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.71 1j6y h LEU 79 Cb 1.18 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 41.40 1j6y h LEU 79 CO 0.31 0.00 0.00 0.61 -4.11 0.00 0.00 178.44 175.25 1j6y n GLY 80 N -1.69 1.96 3.30 0.17 0.00 -1.24 -4.93 105.19 102.77 1j6y n GLY 80 Ca 0.21 -0.60 -0.10 0.00 0.00 0.00 0.00 46.02 45.53 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 -3.13 -0.19 0.00 1.61 1.04 -1.26 -3.04 113.70 108.72 1j6y s SER 81 Ca 0.00 -0.32 0.00 0.00 0.48 0.00 0.00 55.95 56.11 1j6y s SER 81 Cb 0.00 0.45 0.00 0.00 0.10 0.00 0.00 66.02 66.57 1j6y s SER 81 CO 0.00 -0.81 0.00 2.22 0.98 0.00 0.00 173.24 175.63 1j6y n PHE 82 N -0.11 0.00 0.00 5.02 -1.74 -0.67 -4.93 117.46 115.03 1j6y n PHE 82 Ca -0.16 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.73 1j6y n PHE 82 Cb 0.63 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.63 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 2.46 2.74 4.97 0.00 -1.26 -0.46 105.19 113.64 1j6y n GLY 83 Ca 0.00 -0.04 -0.03 0.00 0.00 0.00 0.00 46.02 45.95 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 -3.57 0.00 1.61 3.00 -1.26 -4.64 116.66 111.80 1j6y n ARG 84 Ca 0.00 2.80 0.00 0.00 -0.01 0.00 0.00 57.85 60.64 1j6y n ARG 84 Cb 0.00 -4.33 0.00 0.00 0.00 0.00 0.00 32.46 28.13 1j6y n ARG 84 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1j6y n GLY 85 N 1.50 0.81 0.00 -0.13 0.00 -1.26 -4.99 105.19 101.12 1j6y n GLY 85 Ca -0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.80 1j6y n GLY 85 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1j6y n GLN 86 N 0.00 0.00 -3.00 1.61 1.13 -1.26 -4.98 117.38 110.88 1j6y n GLN 86 Ca 0.00 0.00 -0.32 0.00 -1.94 0.00 0.00 57.00 54.74 1j6y n GLN 86 Cb 0.00 -0.17 -0.06 0.00 0.11 0.00 0.00 30.24 30.12 1j6y n GLN 86 CO 0.00 0.00 0.00 -1.64 -1.44 0.00 0.00 177.06 173.98 1j6y s MET 87 N 0.00 4.04 0.00 -1.09 -1.94 -1.26 -5.07 119.30 113.98 1j6y s MET 87 Ca 0.00 0.78 0.00 0.00 -1.71 0.00 0.00 55.69 54.76 1j6y s MET 87 Cb 0.00 -2.35 0.00 0.00 2.01 0.00 0.00 34.83 34.49 1j6y s MET 87 CO 0.00 0.07 0.00 0.94 -0.01 0.00 0.00 175.02 176.02 1j6y n GLN 88 N -0.58 1.46 -0.05 2.03 7.27 -1.26 -4.63 117.38 121.62 1j6y n GLN 88 Ca 0.04 0.00 -0.12 0.00 0.07 0.00 0.00 57.00 57.00 1j6y n GLN 88 Cb 0.53 0.00 -0.10 0.00 2.41 0.00 0.00 30.24 33.08 1j6y n GLN 88 CO 0.00 0.00 0.00 0.87 0.07 0.00 0.00 177.06 178.00 1j6y h LYS 89 N 0.00 -0.02 0.06 3.69 6.56 -2.00 -3.24 116.57 121.62 1j6y h LYS 89 Ca 0.00 0.00 -0.00 0.00 -1.06 0.00 0.00 60.65 59.59 1j6y h LYS 89 Cb 0.00 0.01 0.00 0.00 -0.57 0.00 0.00 32.23 31.67 1j6y h LYS 89 CO 0.00 0.72 -0.03 -1.00 -2.06 0.00 0.00 179.45 177.08 1j6y h PRO 90 N -0.93 -0.08 0.25 3.15 0.13 -1.98 -2.12 132.00 130.42 1j6y h PRO 90 Ca -0.00 0.01 0.01 0.00 -0.87 0.00 0.00 66.00 65.14 1j6y h PRO 90 Cb 0.76 0.02 -0.04 0.00 0.13 0.00 0.00 31.00 31.87 1j6y h PRO 90 CO 0.00 -0.00 -0.46 0.35 -0.23 0.00 0.00 178.00 177.66 1j6y h PHE 91 N -0.14 -1.30 -0.61 1.56 3.04 -1.91 -0.46 116.94 117.11 1j6y h PHE 91 Ca -0.01 0.02 0.08 0.00 3.98 0.00 0.00 57.97 62.05 1j6y h PHE 91 Cb 0.11 0.54 -0.10 0.00 2.56 0.00 0.00 35.95 39.05 1j6y h PHE 91 CO -0.06 -0.58 -0.49 1.49 -2.02 0.00 0.00 178.31 176.66 1j6y h GLU 92 N -0.78 -0.22 -0.12 1.11 4.22 -1.57 2.52 114.58 119.73 1j6y h GLU 92 Ca -0.01 0.02 0.04 0.00 0.08 0.00 0.00 59.36 59.48 1j6y h GLU 92 Cb 0.75 0.05 -0.00 0.00 0.50 0.00 0.00 28.75 30.05 1j6y h GLU 92 CO -0.19 -0.15 0.36 1.49 -2.18 0.00 0.00 179.01 178.35 1j6y h GLU 93 N -0.23 0.00 0.17 1.92 4.81 -0.90 0.48 114.58 120.82 1j6y h GLU 93 Ca 0.16 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.38 1j6y h GLU 93 Cb 0.55 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.93 1j6y h GLU 93 CO -0.71 0.00 -0.08 0.00 -0.73 0.00 0.00 179.01 177.48 1j6y h ALA 94 N 1.39 -0.23 0.00 2.92 0.00 0.60 -0.31 119.26 123.63 1j6y h ALA 94 Ca 0.06 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 54.70 1j6y h ALA 94 Cb 0.78 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 1j6y h ALA 94 CO -0.00 -0.26 -0.40 1.15 0.00 0.00 0.00 179.25 179.75 1j6y h THR 95 N -0.97 1.27 0.00 0.00 2.02 -0.00 -0.14 112.91 115.09 1j6y h THR 95 Ca -0.02 -1.37 -0.08 0.00 0.77 0.00 0.00 66.41 65.71 1j6y h THR 95 Cb 0.44 1.74 -0.01 0.00 -1.74 0.00 0.00 68.15 68.58 1j6y h THR 95 CO 0.04 0.39 -0.37 1.88 0.37 0.00 0.00 175.52 177.83 1j6y h TYR 96 N 0.00 0.00 0.01 3.16 0.05 -0.16 -3.21 116.97 116.82 1j6y h TYR 96 Ca -0.00 0.00 -0.28 0.00 0.05 0.00 0.00 58.73 58.50 1j6y h TYR 96 Cb 0.71 0.00 -0.04 0.00 1.01 0.00 0.00 36.73 38.41 1j6y h TYR 96 CO 0.00 0.37 -1.56 0.00 -1.05 0.00 0.00 178.16 175.92 1j6y h ALA 97 N 1.63 0.66 -2.72 3.88 0.00 -0.38 -3.46 119.26 118.87 1j6y h ALA 97 Ca -0.00 -1.34 -0.54 0.00 0.00 0.00 0.00 54.91 53.03 1j6y h ALA 97 Cb 1.10 0.35 -0.03 0.00 0.00 0.00 0.00 17.79 19.21 1j6y h ALA 97 CO 0.05 1.50 0.14 -1.17 0.00 0.00 0.00 179.25 179.76 1j6y s LEU 98 N -6.27 4.56 0.00 0.00 0.20 -0.13 -5.01 118.68 112.04 1j6y s LEU 98 Ca -0.04 1.55 0.00 0.00 0.69 0.00 0.00 54.13 56.33 1j6y s LEU 98 Cb 0.08 -3.21 0.00 0.00 -0.43 0.00 0.00 46.19 42.63 1j6y s LEU 98 CO 0.82 0.20 0.00 0.29 -0.29 0.00 0.00 176.35 177.37 1j6y n LYS 99 N 1.77 0.00 -3.04 1.98 5.02 -1.26 -4.88 118.16 117.76 1j6y n LYS 99 Ca -0.06 0.00 -0.01 0.00 -2.02 0.00 0.00 58.31 56.22 1j6y n LYS 99 Cb 0.49 0.00 -0.00 0.00 -0.02 0.00 0.00 35.03 35.50 1j6y n LYS 99 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1j6y s VAL 100 N 0.00 -1.00 0.00 -0.18 1.01 -1.26 -4.29 120.40 114.68 1j6y s VAL 100 Ca 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 61.98 61.59 1j6y s VAL 100 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36.38 36.38 1j6y s VAL 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 175.10 175.71 1j6y n GLY 101 N 3.85 0.00 0.00 4.51 0.00 -1.26 -4.58 105.19 107.71 1j6y n GLY 101 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 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 0.00 0.00 -0.66 1.61 9.92 -1.26 -5.00 116.55 121.15 1j6y n ASP 102 Ca 0.00 0.00 -0.09 0.00 -0.53 0.00 0.00 54.79 54.17 1j6y n ASP 102 Cb 0.00 0.00 -0.04 0.00 -0.64 0.00 0.00 41.12 40.44 1j6y n ASP 102 CO 0.00 0.00 0.00 -0.38 0.13 0.00 0.00 177.20 176.95 1j6y n ILE 103 N -0.92 0.00 -2.69 0.53 5.41 -1.26 -3.93 119.36 116.51 1j6y n ILE 103 Ca 0.00 0.00 -0.03 0.00 1.00 0.00 0.00 62.75 63.72 1j6y n ILE 103 Cb 0.00 -1.38 -0.03 0.00 -0.71 0.00 0.00 39.64 37.52 1j6y n ILE 103 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 1j6y n SER 104 N -1.09 -3.84 0.00 4.38 2.88 -0.84 -3.63 113.62 111.48 1j6y n SER 104 Ca -0.09 1.34 0.00 0.00 -1.33 0.00 0.00 58.87 58.79 1j6y n SER 104 Cb 0.56 -5.01 0.00 0.00 -0.75 0.00 0.00 64.21 59.01 1j6y n SER 104 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1j6y n ASP 105 N 1.36 0.00 -4.16 -3.46 5.68 -1.25 -4.43 116.55 110.29 1j6y n ASP 105 Ca -0.23 0.52 -0.26 0.00 -0.50 0.00 0.00 54.79 54.32 1j6y n ASP 105 Cb 0.38 -0.02 -0.16 0.00 -1.14 0.00 0.00 41.12 40.18 1j6y n ASP 105 CO 0.00 0.00 0.00 -0.63 -1.33 0.00 0.00 177.20 175.24 1j6y s ILE 106 N -1.08 1.43 -0.56 2.12 1.01 -1.26 -4.68 121.20 118.18 1j6y s ILE 106 Ca 0.00 -0.75 0.05 0.00 0.00 0.00 0.00 60.65 59.94 1j6y s ILE 106 Cb 0.00 -1.20 0.17 0.00 0.01 0.00 0.00 42.46 41.44 1j6y s ILE 106 CO 0.00 0.41 0.43 0.52 0.00 0.00 0.00 174.94 176.30 1j6y n VAL 107 N 2.80 0.24 -2.74 2.92 0.31 -0.94 -5.00 118.33 115.94 1j6y n VAL 107 Ca -0.16 -4.17 -0.43 0.00 -0.01 0.00 0.00 64.34 59.57 1j6y n VAL 107 Cb 0.53 -1.93 -0.03 0.00 -0.91 0.00 0.00 33.84 31.51 1j6y n VAL 107 CO 0.00 0.00 0.00 1.51 -1.32 0.00 0.00 176.83 177.02 1j6y s ASP 108 N -0.78 6.54 0.00 4.52 -4.77 -1.26 0.76 116.67 121.68 1j6y s ASP 108 Ca 0.30 0.22 0.00 0.00 -3.30 0.00 0.00 52.55 49.76 1j6y s ASP 108 Cb 0.01 -2.49 0.00 0.00 -1.09 0.00 0.00 42.92 39.35 1j6y s ASP 108 CO -0.18 -1.14 0.00 0.35 0.70 0.00 0.00 175.17 174.90 1j6y n THR 109 N 6.58 0.00 -0.94 2.11 -2.24 0.23 -4.94 114.28 115.08 1j6y n THR 109 Ca 0.08 0.00 -0.36 0.00 -2.27 0.00 0.00 64.05 61.50 1j6y n THR 109 Cb 0.49 0.00 0.06 0.00 -2.10 0.00 0.00 70.33 68.78 1j6y n THR 109 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1j6y n ASP 110 N -1.07 -4.56 0.00 3.42 5.68 -1.26 -1.51 116.55 117.25 1j6y n ASP 110 Ca 0.00 0.16 0.00 0.00 -0.50 0.00 0.00 54.79 54.45 1j6y n ASP 110 Cb 0.00 -0.82 0.00 0.00 -1.14 0.00 0.00 41.12 39.16 1j6y n ASP 110 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1j6y n SER 111 N 2.23 0.00 0.00 -1.12 7.64 -1.26 -4.64 113.62 116.47 1j6y n SER 111 Ca -0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1j6y n SER 111 Cb 0.59 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.79 1j6y n SER 111 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1j6y n GLY 112 N 0.00 -0.80 3.48 0.23 0.00 -0.57 -4.62 105.19 102.91 1j6y n GLY 112 Ca 0.00 -0.11 -0.33 0.00 0.00 0.00 0.00 46.02 45.57 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 -3.64 3.62 0.04 1.61 -7.23 -1.23 0.75 120.40 114.33 1j6y s VAL 113 Ca 0.00 -0.47 0.00 0.00 -1.81 0.00 0.00 61.98 59.70 1j6y s VAL 113 Cb 0.00 -2.55 -0.00 0.00 0.56 0.00 0.00 36.38 34.39 1j6y s VAL 113 CO 0.00 0.52 0.00 1.41 -0.31 0.00 0.00 175.10 176.72 1j6y n HIS 114 N 3.27 0.08 -3.41 2.82 -0.00 0.23 0.51 115.22 118.73 1j6y n HIS 114 Ca -0.18 -0.19 -0.13 0.00 -0.00 0.00 0.00 57.72 57.22 1j6y n HIS 114 Cb 0.53 -0.02 -0.10 0.00 -0.00 0.00 0.00 29.99 30.39 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 -1.19 -0.49 0.17 1.59 -4.36 -0.69 -2.20 121.20 114.03 1j6y s ILE 115 Ca 0.00 -0.09 -0.01 0.00 -0.26 0.00 0.00 60.65 60.29 1j6y s ILE 115 Cb 0.00 -0.76 -0.04 0.00 1.25 0.00 0.00 42.46 42.91 1j6y s ILE 115 CO 0.00 -0.16 0.36 -0.63 0.24 0.00 0.00 174.94 174.75 1j6y s ILE 116 N 2.45 5.23 -0.23 8.37 1.01 -1.24 -2.51 121.20 134.29 1j6y s ILE 116 Ca 0.10 -0.35 -0.10 0.00 0.00 0.00 0.00 60.65 60.30 1j6y s ILE 116 Cb -0.16 -3.71 0.09 0.00 0.01 0.00 0.00 42.46 38.70 1j6y s ILE 116 CO -0.15 -0.11 0.52 -1.59 0.00 0.00 0.00 174.94 173.62 1j6y s LYS 117 N -3.15 0.47 0.00 2.79 -2.85 -1.04 -1.98 119.74 113.98 1j6y s LYS 117 Ca 0.38 1.12 0.00 0.00 -1.00 0.00 0.00 55.97 56.47 1j6y s LYS 117 Cb -0.11 0.36 0.00 0.00 -2.06 0.00 0.00 37.83 36.02 1j6y s LYS 117 CO 0.28 -0.20 0.00 -2.13 0.10 0.00 0.00 175.35 173.40 1j6y n ARG 118 N 4.99 0.00 0.00 1.78 3.00 -1.26 -2.93 116.66 122.24 1j6y n ARG 118 Ca -0.14 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.71 1j6y n ARG 118 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.98 1j6y n ARG 118 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.63 180.04 1j6y n THR 119 N 0.00 0.00 -0.67 5.15 -1.04 -1.26 -4.84 114.28 111.61 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 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1j6y n THR 119 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43