#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j6y s MET 2 N 0.00 4.39 -0.24 -1.40 0.00 -1.26 -5.03 119.30 115.76 1j6y s MET 2 Ca 0.00 0.89 -0.07 0.00 0.00 0.00 0.00 55.69 56.52 1j6y s MET 2 Cb 0.00 -3.49 0.12 0.00 0.00 0.00 0.00 34.83 31.46 1j6y s MET 2 CO 0.00 -0.05 0.49 0.00 0.00 0.00 0.00 175.02 175.45 1j6y s ALA 3 N 1.21 -1.47 0.00 3.16 0.00 -1.26 -5.03 121.76 118.38 1j6y s ALA 3 Ca 0.37 1.66 0.00 0.00 0.00 0.00 0.00 51.96 53.99 1j6y s ALA 3 Cb -0.17 -1.56 0.00 0.00 0.00 0.00 0.00 23.12 21.38 1j6y s ALA 3 CO 0.16 -0.92 0.00 0.43 0.00 0.00 0.00 175.76 175.43 1j6y n SER 4 N 5.41 0.00 0.00 0.00 7.64 -1.26 -4.87 113.62 120.54 1j6y n SER 4 Ca -0.08 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.80 1j6y n SER 4 Cb 0.50 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.70 1j6y n SER 4 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1j6y n ARG 5 N 0.00 0.00 0.00 1.43 1.74 -1.26 -4.92 116.66 113.65 1j6y n ARG 5 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1j6y n ARG 5 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 1j6y n ARG 5 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1j6y n ASP 6 N -3.90 0.00 -1.13 0.55 8.00 -1.26 -5.15 116.55 113.65 1j6y n ASP 6 Ca 0.00 0.00 0.12 0.00 0.71 0.00 0.00 54.79 55.62 1j6y n ASP 6 Cb 0.00 0.00 -0.05 0.00 -0.02 0.00 0.00 41.12 41.05 1j6y n ASP 6 CO 0.00 0.00 0.00 1.67 -0.39 0.00 0.00 177.20 178.48 1j6y n GLN 7 N 0.00 -2.14 -3.27 -1.24 7.27 -1.26 -4.92 117.38 111.82 1j6y n GLN 7 Ca 0.00 1.67 -0.06 0.00 0.07 0.00 0.00 57.00 58.68 1j6y n GLN 7 Cb 0.00 -2.70 -0.04 0.00 2.41 0.00 0.00 30.24 29.90 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 -3.77 -0.72 0.82 1.69 0.11 0.52 -4.91 120.40 114.13 1j6y s VAL 8 Ca 0.00 -0.26 -0.12 0.00 -2.93 0.00 0.00 61.98 58.67 1j6y s VAL 8 Cb 0.00 -0.89 0.08 0.00 -1.53 0.00 0.00 36.38 34.04 1j6y s VAL 8 CO 0.00 -0.22 1.10 -0.54 -3.33 0.00 0.00 175.10 172.11 1j6y s LYS 9 N 2.46 1.93 0.00 1.54 1.02 -1.25 -2.60 119.74 122.84 1j6y s LYS 9 Ca 0.11 0.61 0.00 0.00 0.02 0.00 0.00 55.97 56.71 1j6y s LYS 9 Cb -0.11 -1.90 0.00 0.00 -0.52 0.00 0.00 37.83 35.29 1j6y s LYS 9 CO -0.25 -1.72 0.00 0.00 -0.92 0.00 0.00 175.35 172.45 1j6y n ALA 10 N -3.50 0.00 -2.72 5.17 0.00 -1.12 -4.93 120.51 113.41 1j6y n ALA 10 Ca 0.07 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.19 1j6y n ALA 10 Cb 0.56 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.94 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 3.87 -0.03 0.00 1.04 -1.10 -0.32 113.70 117.16 1j6y s SER 11 Ca 0.00 -1.68 -0.30 0.00 0.48 0.00 0.00 55.95 54.45 1j6y s SER 11 Cb 0.00 0.56 0.12 0.00 0.10 0.00 0.00 66.02 66.80 1j6y s SER 11 CO 0.00 -0.89 1.32 -1.38 0.98 0.00 0.00 173.24 173.27 1j6y s HIS 12 N -2.95 -0.01 0.28 5.02 -3.43 -1.20 -2.67 115.29 110.33 1j6y s HIS 12 Ca 0.08 -0.08 -0.04 0.00 -0.80 0.00 0.00 55.06 54.22 1j6y s HIS 12 Cb 0.01 0.54 -0.01 0.00 -1.43 0.00 0.00 32.58 31.69 1j6y s HIS 12 CO 0.05 -0.22 0.38 0.42 -2.00 0.00 0.00 174.74 173.36 1j6y s ILE 13 N -2.21 0.00 -0.05 -5.38 1.01 -0.72 -4.70 121.20 109.15 1j6y s ILE 13 Ca 0.20 -1.67 -0.02 0.00 0.00 0.00 0.00 60.65 59.15 1j6y s ILE 13 Cb 0.04 -2.47 0.04 0.00 0.01 0.00 0.00 42.46 40.08 1j6y s ILE 13 CO -0.03 0.00 0.11 -0.22 0.00 0.00 0.00 174.94 174.80 1j6y s LEU 14 N -3.17 0.63 0.00 2.97 2.96 -0.64 -1.89 118.68 119.54 1j6y s LEU 14 Ca 0.31 0.21 0.00 0.00 -0.22 0.00 0.00 54.13 54.44 1j6y s LEU 14 Cb 0.02 0.18 0.00 0.00 0.50 0.00 0.00 46.19 46.89 1j6y s LEU 14 CO 0.16 -0.17 0.00 -0.38 -1.32 0.00 0.00 176.35 174.64 1j6y n ILE 15 N 4.49 0.00 -3.64 6.68 5.41 -1.16 -3.17 119.36 127.98 1j6y n ILE 15 Ca -0.21 0.00 -0.02 0.00 1.00 0.00 0.00 62.75 63.51 1j6y n ILE 15 Cb 0.51 0.00 -0.04 0.00 -0.71 0.00 0.00 39.64 39.40 1j6y n ILE 15 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 176.55 174.96 1j6y s LYS 16 N 0.61 0.09 0.00 0.38 -2.85 -1.26 -4.86 119.74 111.84 1j6y s LYS 16 Ca 0.00 0.01 0.00 0.00 -1.00 0.00 0.00 55.97 54.98 1j6y s LYS 16 Cb 0.00 0.04 0.00 0.00 -2.06 0.00 0.00 37.83 35.81 1j6y s LYS 16 CO 0.00 -0.03 0.00 -2.39 0.10 0.00 0.00 175.35 173.03 1j6y n HIS 17 N 0.39 0.00 -3.05 1.78 1.44 -1.26 -4.67 115.22 109.85 1j6y n HIS 17 Ca 0.01 0.00 -0.40 0.00 -2.01 0.00 0.00 57.72 55.31 1j6y n HIS 17 Cb 0.58 0.00 -0.00 0.00 0.12 0.00 0.00 29.99 30.69 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 4.23 0.00 -1.40 6.02 -1.11 -4.82 117.38 120.30 1j6y n GLN 18 Ca 0.00 -4.58 0.00 0.00 -0.01 0.00 0.00 57.00 52.41 1j6y n GLN 18 Cb 0.00 -2.47 0.00 0.00 1.02 0.00 0.00 30.24 28.79 1j6y n GLN 18 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1j6y n GLY 19 N 1.18 1.23 0.72 1.08 0.00 -1.26 -4.94 105.19 103.20 1j6y n GLY 19 Ca 0.27 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.23 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 0.00 1.80 -0.83 1.61 7.64 -1.26 -5.08 113.62 117.51 1j6y n SER 20 Ca 0.00 -1.45 0.02 0.00 1.01 0.00 0.00 58.87 58.45 1j6y n SER 20 Cb 0.00 0.13 -0.01 0.00 -1.01 0.00 0.00 64.21 63.32 1j6y n SER 20 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 1j6y n ARG 21 N -0.23 -0.31 -4.63 1.43 0.63 -1.26 -4.82 116.66 107.47 1j6y n ARG 21 Ca -0.03 0.20 -0.24 0.00 -0.92 0.00 0.00 57.85 56.86 1j6y n ARG 21 Cb 0.13 -0.37 -0.16 0.00 0.45 0.00 0.00 32.46 32.51 1j6y n ARG 21 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 1j6y s ARG 22 N -0.26 1.59 0.52 -0.14 0.52 -1.26 -5.14 118.95 114.77 1j6y s ARG 22 Ca 0.00 -0.46 0.05 0.00 -0.52 0.00 0.00 55.73 54.81 1j6y s ARG 22 Cb 0.00 -1.36 0.09 0.00 0.52 0.00 0.00 34.95 34.21 1j6y s ARG 22 CO 0.00 0.11 0.72 0.36 0.02 0.00 0.00 175.30 176.51 1j6y n LYS 23 N 3.49 0.46 -2.07 3.54 2.85 -1.26 -4.42 118.16 120.75 1j6y n LYS 23 Ca -0.20 -2.48 -0.15 0.00 -1.05 0.00 0.00 58.31 54.42 1j6y n LYS 23 Cb 0.53 -0.31 -0.03 0.00 -0.65 0.00 0.00 35.03 34.57 1j6y n LYS 23 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1j6y n ALA 24 N -2.60 -0.55 -1.00 0.58 0.00 -1.26 -4.94 120.51 110.75 1j6y n ALA 24 Ca -0.12 0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.49 1j6y n ALA 24 Cb 0.49 -1.69 0.00 0.00 0.00 0.00 0.00 19.45 18.26 1j6y n ALA 24 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1j6y n SER 25 N -1.47 0.00 -3.12 0.00 2.88 -1.26 -4.27 113.62 106.37 1j6y n SER 25 Ca -0.17 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 57.24 1j6y n SER 25 Cb 0.59 0.00 0.06 0.00 -0.75 0.00 0.00 64.21 64.11 1j6y n SER 25 CO 0.00 0.00 0.00 0.79 -1.23 0.00 0.00 175.04 174.60 1j6y n TRP 26 N 0.00 -2.33 -3.46 0.66 5.03 -1.26 -3.72 117.44 112.37 1j6y n TRP 26 Ca 0.00 0.81 -0.14 0.00 3.03 0.00 0.00 57.50 61.20 1j6y n TRP 26 Cb 0.00 -4.01 0.00 0.00 -1.03 0.00 0.00 31.31 26.27 1j6y n TRP 26 CO 0.00 0.00 0.00 1.63 -0.03 0.00 0.00 177.69 179.29 1j6y n LYS 27 N -3.04 -1.42 -4.08 -0.99 5.02 -1.26 -5.00 118.16 107.40 1j6y n LYS 27 Ca -0.06 1.07 -0.14 0.00 -2.02 0.00 0.00 58.31 57.16 1j6y n LYS 27 Cb 0.61 -3.99 -0.12 0.00 -0.02 0.00 0.00 35.03 31.51 1j6y n LYS 27 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1j6y s ASP 28 N -3.03 0.93 1.10 4.39 1.11 -1.24 -5.16 116.67 114.76 1j6y s ASP 28 Ca 0.04 -0.54 -0.14 0.00 0.18 0.00 0.00 52.55 52.08 1j6y s ASP 28 Cb -0.01 0.02 0.20 0.00 1.07 0.00 0.00 42.92 44.20 1j6y s ASP 28 CO 0.83 -0.18 0.91 -0.81 1.18 0.00 0.00 175.17 177.10 1j6y n PRO 29 N 1.50 -1.83 -3.78 8.23 -0.04 -1.26 -4.95 135.00 132.87 1j6y n PRO 29 Ca -0.22 -1.43 -0.12 0.00 -0.04 0.00 0.00 63.50 61.68 1j6y n PRO 29 Cb 0.55 -1.14 -0.08 0.00 -0.04 0.00 0.00 33.50 32.78 1j6y n PRO 29 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 1j6y s GLU 30 N -5.03 0.68 -0.00 0.54 2.56 -1.26 -5.02 118.70 111.17 1j6y s GLU 30 Ca 0.55 -0.34 0.11 0.00 0.00 0.00 0.00 54.97 55.29 1j6y s GLU 30 Cb -0.03 0.30 -0.13 0.00 2.00 0.00 0.00 34.13 36.26 1j6y s GLU 30 CO 0.41 -0.20 0.43 0.41 -0.56 0.00 0.00 175.26 175.75 1j6y n GLY 31 N 1.06 -0.15 7.00 -1.50 0.00 -1.26 -5.07 105.19 105.27 1j6y n GLY 31 Ca -0.21 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.50 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 -1.39 0.00 0.00 1.61 4.81 -1.26 -4.69 118.16 117.24 1j6y n LYS 32 Ca 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.45 1j6y n LYS 32 Cb 0.20 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.25 1j6y n LYS 32 CO 0.00 0.00 0.00 -0.89 1.17 0.00 0.00 177.40 177.68 1j6y n ILE 33 N 0.00 0.00 -4.17 3.15 5.41 -1.26 -4.49 119.36 117.99 1j6y n ILE 33 Ca 0.00 0.00 -0.07 0.00 1.00 0.00 0.00 62.75 63.68 1j6y n ILE 33 Cb 0.00 0.00 -0.02 0.00 -0.71 0.00 0.00 39.64 38.91 1j6y n ILE 33 CO 0.00 0.00 0.00 2.30 0.00 0.00 0.00 176.55 178.85 1j6y n ILE 34 N 0.00 0.00 0.00 1.39 -5.35 -1.26 -5.13 119.36 109.01 1j6y n ILE 34 Ca 0.00 -0.55 0.00 0.00 -0.27 0.00 0.00 62.75 61.93 1j6y n ILE 34 Cb 0.00 0.11 0.00 0.00 -1.74 0.00 0.00 39.64 38.01 1j6y n ILE 34 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 1j6y n LEU 35 N 0.00 0.00 0.00 7.28 4.32 -1.26 -4.94 117.00 122.40 1j6y n LEU 35 Ca -0.05 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.94 1j6y n LEU 35 Cb 0.15 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.95 1j6y n LEU 35 CO 0.08 0.00 0.00 1.07 -1.22 0.00 0.00 177.39 177.32 1j6y n THR 36 N -0.76 0.00 -1.99 -5.08 5.66 -1.26 -5.11 114.28 105.73 1j6y n THR 36 Ca 0.00 0.00 -0.42 0.00 -3.05 0.00 0.00 64.05 60.58 1j6y n THR 36 Cb 0.00 0.00 -0.03 0.00 -1.55 0.00 0.00 70.33 68.75 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 2.77 0.54 1.09 2.01 -1.26 -5.00 115.64 115.79 1j6y s THR 37 Ca 0.00 0.56 0.06 0.00 0.31 0.00 0.00 61.69 62.63 1j6y s THR 37 Cb 0.00 -3.36 0.04 0.00 0.01 0.00 0.00 72.50 69.19 1j6y s THR 37 CO 0.00 0.05 0.47 0.42 -0.69 0.00 0.00 174.62 174.87 1j6y s THR 38 N 0.97 1.83 0.11 -0.82 -4.23 -1.26 -2.77 115.64 109.48 1j6y s THR 38 Ca 0.67 -1.39 -0.25 0.00 -1.18 0.00 0.00 61.69 59.54 1j6y s THR 38 Cb -0.42 -2.22 -0.08 0.00 1.34 0.00 0.00 72.50 71.12 1j6y s THR 38 CO 0.33 0.00 1.43 -0.09 -0.54 0.00 0.00 174.62 175.75 1j6y h ARG 39 N 0.67 -0.20 0.19 3.99 2.43 -1.95 1.27 114.38 120.79 1j6y h ARG 39 Ca -0.36 0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 58.82 1j6y h ARG 39 Cb 1.30 0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.88 1j6y h ARG 39 CO 0.54 -0.13 -0.27 1.49 -1.51 0.00 0.00 179.97 180.09 1j6y h GLU 40 N -0.20 -0.46 -0.81 0.20 4.81 -2.00 -1.73 114.58 114.39 1j6y h GLU 40 Ca 0.08 0.03 0.15 0.00 -0.13 0.00 0.00 59.36 59.50 1j6y h GLU 40 Cb 0.42 0.10 -0.15 0.00 0.63 0.00 0.00 28.75 29.75 1j6y h GLU 40 CO -0.57 -0.31 -0.26 0.00 -0.73 0.00 0.00 179.01 177.15 1j6y h ALA 41 N -1.22 0.39 -0.03 2.92 0.00 -1.78 -0.26 119.26 119.27 1j6y h ALA 41 Ca -0.02 0.29 0.01 0.00 0.00 0.00 0.00 54.91 55.18 1j6y h ALA 41 Cb 0.43 0.71 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 1j6y h ALA 41 CO -0.07 -0.48 -0.08 0.00 0.00 0.00 0.00 179.25 178.62 1j6y h ALA 42 N 1.62 -0.44 -1.24 0.00 0.00 0.21 0.41 119.26 119.82 1j6y h ALA 42 Ca 0.36 -0.01 0.36 0.00 0.00 0.00 0.00 54.91 55.63 1j6y h ALA 42 Cb 0.60 0.68 -0.09 0.00 0.00 0.00 0.00 17.79 18.98 1j6y h ALA 42 CO -0.84 -0.47 0.83 0.28 0.00 0.00 0.00 179.25 179.05 1j6y h VAL 43 N -0.07 0.33 0.23 0.00 2.07 -0.42 0.34 116.25 118.72 1j6y h VAL 43 Ca 0.01 -0.06 -0.01 0.00 0.82 0.00 0.00 66.70 67.46 1j6y h VAL 43 Cb 0.09 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.00 1j6y h VAL 43 CO -0.07 0.03 -0.11 -0.08 0.02 0.00 0.00 177.57 177.36 1j6y h GLU 44 N 0.17 -0.30 -0.06 1.57 4.81 0.12 1.52 114.58 122.42 1j6y h GLU 44 Ca 0.69 0.02 0.02 0.00 -0.13 0.00 0.00 59.36 59.95 1j6y h GLU 44 Cb 2.21 0.07 -0.00 0.00 0.63 0.00 0.00 28.75 31.66 1j6y h GLU 44 CO -0.24 -0.01 0.04 0.37 -0.73 0.00 0.00 179.01 178.44 1j6y h GLN 45 N -0.60 0.00 0.16 1.92 -0.00 0.33 -1.82 115.11 115.10 1j6y h GLN 45 Ca -0.03 0.00 -0.32 0.00 -0.00 0.00 0.00 58.65 58.30 1j6y h GLN 45 Cb 0.43 0.00 0.01 0.00 0.00 0.00 0.00 27.48 27.92 1j6y h GLN 45 CO 0.05 0.00 -1.57 1.25 0.00 0.00 0.00 178.83 178.56 1j6y h LEU 46 N 0.00 0.53 -1.97 -2.39 6.46 -0.37 -3.00 115.31 114.57 1j6y h LEU 46 Ca 0.03 -0.71 0.22 0.00 -0.12 0.00 0.00 57.88 57.30 1j6y h LEU 46 Cb 0.11 -0.17 -0.03 0.00 -0.73 0.00 0.00 40.66 39.83 1j6y h LEU 46 CO -0.00 1.59 0.55 0.50 -0.62 0.00 0.00 178.44 180.46 1j6y h LYS 47 N 0.09 0.03 0.15 1.25 3.64 0.30 0.63 116.57 122.66 1j6y h LYS 47 Ca -0.27 -0.00 -0.33 0.00 -1.27 0.00 0.00 60.65 58.77 1j6y h LYS 47 Cb 2.06 -0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 33.88 1j6y h LYS 47 CO 0.19 0.02 -1.69 1.03 -2.27 0.00 0.00 179.45 176.72 1j6y h SER 48 N 0.03 0.50 -0.07 4.20 0.87 -1.56 -2.88 113.55 114.63 1j6y h SER 48 Ca 0.37 -0.76 0.00 0.00 -1.23 0.00 0.00 61.79 60.17 1j6y h SER 48 Cb 1.44 -0.16 -0.00 0.00 -0.44 0.00 0.00 62.40 63.24 1j6y h SER 48 CO -0.01 1.64 0.05 -0.29 -0.53 0.00 0.00 176.83 177.68 1j6y h ILE 49 N 0.09 1.04 -0.75 2.23 -0.00 -0.82 1.07 117.51 120.36 1j6y h ILE 49 Ca -0.31 -0.09 -0.02 0.00 -0.00 0.00 0.00 64.86 64.44 1j6y h ILE 49 Cb 2.06 0.97 -0.04 0.00 -0.00 0.00 0.00 36.82 39.81 1j6y h ILE 49 CO 0.16 0.03 0.39 -0.09 -0.00 0.00 0.00 178.15 178.64 1j6y h ARG 50 N 0.08 1.05 0.61 2.19 1.12 -1.17 0.41 114.38 118.67 1j6y h ARG 50 Ca 0.03 -0.13 -0.03 0.00 -1.11 0.00 0.00 59.98 58.74 1j6y h ARG 50 Cb 0.01 -0.20 0.01 0.00 -0.01 0.00 0.00 29.97 29.78 1j6y h ARG 50 CO -0.01 0.79 -0.29 1.49 -3.11 0.00 0.00 179.97 178.84 1j6y h GLU 51 N 1.05 -0.79 -0.41 0.20 4.57 -1.09 1.16 114.58 119.28 1j6y h GLU 51 Ca 0.26 0.05 0.07 0.00 -1.18 0.00 0.00 59.36 58.57 1j6y h GLU 51 Cb 0.06 0.18 -0.06 0.00 -0.16 0.00 0.00 28.75 28.77 1j6y h GLU 51 CO -0.04 -0.47 0.05 0.22 -1.18 0.00 0.00 179.01 177.59 1j6y h ASP 52 N -0.99 -0.07 0.22 1.04 1.82 0.14 0.76 116.42 119.35 1j6y h ASP 52 Ca -0.08 0.08 -0.02 0.00 -0.39 0.00 0.00 57.03 56.62 1j6y h ASP 52 Cb 0.67 0.13 -0.00 0.00 0.68 0.00 0.00 39.33 40.81 1j6y h ASP 52 CO 0.14 0.00 -0.10 0.40 -1.61 0.00 0.00 179.24 178.06 1j6y h ILE 53 N 0.17 0.72 0.50 2.25 2.04 -0.00 -2.88 117.51 120.30 1j6y h ILE 53 Ca 0.20 -0.42 -0.02 0.00 1.00 0.00 0.00 64.86 65.62 1j6y h ILE 53 Cb 0.27 1.25 0.00 0.00 -0.74 0.00 0.00 36.82 37.60 1j6y h ILE 53 CO -0.29 0.10 -0.24 0.58 0.00 0.00 0.00 178.15 178.30 1j6y h VAL 54 N 0.00 0.00 -2.80 1.67 2.07 0.75 -3.44 116.25 114.49 1j6y h VAL 54 Ca -0.00 -0.49 -0.64 0.00 0.82 0.00 0.00 66.70 66.39 1j6y h VAL 54 Cb 0.24 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 29.95 1j6y h VAL 54 CO 0.01 0.00 -0.37 -0.44 0.02 0.00 0.00 177.57 176.79 1j6y s SER 55 N -4.71 6.55 0.00 0.57 0.01 1.00 -4.84 113.70 112.28 1j6y s SER 55 Ca -0.10 0.65 0.00 0.00 1.31 0.00 0.00 55.95 57.82 1j6y s SER 55 Cb 0.01 -2.14 0.00 0.00 0.21 0.00 0.00 66.02 64.10 1j6y s SER 55 CO 0.29 0.36 0.00 0.61 0.41 0.00 0.00 173.24 174.91 1j6y n GLY 56 N 1.81 -2.28 2.48 3.44 0.00 -1.26 -4.62 105.19 104.76 1j6y n GLY 56 Ca -0.17 -0.61 -0.10 0.00 0.00 0.00 0.00 46.02 45.14 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 0.41 1.18 0.00 1.61 3.00 -1.26 -4.72 118.16 118.38 1j6y n LYS 57 Ca 0.00 -0.79 0.00 0.00 -0.00 0.00 0.00 58.31 57.52 1j6y n LYS 57 Cb 0.00 -2.00 0.00 0.00 0.00 0.00 0.00 35.03 33.03 1j6y n LYS 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1j6y n ALA 58 N 3.52 0.00 -1.73 3.14 0.00 -1.26 -5.04 120.51 119.14 1j6y n ALA 58 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.69 1j6y n ALA 58 Cb 0.26 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.71 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 0.00 0.00 0.00 0.00 4.13 -1.26 -5.05 115.26 113.08 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 -0.05 0.00 -0.32 -4.13 -0.58 -1.26 -1.16 120.64 113.13 1j6y n GLU 61 Ca 0.00 0.00 0.15 0.00 -0.42 0.00 0.00 57.16 56.89 1j6y n GLU 61 Cb 0.00 -0.83 0.30 0.00 -0.57 0.00 0.00 31.44 30.34 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 0.05 -0.56 3.49 5.08 -1.97 1.38 114.58 122.06 1j6y h GLU 62 Ca 0.00 -0.00 0.11 0.00 -1.00 0.00 0.00 59.36 58.47 1j6y h GLU 62 Cb 0.00 -0.01 -0.09 0.00 0.50 0.00 0.00 28.75 29.14 1j6y h GLU 62 CO 0.00 0.03 -0.01 0.28 -1.00 0.00 0.00 179.01 178.31 1j6y h VAL 63 N 0.05 0.54 0.76 3.13 2.07 -1.95 -2.40 116.25 118.46 1j6y h VAL 63 Ca 0.59 -0.04 -0.04 0.00 0.82 0.00 0.00 66.70 68.04 1j6y h VAL 63 Cb 1.24 0.43 0.01 0.00 -1.52 0.00 0.00 31.29 31.45 1j6y h VAL 63 CO -0.84 0.02 -0.36 0.00 0.02 0.00 0.00 177.57 176.40 1j6y h ALA 64 N 1.51 -1.02 -1.26 1.67 0.00 0.33 -0.89 119.26 119.59 1j6y h ALA 64 Ca 0.28 -0.23 0.37 0.00 0.00 0.00 0.00 54.91 55.33 1j6y h ALA 64 Cb 0.44 0.39 -0.05 0.00 0.00 0.00 0.00 17.79 18.58 1j6y h ALA 64 CO -0.48 -0.99 1.23 1.79 0.00 0.00 0.00 179.25 180.80 1j6y h THR 65 N -1.19 0.03 0.00 0.00 1.35 -0.72 -1.49 112.91 110.89 1j6y h THR 65 Ca -0.10 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.76 1j6y h THR 65 Cb 0.80 0.05 0.00 0.00 -1.73 0.00 0.00 68.15 67.27 1j6y h THR 65 CO 0.17 0.00 -0.24 -1.14 -0.25 0.00 0.00 175.52 174.06 1j6y n ARG 66 N -3.48 0.15 -1.50 4.72 0.63 -0.94 -3.94 116.66 112.29 1j6y n ARG 66 Ca 0.28 0.18 -0.32 0.00 -0.92 0.00 0.00 57.85 57.07 1j6y n ARG 66 Cb 1.61 -0.89 -0.05 0.00 0.45 0.00 0.00 32.46 33.57 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 -3.04 4.22 -4.64 5.15 3.14 -0.37 -4.79 118.33 118.01 1j6y n VAL 67 Ca -0.03 -3.00 -0.29 0.00 -2.96 0.00 0.00 64.34 58.05 1j6y n VAL 67 Cb 0.12 -2.17 -0.08 0.00 -1.06 0.00 0.00 33.84 30.65 1j6y n VAL 67 CO 0.00 0.00 0.00 -0.44 -6.46 0.00 0.00 176.83 169.93 1j6y s SER 68 N 1.28 3.48 -1.16 6.55 0.01 -0.60 -1.62 113.70 121.64 1j6y s SER 68 Ca 0.63 -1.62 -0.23 0.00 1.31 0.00 0.00 55.95 56.03 1j6y s SER 68 Cb 0.24 0.40 -0.11 0.00 0.21 0.00 0.00 66.02 66.76 1j6y s SER 68 CO -0.09 -0.84 1.97 -0.62 0.41 0.00 0.00 173.24 174.08 1j6y s ASP 69 N -3.74 4.73 0.00 2.44 -1.08 -1.26 -4.31 116.67 113.45 1j6y s ASP 69 Ca 0.17 -1.52 0.00 0.00 -0.52 0.00 0.00 52.55 50.68 1j6y s ASP 69 Cb 0.03 -2.59 0.00 0.00 -1.46 0.00 0.00 42.92 38.90 1j6y s ASP 69 CO 0.09 -3.40 0.00 0.00 0.52 0.00 0.00 175.17 172.39 1j6y h SER 71 N 0.00 -0.42 -0.84 0.00 0.87 -1.99 2.32 113.55 113.49 1j6y h SER 71 Ca 0.00 0.21 0.17 0.00 -1.23 0.00 0.00 61.79 60.94 1j6y h SER 71 Cb 0.00 0.38 -0.06 0.00 -0.44 0.00 0.00 62.40 62.28 1j6y h SER 71 CO 0.00 -0.21 0.56 0.28 -0.53 0.00 0.00 176.83 176.93 1j6y h SER 72 N 0.08 0.44 -0.95 6.23 0.02 -0.19 1.60 113.55 120.78 1j6y h SER 72 Ca 0.42 0.03 0.27 0.00 -0.84 0.00 0.00 61.79 61.68 1j6y h SER 72 Cb 0.75 -0.05 -0.04 0.00 0.14 0.00 0.00 62.40 63.20 1j6y h SER 72 CO -0.71 0.21 0.68 0.00 -1.14 0.00 0.00 176.83 175.87 1j6y h ALA 73 N 1.62 2.89 0.03 3.77 0.00 0.38 2.72 119.26 130.68 1j6y h ALA 73 Ca 0.43 -0.03 -0.27 0.00 0.00 0.00 0.00 54.91 55.03 1j6y h ALA 73 Cb 0.97 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.80 1j6y h ALA 73 CO -0.16 -1.17 -1.46 -0.22 0.00 0.00 0.00 179.25 176.24 1j6y h LYS 74 N 0.00 0.06 -2.27 0.00 1.63 0.24 -3.35 116.57 112.89 1j6y h LYS 74 Ca 0.45 -0.11 -0.58 0.00 -0.85 0.00 0.00 60.65 59.56 1j6y h LYS 74 Cb 1.81 0.04 -0.42 0.00 -0.60 0.00 0.00 32.23 33.06 1j6y h LYS 74 CO -0.01 0.81 -0.67 0.54 -3.45 0.00 0.00 179.45 176.67 1j6y n ARG 75 N -3.24 3.08 0.00 1.90 1.74 0.68 -4.84 116.66 115.98 1j6y n ARG 75 Ca -0.12 -4.77 0.11 0.00 -0.77 0.00 0.00 57.85 52.30 1j6y n ARG 75 Cb 1.02 -2.21 0.52 0.00 -1.02 0.00 0.00 32.46 30.77 1j6y n ARG 75 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1j6y n GLY 76 N -0.18 -1.12 0.00 -0.13 0.00 0.76 -4.35 105.19 100.18 1j6y n GLY 76 Ca 0.31 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.23 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 0.66 -1.74 0.24 -0.02 0.00 -1.26 -4.50 105.19 98.57 1j6y n GLY 77 Ca 0.08 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.09 1j6y n GLY 77 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1j6y n ASP 78 N 0.00 -0.09 -0.02 1.61 5.75 -1.26 -3.21 116.55 119.33 1j6y n ASP 78 Ca 0.00 -1.14 -0.02 0.00 -0.01 0.00 0.00 54.79 53.62 1j6y n ASP 78 Cb 0.00 0.17 -0.01 0.00 -1.03 0.00 0.00 41.12 40.25 1j6y n ASP 78 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1j6y n LEU 79 N 0.00 0.49 0.00 -2.12 4.32 0.57 -4.87 117.00 115.39 1j6y n LEU 79 Ca 0.00 0.24 0.00 0.00 -0.02 0.00 0.00 56.01 56.23 1j6y n LEU 79 Cb 0.04 -0.58 0.00 0.00 -1.62 0.00 0.00 43.42 41.26 1j6y n LEU 79 CO 0.02 -0.47 0.00 0.61 -1.22 0.00 0.00 177.39 176.33 1j6y n GLY 80 N 1.62 0.81 3.26 -0.72 0.00 -1.16 -4.98 105.19 104.02 1j6y n GLY 80 Ca -0.03 -0.21 -0.10 0.00 0.00 0.00 0.00 46.02 45.68 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 -0.48 0.00 1.61 1.04 -1.26 -2.80 113.70 107.81 1j6y s SER 81 Ca 0.00 0.89 0.00 0.00 0.48 0.00 0.00 55.95 57.32 1j6y s SER 81 Cb 0.00 0.82 0.00 0.00 0.10 0.00 0.00 66.02 66.94 1j6y s SER 81 CO 0.00 -0.20 0.00 2.22 0.98 0.00 0.00 173.24 176.24 1j6y n PHE 82 N 4.39 0.00 0.00 5.02 -1.74 -1.07 -4.89 117.46 119.17 1j6y n PHE 82 Ca -0.22 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.67 1j6y n PHE 82 Cb 0.55 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.55 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 -0.75 3.56 4.97 0.00 -1.26 0.19 105.19 111.91 1j6y n GLY 83 Ca 0.00 0.28 -0.34 0.00 0.00 0.00 0.00 46.02 45.96 1j6y n GLY 83 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1j6y s ARG 84 N 0.00 3.10 0.00 1.61 3.00 -1.26 -4.73 118.95 120.67 1j6y s ARG 84 Ca 0.00 -0.86 0.00 0.00 0.00 0.00 0.00 55.73 54.87 1j6y s ARG 84 Cb 0.00 -5.24 0.00 0.00 0.00 0.00 0.00 34.95 29.71 1j6y s ARG 84 CO 0.00 -2.85 0.00 0.41 0.00 0.00 0.00 175.30 172.86 1j6y n GLY 85 N 6.65 0.36 5.25 -3.53 0.00 -1.26 -5.00 105.19 107.65 1j6y n GLY 85 Ca 0.38 -1.82 0.00 0.00 0.00 0.00 0.00 46.02 44.59 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 -0.82 1.61 1.13 -1.26 -2.08 117.38 115.96 1j6y n GLN 86 Ca 0.00 0.00 -0.16 0.00 -1.94 0.00 0.00 57.00 54.90 1j6y n GLN 86 Cb 0.00 0.00 0.11 0.00 0.11 0.00 0.00 30.24 30.46 1j6y n GLN 86 CO 0.00 0.00 0.00 -1.33 -1.44 0.00 0.00 177.06 174.29 1j6y n MET 87 N 0.00 1.84 0.00 -1.09 2.81 -1.26 -5.03 117.12 114.38 1j6y n MET 87 Ca 0.00 -1.99 0.00 0.00 -1.81 0.00 0.00 57.70 53.90 1j6y n MET 87 Cb 0.00 -1.78 0.00 0.00 -0.71 0.00 0.00 33.22 30.73 1j6y n MET 87 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 1j6y n GLN 88 N -0.56 0.00 0.06 0.03 1.13 -0.88 -3.42 117.38 113.75 1j6y n GLN 88 Ca 0.39 0.00 0.11 0.00 -1.94 0.00 0.00 57.00 55.57 1j6y n GLN 88 Cb 1.24 0.00 0.01 0.00 0.11 0.00 0.00 30.24 31.60 1j6y n GLN 88 CO 0.00 0.00 0.00 0.36 -1.44 0.00 0.00 177.06 175.98 1j6y n LYS 89 N -0.05 0.47 0.00 -1.09 2.85 -1.26 -4.02 118.16 115.06 1j6y n LYS 89 Ca 0.00 0.04 0.00 0.00 -1.05 0.00 0.00 58.31 57.30 1j6y n LYS 89 Cb 0.00 -1.70 0.00 0.00 -0.65 0.00 0.00 35.03 32.68 1j6y n LYS 89 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 177.40 177.00 1j6y n PRO 90 N -2.34 0.00 -0.23 -1.58 -0.04 -1.25 -2.72 135.00 126.83 1j6y n PRO 90 Ca 0.01 0.33 -0.04 0.00 -0.04 0.00 0.00 63.50 63.75 1j6y n PRO 90 Cb 0.50 -1.00 0.02 0.00 -0.04 0.00 0.00 33.50 32.98 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 -0.92 -0.43 0.54 3.04 -1.81 -1.81 116.94 115.55 1j6y h PHE 91 Ca 0.00 0.08 0.04 0.00 3.98 0.00 0.00 57.97 62.07 1j6y h PHE 91 Cb 0.00 0.50 -0.06 0.00 2.56 0.00 0.00 35.95 38.96 1j6y h PHE 91 CO 0.05 -0.38 -0.29 1.49 -2.02 0.00 0.00 178.31 177.16 1j6y h GLU 92 N -0.13 -0.05 -0.87 1.11 4.81 -1.70 1.71 114.58 119.46 1j6y h GLU 92 Ca 0.26 0.00 0.25 0.00 -0.13 0.00 0.00 59.36 59.74 1j6y h GLU 92 Cb 0.56 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.91 1j6y h GLU 92 CO -0.73 -0.03 0.97 1.49 -0.73 0.00 0.00 179.01 179.97 1j6y h GLU 93 N -0.05 0.00 0.49 1.92 4.57 -1.13 0.36 114.58 120.74 1j6y h GLU 93 Ca 0.07 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.23 1j6y h GLU 93 Cb 0.23 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.83 1j6y h GLU 93 CO -0.43 0.00 -0.24 0.00 -1.18 0.00 0.00 179.01 177.16 1j6y h ALA 94 N 0.88 -0.66 0.00 2.92 0.00 0.28 0.17 119.26 122.86 1j6y h ALA 94 Ca 0.42 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 55.09 1j6y h ALA 94 Cb 2.35 0.26 -0.01 0.00 0.00 0.00 0.00 17.79 20.38 1j6y h ALA 94 CO -0.00 -0.64 -0.35 1.15 0.00 0.00 0.00 179.25 179.41 1j6y h THR 95 N -1.13 1.02 0.00 0.00 2.02 -0.57 -0.99 112.91 113.26 1j6y h THR 95 Ca -0.07 -1.29 -0.02 0.00 0.77 0.00 0.00 66.41 65.80 1j6y h THR 95 Cb 0.55 1.74 -0.00 0.00 -1.74 0.00 0.00 68.15 68.70 1j6y h THR 95 CO 0.11 0.34 -0.08 1.88 0.37 0.00 0.00 175.52 178.14 1j6y h TYR 96 N 0.00 0.00 0.00 3.16 0.05 -0.40 -3.32 116.97 116.46 1j6y h TYR 96 Ca -0.00 0.00 -0.23 0.00 0.05 0.00 0.00 58.73 58.55 1j6y h TYR 96 Cb 0.72 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 38.42 1j6y h TYR 96 CO 0.00 0.08 -1.23 0.00 -1.05 0.00 0.00 178.16 175.96 1j6y h ALA 97 N 1.92 0.26 -2.16 3.88 0.00 0.17 -3.48 119.26 119.86 1j6y h ALA 97 Ca -0.00 -1.20 -0.47 0.00 0.00 0.00 0.00 54.91 53.25 1j6y h ALA 97 Cb 0.87 0.72 0.01 0.00 0.00 0.00 0.00 17.79 19.39 1j6y h ALA 97 CO 0.01 0.69 -0.24 -1.17 0.00 0.00 0.00 179.25 178.54 1j6y s LEU 98 N -7.88 4.01 0.00 0.00 0.20 -0.45 -5.06 118.68 109.50 1j6y s LEU 98 Ca -0.29 0.29 0.00 0.00 0.69 0.00 0.00 54.13 54.82 1j6y s LEU 98 Cb 0.06 -3.14 0.00 0.00 -0.43 0.00 0.00 46.19 42.67 1j6y s LEU 98 CO 0.60 -0.33 0.00 0.29 -0.29 0.00 0.00 176.35 176.61 1j6y n LYS 99 N -1.75 0.00 0.00 1.98 5.02 -1.26 -4.72 118.16 117.43 1j6y n LYS 99 Ca -0.04 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.25 1j6y n LYS 99 Cb 0.57 -0.36 0.00 0.00 -0.02 0.00 0.00 35.03 35.22 1j6y n LYS 99 CO 0.00 0.00 0.00 1.55 -0.52 0.00 0.00 177.40 178.43 1j6y n VAL 100 N -2.33 0.00 -0.03 -0.18 3.14 -1.26 -4.28 118.33 113.39 1j6y n VAL 100 Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 1j6y n VAL 100 Cb 0.00 0.00 0.30 0.00 -1.06 0.00 0.00 33.84 33.08 1j6y n VAL 100 CO 0.00 0.00 0.00 1.23 -6.46 0.00 0.00 176.83 171.60 1j6y h GLY 101 N 0.00 0.63 0.60 7.55 0.00 -1.93 -2.84 103.07 107.08 1j6y h GLY 101 Ca 0.00 -0.35 -0.08 0.00 0.00 0.00 0.00 47.33 46.91 1j6y h GLY 101 CO 0.00 0.32 -1.53 1.22 0.00 0.00 0.00 176.54 176.55 1j6y n ASP 102 N -4.31 0.52 -1.95 0.19 8.00 -1.26 -5.02 116.55 112.71 1j6y n ASP 102 Ca 0.02 0.21 0.00 0.00 0.71 0.00 0.00 54.79 55.73 1j6y n ASP 102 Cb 0.21 0.89 0.00 0.00 -0.02 0.00 0.00 41.12 42.21 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 -2.61-12.41 -1.13 0.53 5.41 -1.07 -4.81 119.36 103.26 1j6y n ILE 103 Ca -0.07 3.05 -0.36 0.00 1.00 0.00 0.00 62.75 66.37 1j6y n ILE 103 Cb 0.68 -5.29 -0.00 0.00 -0.71 0.00 0.00 39.64 34.32 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 1.70 -2.58 -4.68 4.38 2.88 -1.17 -4.95 113.62 109.20 1j6y n SER 104 Ca 0.00 0.70 -0.27 0.00 -1.33 0.00 0.00 58.87 57.96 1j6y n SER 104 Cb 0.00 -0.77 -0.08 0.00 -0.75 0.00 0.00 64.21 62.62 1j6y n SER 104 CO 0.00 0.00 0.00 1.51 -1.23 0.00 0.00 175.04 175.32 1j6y s ASP 105 N -0.87 4.88 0.00 -3.46 1.47 -1.26 -4.40 116.67 113.02 1j6y s ASP 105 Ca 0.52 -0.32 0.00 0.00 1.18 0.00 0.00 52.55 53.92 1j6y s ASP 105 Cb -0.55 -1.09 0.00 0.00 -0.34 0.00 0.00 42.92 40.95 1j6y s ASP 105 CO 0.55 0.11 0.00 2.30 0.68 0.00 0.00 175.17 178.81 1j6y n ILE 106 N 0.04 0.00 -2.92 2.11 -0.00 -1.26 -4.81 119.36 112.52 1j6y n ILE 106 Ca -0.10 0.00 -0.35 0.00 -0.00 0.00 0.00 62.75 62.30 1j6y n ILE 106 Cb 0.54 0.00 -0.02 0.00 -0.00 0.00 0.00 39.64 40.17 1j6y n ILE 106 CO 0.00 0.00 0.00 0.52 -0.00 0.00 0.00 176.55 177.07 1j6y n VAL 107 N 0.57 4.48 -1.55 7.28 0.31 0.20 -4.88 118.33 124.75 1j6y n VAL 107 Ca 0.00 -5.74 -0.36 0.00 -0.01 0.00 0.00 64.34 58.23 1j6y n VAL 107 Cb 0.00 -1.68 -0.04 0.00 -0.91 0.00 0.00 33.84 31.20 1j6y n VAL 107 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 1j6y n ASP 108 N 0.27 2.12 0.00 4.52 5.68 -1.26 -1.02 116.55 126.85 1j6y n ASP 108 Ca 0.36 -0.47 0.00 0.00 -0.50 0.00 0.00 54.79 54.17 1j6y n ASP 108 Cb 0.34 -1.53 0.00 0.00 -1.14 0.00 0.00 41.12 38.79 1j6y n ASP 108 CO 0.00 0.00 0.00 0.41 -1.33 0.00 0.00 177.20 176.28 1j6y n THR 109 N 7.97 0.00 -1.18 2.12 -1.04 -0.87 -4.89 114.28 116.39 1j6y n THR 109 Ca 0.40 0.00 -0.37 0.00 -2.04 0.00 0.00 64.05 62.04 1j6y n THR 109 Cb 0.50 0.00 0.04 0.00 -1.82 0.00 0.00 70.33 69.05 1j6y n THR 109 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 1j6y n ASP 110 N 0.00 -3.16 0.00 8.00 2.03 -1.26 -1.45 116.55 120.70 1j6y n ASP 110 Ca 0.00 0.51 0.00 0.00 0.52 0.00 0.00 54.79 55.82 1j6y n ASP 110 Cb 0.00 -0.99 0.00 0.00 -0.72 0.00 0.00 41.12 39.41 1j6y n ASP 110 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 1j6y n SER 111 N 1.48 0.00 0.00 1.67 7.64 -1.26 -4.75 113.62 118.39 1j6y n SER 111 Ca 0.06 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.94 1j6y n SER 111 Cb 0.50 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.70 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 -0.93 3.69 0.23 0.00 -0.53 -3.99 105.19 103.65 1j6y n GLY 112 Ca 0.00 -1.14 -0.42 0.00 0.00 0.00 0.00 46.02 44.46 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 -3.00 2.65 0.33 1.61 -7.23 -1.26 -2.05 120.40 111.45 1j6y s VAL 113 Ca 0.00 0.10 0.09 0.00 -1.81 0.00 0.00 61.98 60.37 1j6y s VAL 113 Cb 0.00 -3.07 -0.06 0.00 0.56 0.00 0.00 36.38 33.82 1j6y s VAL 113 CO 0.00 -0.00 -0.04 -1.00 -0.31 0.00 0.00 175.10 173.75 1j6y s HIS 114 N 2.93 2.50 0.09 2.82 4.02 -0.19 -2.96 115.29 124.50 1j6y s HIS 114 Ca 0.81 -0.42 0.06 0.00 1.02 0.00 0.00 55.06 56.52 1j6y s HIS 114 Cb -0.45 -1.39 -0.03 0.00 -1.02 0.00 0.00 32.58 29.69 1j6y s HIS 114 CO 0.36 0.54 -0.14 0.96 1.02 0.00 0.00 174.74 177.48 1j6y s ILE 115 N -2.52 1.22 0.08 0.60 -4.36 -0.79 0.61 121.20 116.04 1j6y s ILE 115 Ca 0.33 -1.50 0.01 0.00 -0.26 0.00 0.00 60.65 59.24 1j6y s ILE 115 Cb -0.00 -1.29 -0.04 0.00 1.25 0.00 0.00 42.46 42.37 1j6y s ILE 115 CO 0.18 -0.31 -0.06 -0.63 0.24 0.00 0.00 174.94 174.37 1j6y s ILE 116 N -1.66 0.56 0.28 8.37 1.01 -1.26 -1.75 121.20 126.75 1j6y s ILE 116 Ca 0.03 -1.85 0.03 0.00 0.00 0.00 0.00 60.65 58.86 1j6y s ILE 116 Cb -0.08 -1.57 -0.04 0.00 0.01 0.00 0.00 42.46 40.79 1j6y s ILE 116 CO 0.03 -0.87 0.17 -0.75 0.00 0.00 0.00 174.94 173.51 1j6y s LYS 117 N -3.70 1.52 0.00 2.79 2.20 -1.09 -3.05 119.74 118.41 1j6y s LYS 117 Ca 0.09 -1.86 0.00 0.00 -0.36 0.00 0.00 55.97 53.84 1j6y s LYS 117 Cb 0.05 0.03 0.00 0.00 -1.51 0.00 0.00 37.83 36.40 1j6y s LYS 117 CO -0.06 -0.46 0.00 -2.13 -0.36 0.00 0.00 175.35 172.35 1j6y n ARG 118 N -0.52 0.00 0.00 4.03 0.63 -1.26 -2.72 116.66 116.82 1j6y n ARG 118 Ca 0.02 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.95 1j6y n ARG 118 Cb 0.65 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.56 1j6y n ARG 118 CO 0.00 0.00 0.00 2.41 -2.51 0.00 0.00 177.63 177.53 1j6y n THR 119 N 0.00 0.00 0.59 5.15 -1.04 -1.26 -5.00 114.28 112.72 1j6y n THR 119 Ca 0.00 0.00 0.07 0.00 -2.04 0.00 0.00 64.05 62.08 1j6y n THR 119 Cb 0.00 0.00 0.06 0.00 -1.82 0.00 0.00 70.33 68.57 1j6y n THR 119 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43