#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 0.00 0.00 -0.41 0.00 -1.26 -5.08 117.12 110.37 1j6y n MET 2 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.70 57.70 1j6y n MET 2 Cb 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 33.22 32.89 1j6y n MET 2 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1j6y n ALA 3 N -3.23 0.00 -2.41 -5.12 0.00 -1.26 -5.12 120.51 103.37 1j6y n ALA 3 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 1j6y n ALA 3 Cb 0.14 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.57 1j6y n ALA 3 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1j6y n SER 4 N -1.68 -6.02 -3.08 0.00 2.88 -1.26 -4.97 113.62 99.49 1j6y n SER 4 Ca 0.00 1.64 0.00 0.00 -1.33 0.00 0.00 58.87 59.18 1j6y n SER 4 Cb 0.00 -5.14 0.00 0.00 -0.75 0.00 0.00 64.21 58.32 1j6y n SER 4 CO 0.00 0.00 0.00 -2.11 -1.23 0.00 0.00 175.04 171.70 1j6y n ARG 5 N 1.74 -1.64 0.00 -1.46 0.00 -1.26 -5.05 116.66 108.99 1j6y n ARG 5 Ca -0.16 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.69 1j6y n ARG 5 Cb 0.24 0.00 0.00 0.00 -0.00 0.00 0.00 32.46 32.70 1j6y n ARG 5 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.63 177.23 1j6y n ASP 6 N -2.67 0.00 -0.61 2.89 5.68 -1.26 -5.16 116.55 115.42 1j6y n ASP 6 Ca 0.00 0.00 0.07 0.00 -0.50 0.00 0.00 54.79 54.36 1j6y n ASP 6 Cb 0.00 0.00 -0.04 0.00 -1.14 0.00 0.00 41.12 39.94 1j6y n ASP 6 CO 0.00 0.00 0.00 1.67 -1.33 0.00 0.00 177.20 177.54 1j6y n GLN 7 N -0.01 -1.39 -3.56 0.11 7.27 -1.26 -4.94 117.38 113.59 1j6y n GLN 7 Ca 0.00 1.13 -0.26 0.00 0.07 0.00 0.00 57.00 57.93 1j6y n GLN 7 Cb 0.00 -1.63 -0.15 0.00 2.41 0.00 0.00 30.24 30.86 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 -3.39 -0.11 0.77 1.69 0.11 0.14 -4.93 120.40 114.67 1j6y s VAL 8 Ca 0.00 -0.47 -0.11 0.00 -2.93 0.00 0.00 61.98 58.47 1j6y s VAL 8 Cb 0.00 -0.80 0.06 0.00 -1.53 0.00 0.00 36.38 34.10 1j6y s VAL 8 CO 0.00 -0.50 1.09 -0.54 -3.33 0.00 0.00 175.10 171.82 1j6y s LYS 9 N 2.15 2.28 0.00 1.54 1.02 -1.25 -2.82 119.74 122.65 1j6y s LYS 9 Ca 0.06 0.62 0.00 0.00 0.02 0.00 0.00 55.97 56.68 1j6y s LYS 9 Cb -0.16 -1.94 0.00 0.00 -0.52 0.00 0.00 37.83 35.21 1j6y s LYS 9 CO -0.24 -1.48 0.00 0.00 -0.92 0.00 0.00 175.35 172.71 1j6y n ALA 10 N -3.33 0.00 -4.28 5.17 0.00 -1.11 -4.88 120.51 112.08 1j6y n ALA 10 Ca 0.07 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.32 1j6y n ALA 10 Cb 0.56 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.97 1j6y n ALA 10 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1j6y n SER 11 N 0.00 1.99 -3.58 0.00 3.41 -0.59 -0.31 113.62 114.54 1j6y n SER 11 Ca 0.00 -2.37 -0.05 0.00 -0.26 0.00 0.00 58.87 56.19 1j6y n SER 11 Cb 0.00 0.43 -0.02 0.00 -0.26 0.00 0.00 64.21 64.37 1j6y n SER 11 CO 0.00 0.00 0.00 -1.38 -0.16 0.00 0.00 175.04 173.50 1j6y s HIS 12 N -2.32 -0.18 0.34 7.33 -3.43 -1.20 -2.85 115.29 112.99 1j6y s HIS 12 Ca 0.07 0.09 -0.00 0.00 -0.80 0.00 0.00 55.06 54.41 1j6y s HIS 12 Cb 0.00 0.53 -0.00 0.00 -1.43 0.00 0.00 32.58 31.68 1j6y s HIS 12 CO 0.05 -0.33 0.44 0.42 -2.00 0.00 0.00 174.74 173.32 1j6y s ILE 13 N -2.64 0.00 0.04 -5.38 1.01 -0.68 -4.69 121.20 108.87 1j6y s ILE 13 Ca 0.09 -1.68 0.00 0.00 0.00 0.00 0.00 60.65 59.06 1j6y s ILE 13 Cb -0.00 -2.63 -0.03 0.00 0.01 0.00 0.00 42.46 39.81 1j6y s ILE 13 CO -0.05 0.00 -0.04 -0.22 0.00 0.00 0.00 174.94 174.63 1j6y s LEU 14 N -3.27 2.35 0.00 2.97 2.96 -0.97 -2.43 118.68 120.30 1j6y s LEU 14 Ca 0.33 -0.71 0.00 0.00 -0.22 0.00 0.00 54.13 53.52 1j6y s LEU 14 Cb 0.00 0.08 0.00 0.00 0.50 0.00 0.00 46.19 46.77 1j6y s LEU 14 CO 0.22 -0.40 0.06 -0.38 -1.32 0.00 0.00 176.35 174.53 1j6y n ILE 15 N 0.95 0.00 -1.24 6.68 5.41 -1.00 -3.94 119.36 126.22 1j6y n ILE 15 Ca -0.20 -0.36 0.15 0.00 1.00 0.00 0.00 62.75 63.35 1j6y n ILE 15 Cb 0.57 1.04 -0.08 0.00 -0.71 0.00 0.00 39.64 40.47 1j6y n ILE 15 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 1j6y n LYS 16 N -0.61 -2.85 0.00 0.38 5.02 -1.26 -4.92 118.16 113.92 1j6y n LYS 16 Ca 0.00 2.32 0.00 0.00 -2.02 0.00 0.00 58.31 58.61 1j6y n LYS 16 Cb 0.01 -3.34 0.00 0.00 -0.02 0.00 0.00 35.03 31.69 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 -4.01 0.00 -3.49 2.13 1.44 -1.26 -4.75 115.22 105.27 1j6y n HIS 17 Ca -0.08 0.00 -0.42 0.00 -2.01 0.00 0.00 57.72 55.21 1j6y n HIS 17 Cb 0.59 0.00 -0.05 0.00 0.12 0.00 0.00 29.99 30.65 1j6y n HIS 17 CO 0.00 0.00 0.00 -0.65 -2.81 0.00 0.00 176.34 172.88 1j6y s GLN 18 N 4.05 3.34 -0.37 -1.40 -1.52 -1.11 -4.74 119.66 117.90 1j6y s GLN 18 Ca 0.00 -2.72 0.06 0.00 -1.95 0.00 0.00 55.36 50.75 1j6y s GLN 18 Cb 0.00 -4.17 0.44 0.00 -0.22 0.00 0.00 33.01 29.06 1j6y s GLN 18 CO 0.00 -1.25 1.19 0.41 -0.25 0.00 0.00 175.29 175.39 1j6y n GLY 19 N 3.38 6.22 3.33 3.09 0.00 -1.26 -4.39 105.19 115.57 1j6y n GLY 19 Ca 0.15 -2.70 -0.15 0.00 0.00 0.00 0.00 46.02 43.31 1j6y n GLY 19 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1j6y n SER 20 N -0.62 -6.52 -1.95 1.61 2.88 -1.26 -5.01 113.62 102.76 1j6y n SER 20 Ca 0.43 -0.28 -0.08 0.00 -1.33 0.00 0.00 58.87 57.61 1j6y n SER 20 Cb 0.82 -3.59 -0.03 0.00 -0.75 0.00 0.00 64.21 60.67 1j6y n SER 20 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1j6y n ARG 21 N -1.58 0.23 0.00 -1.46 1.74 -1.26 -5.06 116.66 109.27 1j6y n ARG 21 Ca -0.10 -1.39 0.00 0.00 -0.77 0.00 0.00 57.85 55.59 1j6y n ARG 21 Cb 0.59 1.20 0.00 0.00 -1.02 0.00 0.00 32.46 33.23 1j6y n ARG 21 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1j6y n ARG 22 N -0.27 0.63 -3.61 5.56 5.12 -1.26 -5.02 116.66 117.80 1j6y n ARG 22 Ca 0.02 -0.71 -0.22 0.00 -1.93 0.00 0.00 57.85 55.01 1j6y n ARG 22 Cb 0.26 -0.80 0.04 0.00 -1.16 0.00 0.00 32.46 30.81 1j6y n ARG 22 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 1j6y n LYS 23 N -0.15 -3.90 -3.41 5.56 5.02 -1.26 -4.84 118.16 115.17 1j6y n LYS 23 Ca 0.00 0.64 -0.27 0.00 -2.02 0.00 0.00 58.31 56.67 1j6y n LYS 23 Cb 0.23 -5.12 -0.11 0.00 -0.02 0.00 0.00 35.03 30.01 1j6y n LYS 23 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1j6y s ALA 24 N -3.57 0.85 -0.40 7.82 0.00 -1.26 -4.58 121.76 120.62 1j6y s ALA 24 Ca 0.16 -1.91 0.09 0.00 0.00 0.00 0.00 51.96 50.30 1j6y s ALA 24 Cb -0.04 -1.67 0.32 0.00 0.00 0.00 0.00 23.12 21.72 1j6y s ALA 24 CO 0.81 -2.07 0.79 0.45 0.00 0.00 0.00 175.76 175.73 1j6y n SER 25 N 3.67 -0.27 0.00 0.00 2.88 -1.26 -5.11 113.62 113.53 1j6y n SER 25 Ca 0.18 -3.12 0.00 0.00 -1.33 0.00 0.00 58.87 54.59 1j6y n SER 25 Cb 0.42 0.12 0.00 0.00 -0.75 0.00 0.00 64.21 63.99 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 0.62 0.00 -3.26 0.66 5.03 -1.26 -5.05 117.44 114.18 1j6y n TRP 26 Ca 0.19 0.00 -0.25 0.00 3.03 0.00 0.00 57.50 60.47 1j6y n TRP 26 Cb 0.64 0.00 -0.07 0.00 -1.03 0.00 0.00 31.31 30.85 1j6y n TRP 26 CO 0.00 0.00 0.00 0.36 -0.03 0.00 0.00 177.69 178.02 1j6y n LYS 27 N 0.00 1.29 0.00 -0.99 2.85 -1.26 -4.86 118.16 115.20 1j6y n LYS 27 Ca 0.00 -3.68 0.00 0.00 -1.05 0.00 0.00 58.31 53.58 1j6y n LYS 27 Cb 0.00 -1.55 0.00 0.00 -0.65 0.00 0.00 35.03 32.83 1j6y n LYS 27 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1j6y n ASP 28 N 1.21 0.00 -4.11 -5.58 8.00 -1.26 -5.04 116.55 109.78 1j6y n ASP 28 Ca 0.24 0.00 -0.36 0.00 0.71 0.00 0.00 54.79 55.38 1j6y n ASP 28 Cb 0.49 0.00 -0.06 0.00 -0.02 0.00 0.00 41.12 41.53 1j6y n ASP 28 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 1j6y n PRO 29 N 0.00 1.51 -0.25 -0.24 -0.04 -1.26 -4.76 135.00 129.96 1j6y n PRO 29 Ca 0.00 -2.14 0.02 0.00 -0.04 0.00 0.00 63.50 61.33 1j6y n PRO 29 Cb 0.00 -3.32 0.09 0.00 -0.04 0.00 0.00 33.50 30.23 1j6y n PRO 29 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 1j6y h GLU 30 N 8.88 0.01 0.00 0.54 4.81 -1.96 -3.45 114.58 123.41 1j6y h GLU 30 Ca 0.31 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.54 1j6y h GLU 30 Cb 0.81 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.18 1j6y h GLU 30 CO 1.59 0.01 0.00 0.41 -0.73 0.00 0.00 179.01 180.29 1j6y n GLY 31 N -1.47 1.13 0.00 1.92 0.00 -1.26 -4.82 105.19 100.70 1j6y n GLY 31 Ca 0.10 -2.14 0.00 0.00 0.00 0.00 0.00 46.02 43.98 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 -1.44 0.00 -0.17 1.61 3.00 -1.26 -5.07 118.16 114.83 1j6y n LYS 32 Ca 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 58.31 58.32 1j6y n LYS 32 Cb 0.00 0.00 0.02 0.00 0.00 0.00 0.00 35.03 35.05 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 0.00 0.40 -0.51 3.15 3.06 -1.26 -5.07 119.36 119.13 1j6y n ILE 33 Ca 0.00 -0.44 0.00 0.00 -2.50 0.00 0.00 62.75 59.81 1j6y n ILE 33 Cb 0.00 0.60 0.00 0.00 0.54 0.00 0.00 39.64 40.78 1j6y n ILE 33 CO 0.00 0.00 0.00 2.30 -2.50 0.00 0.00 176.55 176.35 1j6y n ILE 34 N -0.26 0.00 -3.69 9.51 -5.35 -1.26 -5.12 119.36 113.18 1j6y n ILE 34 Ca 0.02 0.00 -0.11 0.00 -0.27 0.00 0.00 62.75 62.40 1j6y n ILE 34 Cb 0.54 0.00 -0.10 0.00 -1.74 0.00 0.00 39.64 38.34 1j6y n ILE 34 CO 0.00 0.00 0.00 -0.22 -1.76 0.00 0.00 176.55 174.57 1j6y s LEU 35 N 0.00 -0.10 0.00 7.28 0.20 -1.26 -5.16 118.68 119.64 1j6y s LEU 35 Ca 0.00 0.94 0.00 0.00 0.69 0.00 0.00 54.13 55.76 1j6y s LEU 35 Cb 0.00 1.44 0.00 0.00 -0.43 0.00 0.00 46.19 47.20 1j6y s LEU 35 CO 0.00 -0.19 0.00 1.07 -0.29 0.00 0.00 176.35 176.94 1j6y n THR 36 N 4.08 0.00 -1.55 3.68 5.66 -1.26 -5.04 114.28 119.85 1j6y n THR 36 Ca -0.22 0.00 -0.51 0.00 -3.05 0.00 0.00 64.05 60.27 1j6y n THR 36 Cb 0.56 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.29 1j6y n THR 36 CO 0.00 0.00 0.00 0.41 -3.05 0.00 0.00 175.07 172.43 1j6y n THR 37 N 0.00 0.60 -3.92 1.09 -1.04 -1.26 -4.92 114.28 104.83 1j6y n THR 37 Ca 0.00 -0.15 -0.02 0.00 -2.04 0.00 0.00 64.05 61.84 1j6y n THR 37 Cb 0.00 -0.62 -0.00 0.00 -1.82 0.00 0.00 70.33 67.89 1j6y n THR 37 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 1j6y n THR 38 N 1.63 0.00 0.06 12.58 -2.24 -1.26 -2.77 114.28 122.28 1j6y n THR 38 Ca 0.17 -0.11 -0.05 0.00 -2.27 0.00 0.00 64.05 61.79 1j6y n THR 38 Cb 0.20 -0.09 -0.03 0.00 -2.10 0.00 0.00 70.33 68.32 1j6y n THR 38 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 1j6y h ARG 39 N 0.00 -0.23 0.13 -0.78 1.12 -1.90 0.69 114.38 113.41 1j6y h ARG 39 Ca -0.02 0.02 0.01 0.00 -1.11 0.00 0.00 59.98 58.87 1j6y h ARG 39 Cb 0.06 0.05 -0.04 0.00 -0.01 0.00 0.00 29.97 30.04 1j6y h ARG 39 CO 0.03 -0.15 -0.42 1.49 -3.11 0.00 0.00 179.97 177.81 1j6y h GLU 40 N -0.24 -0.60 -0.78 0.20 4.81 -1.97 -1.96 114.58 114.04 1j6y h GLU 40 Ca -0.01 0.04 0.15 0.00 -0.13 0.00 0.00 59.36 59.41 1j6y h GLU 40 Cb 0.22 0.14 -0.15 0.00 0.63 0.00 0.00 28.75 29.59 1j6y h GLU 40 CO -0.04 -0.40 -0.24 0.00 -0.73 0.00 0.00 179.01 177.60 1j6y h ALA 41 N -0.79 0.40 -0.28 2.92 0.00 -1.93 0.59 119.26 120.17 1j6y h ALA 41 Ca -0.01 0.29 0.00 0.00 0.00 0.00 0.00 54.91 55.18 1j6y h ALA 41 Cb 0.61 0.67 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1j6y h ALA 41 CO -0.21 -0.47 0.00 0.00 0.00 0.00 0.00 179.25 178.57 1j6y n ALA 42 N -3.31 -0.08 -0.17 0.00 0.00 0.24 0.21 120.51 117.40 1j6y n ALA 42 Ca 0.10 0.00 0.26 0.00 0.00 0.00 0.00 53.44 53.80 1j6y n ALA 42 Cb 0.40 0.40 0.67 0.00 0.00 0.00 0.00 19.45 20.92 1j6y n ALA 42 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1j6y h VAL 43 N 0.00 0.60 0.09 0.00 2.07 -1.12 0.55 116.25 118.44 1j6y h VAL 43 Ca 0.00 -0.03 -0.00 0.00 0.82 0.00 0.00 66.70 67.48 1j6y h VAL 43 Cb 0.00 0.50 0.00 0.00 -1.52 0.00 0.00 31.29 30.27 1j6y h VAL 43 CO 0.00 0.02 -0.04 -0.08 0.02 0.00 0.00 177.57 177.48 1j6y h GLU 44 N 0.09 -0.12 -0.53 1.57 4.81 0.27 -0.75 114.58 119.93 1j6y h GLU 44 Ca 0.42 0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.61 1j6y h GLU 44 Cb 1.52 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.90 1j6y h GLU 44 CO -0.05 0.23 0.15 0.37 -0.73 0.00 0.00 179.01 178.99 1j6y h GLN 45 N -0.48 0.79 0.00 1.92 -0.00 0.49 0.76 115.11 118.59 1j6y h GLN 45 Ca -0.01 -0.14 0.00 0.00 -0.00 0.00 0.00 58.65 58.49 1j6y h GLN 45 Cb 0.40 -0.13 0.00 0.00 0.00 0.00 0.00 27.48 27.75 1j6y h GLN 45 CO 0.02 0.69 0.00 1.25 0.00 0.00 0.00 178.83 180.79 1j6y h LEU 46 N 0.77 0.00 0.05 -2.39 7.12 0.17 0.20 115.31 121.23 1j6y h LEU 46 Ca 0.17 0.00 -0.13 0.00 0.13 0.00 0.00 57.88 58.06 1j6y h LEU 46 Cb 0.24 0.00 0.01 0.00 -0.53 0.00 0.00 40.66 40.38 1j6y h LEU 46 CO -0.01 0.00 -0.53 0.50 -0.13 0.00 0.00 178.44 178.27 1j6y h LYS 47 N 0.00 0.26 0.00 1.25 3.64 0.69 -3.13 116.57 119.29 1j6y h LYS 47 Ca 0.00 -0.36 -0.06 0.00 -1.27 0.00 0.00 60.65 58.96 1j6y h LYS 47 Cb 0.29 0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.22 1j6y h LYS 47 CO 0.00 1.10 -0.37 0.66 -2.27 0.00 0.00 179.45 178.57 1j6y h SER 48 N -0.40 0.00 -0.12 4.20 4.64 -1.13 -2.95 113.55 117.79 1j6y h SER 48 Ca -0.08 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.21 1j6y h SER 48 Cb 1.33 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.42 1j6y h SER 48 CO 0.10 0.27 -0.02 -0.29 -0.87 0.00 0.00 176.83 176.02 1j6y h ILE 49 N 0.00 1.28 -0.04 0.95 -0.00 -0.69 1.81 117.51 120.82 1j6y h ILE 49 Ca -0.01 -0.94 -0.08 0.00 -0.00 0.00 0.00 64.86 63.83 1j6y h ILE 49 Cb 1.22 1.67 -0.01 0.00 -0.00 0.00 0.00 36.82 39.69 1j6y h ILE 49 CO 0.03 0.27 -0.34 0.08 -0.00 0.00 0.00 178.15 178.19 1j6y h ARG 50 N -0.08 0.07 0.10 2.19 -0.00 -1.63 0.18 114.38 115.21 1j6y h ARG 50 Ca 0.03 -0.03 -0.01 0.00 -0.00 0.00 0.00 59.98 59.98 1j6y h ARG 50 Cb 0.43 -0.00 0.00 0.00 -0.00 0.00 0.00 29.97 30.40 1j6y h ARG 50 CO 0.01 0.41 -0.05 1.49 -0.00 0.00 0.00 179.97 181.83 1j6y h GLU 51 N 0.06 -0.14 -0.04 0.08 4.57 -1.28 -0.37 114.58 117.46 1j6y h GLU 51 Ca 0.01 0.01 0.04 0.00 -1.18 0.00 0.00 59.36 58.23 1j6y h GLU 51 Cb 0.64 0.03 -0.05 0.00 -0.16 0.00 0.00 28.75 29.22 1j6y h GLU 51 CO 0.05 0.36 -0.25 0.22 -1.18 0.00 0.00 179.01 178.21 1j6y h ASP 52 N -0.87 -0.74 0.08 1.04 3.58 0.29 0.43 116.42 120.23 1j6y h ASP 52 Ca -0.01 0.11 -0.01 0.00 0.42 0.00 0.00 57.03 57.54 1j6y h ASP 52 Cb 0.56 0.31 -0.00 0.00 1.72 0.00 0.00 39.33 41.92 1j6y h ASP 52 CO 0.02 -0.31 -0.03 0.40 -2.88 0.00 0.00 179.24 176.45 1j6y h ILE 53 N -0.36 0.53 0.28 2.25 2.04 -1.05 -2.12 117.51 119.09 1j6y h ILE 53 Ca 0.07 -0.12 -0.01 0.00 1.00 0.00 0.00 64.86 65.80 1j6y h ILE 53 Cb 0.46 1.08 0.00 0.00 -0.74 0.00 0.00 36.82 37.63 1j6y h ILE 53 CO -0.25 0.03 -0.14 0.58 0.00 0.00 0.00 178.15 178.37 1j6y h VAL 54 N 0.00 0.75 -2.93 1.67 2.07 0.16 -3.43 116.25 114.55 1j6y h VAL 54 Ca -0.00 -0.46 -0.63 0.00 0.82 0.00 0.00 66.70 66.44 1j6y h VAL 54 Cb 0.08 1.00 -0.07 0.00 -1.52 0.00 0.00 31.29 30.78 1j6y h VAL 54 CO 0.00 0.09 -0.32 -0.44 0.02 0.00 0.00 177.57 176.93 1j6y s SER 55 N -5.05 6.60 0.01 0.57 0.01 -0.10 -4.82 113.70 110.92 1j6y s SER 55 Ca -0.15 0.71 0.00 0.00 1.31 0.00 0.00 55.95 57.82 1j6y s SER 55 Cb 0.03 -2.18 0.00 0.00 0.21 0.00 0.00 66.02 64.08 1j6y s SER 55 CO 0.59 0.32 0.00 0.61 0.41 0.00 0.00 173.24 175.16 1j6y n GLY 56 N 2.15 -3.24 2.60 3.44 0.00 -1.26 -4.61 105.19 104.27 1j6y n GLY 56 Ca -0.16 -0.60 -0.08 0.00 0.00 0.00 0.00 46.02 45.18 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 0.12 0.84 -1.14 1.61 3.00 -1.26 -4.72 118.16 116.61 1j6y n LYS 57 Ca 0.00 -0.67 -0.35 0.00 -0.00 0.00 0.00 58.31 57.29 1j6y n LYS 57 Cb 0.00 -1.96 0.09 0.00 0.00 0.00 0.00 35.03 33.16 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 3.81 -1.40 -1.00 3.14 0.00 -1.26 -4.98 120.51 118.82 1j6y n ALA 58 Ca 0.18 -0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.28 1j6y n ALA 58 Cb 0.16 -1.93 0.00 0.00 0.00 0.00 0.00 19.45 17.67 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 -1.14 -0.30 0.00 0.00 4.13 -1.26 -5.02 115.26 111.66 1j6y n ASN 59 Ca 0.10 -0.08 0.00 0.00 1.68 0.00 0.00 54.58 56.28 1j6y n ASN 59 Cb 0.51 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.75 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 -1.12 0.00 0.00 3.10 -0.00 -1.26 -4.94 117.46 113.25 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 -0.82 0.00 -0.30 -4.13 1.02 -1.26 -0.30 120.64 114.85 1j6y n GLU 61 Ca 0.00 0.02 0.08 0.00 -0.02 0.00 0.00 57.16 57.23 1j6y n GLU 61 Cb 0.00 -0.88 0.19 0.00 -0.02 0.00 0.00 31.44 30.73 1j6y n GLU 61 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 1j6y h GLU 62 N 0.00 0.05 -0.91 3.49 4.81 -1.96 1.10 114.58 121.16 1j6y h GLU 62 Ca 0.00 -0.00 0.08 0.00 -0.13 0.00 0.00 59.36 59.31 1j6y h GLU 62 Cb 0.00 -0.01 -0.07 0.00 0.63 0.00 0.00 28.75 29.30 1j6y h GLU 62 CO 0.00 0.03 0.56 -0.24 -0.73 0.00 0.00 179.01 178.64 1j6y h VAL 63 N 0.05 0.99 0.12 0.32 3.04 -1.92 -2.66 116.25 116.20 1j6y h VAL 63 Ca 0.47 -0.33 -0.01 0.00 -1.01 0.00 0.00 66.70 65.82 1j6y h VAL 63 Cb 0.86 -0.07 0.00 0.00 -2.01 0.00 0.00 31.29 30.07 1j6y h VAL 63 CO -0.80 0.18 -0.06 0.00 -1.01 0.00 0.00 177.57 175.88 1j6y h ALA 64 N 1.45 -0.16 -0.98 3.17 0.00 0.40 -2.19 119.26 120.96 1j6y h ALA 64 Ca 0.42 -0.25 0.28 0.00 0.00 0.00 0.00 54.91 55.36 1j6y h ALA 64 Cb 0.28 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.09 1j6y h ALA 64 CO -0.21 -0.25 1.11 1.79 0.00 0.00 0.00 179.25 181.68 1j6y h THR 65 N -0.83 0.06 0.00 0.00 1.35 0.23 -1.96 112.91 111.77 1j6y h THR 65 Ca -0.02 0.00 -0.01 0.00 -0.55 0.00 0.00 66.41 65.83 1j6y h THR 65 Cb 0.56 0.11 -0.00 0.00 -1.73 0.00 0.00 68.15 67.08 1j6y h THR 65 CO 0.03 0.00 -0.81 -1.14 -0.25 0.00 0.00 175.52 173.35 1j6y n ARG 66 N -3.35 0.50 -2.66 4.72 3.00 -1.03 -4.33 116.66 113.52 1j6y n ARG 66 Ca 0.22 0.36 -0.42 0.00 -0.00 0.00 0.00 57.85 58.00 1j6y n ARG 66 Cb 1.41 -1.55 0.01 0.00 0.00 0.00 0.00 32.46 32.32 1j6y n ARG 66 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.63 179.18 1j6y n VAL 67 N -4.53 5.05 -4.48 5.15 3.14 -0.78 -4.92 118.33 116.97 1j6y n VAL 67 Ca -0.12 -5.28 -0.25 0.00 -2.96 0.00 0.00 64.34 55.74 1j6y n VAL 67 Cb 0.41 -2.13 -0.08 0.00 -1.06 0.00 0.00 33.84 30.98 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 -0.67 2.61 -0.92 6.55 1.04 -0.94 -2.28 113.70 119.09 1j6y s SER 68 Ca 0.36 -1.69 -0.18 0.00 0.48 0.00 0.00 55.95 54.93 1j6y s SER 68 Cb 0.09 0.52 -0.11 0.00 0.10 0.00 0.00 66.02 66.62 1j6y s SER 68 CO 0.04 -0.95 2.03 -0.67 0.98 0.00 0.00 173.24 174.66 1j6y n ASP 69 N -1.34 3.25 0.00 7.02 2.03 -1.26 -4.57 116.55 121.69 1j6y n ASP 69 Ca -0.04 -2.64 0.00 0.00 0.52 0.00 0.00 54.79 52.63 1j6y n ASP 69 Cb 0.65 -1.20 0.00 0.00 -0.72 0.00 0.00 41.12 39.84 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 -0.41 -0.92 0.00 0.87 -1.97 2.26 113.55 113.38 1j6y h SER 71 Ca 0.00 0.22 0.19 0.00 -1.23 0.00 0.00 61.79 60.97 1j6y h SER 71 Cb 0.00 0.39 -0.07 0.00 -0.44 0.00 0.00 62.40 62.28 1j6y h SER 71 CO 0.00 -0.23 0.60 0.28 -0.53 0.00 0.00 176.83 176.95 1j6y h SER 72 N 0.08 0.51 -1.00 6.23 0.02 -1.44 1.05 113.55 118.99 1j6y h SER 72 Ca 0.46 0.05 0.25 0.00 -0.84 0.00 0.00 61.79 61.71 1j6y h SER 72 Cb 0.85 -0.04 -0.09 0.00 0.14 0.00 0.00 62.40 63.26 1j6y h SER 72 CO -0.75 0.21 0.65 0.00 -1.14 0.00 0.00 176.83 175.80 1j6y h ALA 73 N 1.61 2.21 0.00 3.77 0.00 0.36 2.86 119.26 130.07 1j6y h ALA 73 Ca 0.49 0.05 -0.15 0.00 0.00 0.00 0.00 54.91 55.29 1j6y h ALA 73 Cb 1.06 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 1j6y h ALA 73 CO -0.21 -0.58 -0.71 -0.22 0.00 0.00 0.00 179.25 177.53 1j6y h LYS 74 N 0.41 0.00 -1.91 0.00 3.11 0.12 -3.34 116.57 114.97 1j6y h LYS 74 Ca 0.56 0.00 -0.56 0.00 -2.81 0.00 0.00 60.65 57.84 1j6y h LYS 74 Cb 1.39 0.00 -0.42 0.00 -1.00 0.00 0.00 32.23 32.20 1j6y h LYS 74 CO -0.26 0.71 -0.79 0.54 -2.81 0.00 0.00 179.45 176.84 1j6y n ARG 75 N -3.32 2.82 0.02 1.90 1.74 0.70 -4.84 116.66 115.68 1j6y n ARG 75 Ca 0.01 -4.43 0.09 0.00 -0.77 0.00 0.00 57.85 52.75 1j6y n ARG 75 Cb 0.81 -2.09 0.37 0.00 -1.02 0.00 0.00 32.46 30.53 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 -0.23 -1.11 0.00 -0.13 0.00 0.80 -4.33 105.19 100.18 1j6y n GLY 76 Ca 0.31 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.29 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 0.21 -0.40 3.53 -0.02 0.00 -1.26 -4.55 105.19 102.69 1j6y n GLY 77 Ca 0.04 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.94 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 -1.57 0.33 -0.08 1.61 -4.77 -1.26 -3.23 116.67 107.69 1j6y s ASP 78 Ca 0.00 -1.20 -0.18 0.00 -3.30 0.00 0.00 52.55 47.87 1j6y s ASP 78 Cb 0.00 0.61 -0.14 0.00 -1.09 0.00 0.00 42.92 42.30 1j6y s ASP 78 CO 0.00 -1.20 0.63 -0.07 0.70 0.00 0.00 175.17 175.23 1j6y h LEU 79 N 2.22 -0.11 0.00 2.11 4.07 -0.97 -3.47 115.31 119.16 1j6y h LEU 79 Ca -0.28 -0.40 0.00 0.00 0.08 0.00 0.00 57.88 57.28 1j6y h LEU 79 Cb 1.25 0.03 0.00 0.00 1.08 0.00 0.00 40.66 43.01 1j6y h LEU 79 CO 0.39 0.53 0.00 0.61 -1.08 0.00 0.00 178.44 178.88 1j6y n GLY 80 N 1.10 2.06 3.33 0.83 0.00 -1.06 -4.96 105.19 106.48 1j6y n GLY 80 Ca -0.06 -0.64 -0.11 0.00 0.00 0.00 0.00 46.02 45.20 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 -0.53 0.00 1.61 1.04 -1.26 -2.75 113.70 107.81 1j6y s SER 81 Ca 0.00 0.94 0.00 0.00 0.48 0.00 0.00 55.95 57.37 1j6y s SER 81 Cb 0.00 0.87 0.00 0.00 0.10 0.00 0.00 66.02 66.99 1j6y s SER 81 CO 0.00 -0.18 0.00 2.22 0.98 0.00 0.00 173.24 176.26 1j6y n PHE 82 N 3.68 0.00 0.00 5.02 -1.74 -1.13 -4.92 117.46 118.37 1j6y n PHE 82 Ca -0.19 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.70 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 -0.82 3.62 4.97 0.00 -1.26 0.24 105.19 111.95 1j6y n GLY 83 Ca 0.00 0.29 -0.39 0.00 0.00 0.00 0.00 46.02 45.92 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 4.06 0.00 1.61 1.81 -1.26 -4.41 118.95 120.76 1j6y s ARG 84 Ca 0.00 0.07 0.00 0.00 -1.72 0.00 0.00 55.73 54.08 1j6y s ARG 84 Cb 0.00 -3.62 0.00 0.00 -0.45 0.00 0.00 34.95 30.88 1j6y s ARG 84 CO 0.00 -0.20 0.00 0.41 -0.68 0.00 0.00 175.30 174.83 1j6y n GLY 85 N 4.47 2.92 3.54 -3.53 0.00 -1.26 -5.05 105.19 106.27 1j6y n GLY 85 Ca -0.09 -0.78 -0.30 0.00 0.00 0.00 0.00 46.02 44.86 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 -1.21 2.47 1.61 -0.21 -1.26 -4.80 119.66 116.25 1j6y s GLN 86 Ca 0.00 0.21 0.00 0.00 0.02 0.00 0.00 55.36 55.59 1j6y s GLN 86 Cb 0.00 -1.57 0.00 0.00 1.00 0.00 0.00 33.01 32.44 1j6y s GLN 86 CO 0.00 -3.76 0.00 -1.33 -2.12 0.00 0.00 175.29 168.08 1j6y n MET 87 N -4.84 0.00 0.06 2.91 2.81 -1.26 -4.80 117.12 111.99 1j6y n MET 87 Ca 0.10 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.99 1j6y n MET 87 Cb 0.58 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 33.09 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 -0.04 0.00 0.00 0.03 7.27 -1.26 -5.08 117.38 118.31 1j6y n GLN 88 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.07 1j6y n GLN 88 Cb 0.00 -0.35 0.00 0.00 2.41 0.00 0.00 30.24 32.30 1j6y n GLN 88 CO 0.00 0.00 0.00 1.17 0.07 0.00 0.00 177.06 178.30 1j6y n LYS 89 N -3.33 0.00 0.00 3.69 0.00 -1.26 -4.96 118.16 112.31 1j6y n LYS 89 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 58.31 58.28 1j6y n LYS 89 Cb 0.09 0.00 0.22 0.00 0.00 0.00 0.00 35.03 35.34 1j6y n LYS 89 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.40 176.40 1j6y h PRO 90 N 0.00 0.52 0.87 1.64 0.13 -1.98 -2.93 132.00 130.24 1j6y h PRO 90 Ca 0.00 -0.17 -0.04 0.00 -0.87 0.00 0.00 66.00 64.92 1j6y h PRO 90 Cb 0.00 -0.04 0.01 0.00 0.13 0.00 0.00 31.00 31.09 1j6y h PRO 90 CO 0.00 0.68 -0.42 0.35 -0.23 0.00 0.00 178.00 178.38 1j6y h PHE 91 N 0.47 -1.08 -0.68 1.56 3.04 -1.94 -2.42 116.94 115.89 1j6y h PHE 91 Ca 0.08 -0.03 0.09 0.00 3.98 0.00 0.00 57.97 62.09 1j6y h PHE 91 Cb 0.58 0.36 -0.11 0.00 2.56 0.00 0.00 35.95 39.33 1j6y h PHE 91 CO 0.02 -0.67 -0.48 0.93 -2.02 0.00 0.00 178.31 176.09 1j6y h GLU 92 N -1.28 -0.18 -1.06 1.11 5.08 -1.94 2.10 114.58 118.42 1j6y h GLU 92 Ca -0.12 0.01 0.31 0.00 -1.00 0.00 0.00 59.36 58.56 1j6y h GLU 92 Cb 0.89 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 30.14 1j6y h GLU 92 CO 0.20 -0.12 0.82 0.93 -1.00 0.00 0.00 179.01 179.84 1j6y h GLU 93 N -0.18 0.00 0.62 2.33 5.08 -1.48 1.02 114.58 121.97 1j6y h GLU 93 Ca 0.18 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.51 1j6y h GLU 93 Cb 0.54 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.80 1j6y h GLU 93 CO -0.76 0.00 -0.30 0.00 -1.00 0.00 0.00 179.01 176.95 1j6y h ALA 94 N 1.36 -0.90 0.00 3.43 0.00 0.39 0.70 119.26 124.25 1j6y h ALA 94 Ca 0.50 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 55.16 1j6y h ALA 94 Cb 2.14 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 20.24 1j6y h ALA 94 CO -0.01 -0.84 -0.34 1.15 0.00 0.00 0.00 179.25 179.22 1j6y h THR 95 N -1.13 1.16 0.00 0.00 2.02 -0.58 0.34 112.91 114.73 1j6y h THR 95 Ca -0.08 -1.21 -0.09 0.00 0.77 0.00 0.00 66.41 65.80 1j6y h THR 95 Cb 0.64 1.67 -0.01 0.00 -1.74 0.00 0.00 68.15 68.70 1j6y h THR 95 CO 0.14 0.34 -0.42 1.88 0.37 0.00 0.00 175.52 177.82 1j6y h TYR 96 N 0.00 0.00 0.01 3.16 0.05 0.11 -3.30 116.97 117.00 1j6y h TYR 96 Ca -0.00 0.00 -0.12 0.00 0.05 0.00 0.00 58.73 58.66 1j6y h TYR 96 Cb 0.64 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.37 1j6y h TYR 96 CO 0.00 0.42 -0.63 0.00 -1.05 0.00 0.00 178.16 176.90 1j6y h ALA 97 N 1.58 0.12 -2.00 3.88 0.00 0.13 -3.42 119.26 119.54 1j6y h ALA 97 Ca -0.00 -0.83 -0.72 0.00 0.00 0.00 0.00 54.91 53.35 1j6y h ALA 97 Cb 1.08 0.34 -0.21 0.00 0.00 0.00 0.00 17.79 19.00 1j6y h ALA 97 CO 0.05 0.35 0.10 -1.17 0.00 0.00 0.00 179.25 178.59 1j6y s LEU 98 N -8.02 5.61 0.20 0.00 0.20 0.03 -4.92 118.68 111.77 1j6y s LEU 98 Ca -0.23 -1.62 -0.11 0.00 0.69 0.00 0.00 54.13 52.86 1j6y s LEU 98 Cb 0.01 -2.29 0.22 0.00 -0.43 0.00 0.00 46.19 43.71 1j6y s LEU 98 CO 0.66 -1.03 1.76 0.07 -0.29 0.00 0.00 176.35 177.52 1j6y h LYS 99 N 9.01 0.45 0.00 1.98 2.10 -1.83 -3.44 116.57 124.85 1j6y h LYS 99 Ca -0.24 -0.03 0.00 0.00 -2.00 0.00 0.00 60.65 58.38 1j6y h LYS 99 Cb 1.08 -0.10 0.00 0.00 -0.90 0.00 0.00 32.23 32.31 1j6y h LYS 99 CO 1.07 0.30 0.00 0.28 -2.00 0.00 0.00 179.45 179.09 1j6y n VAL 100 N -4.94 0.00 -0.52 0.07 0.31 -1.26 -4.75 118.33 107.24 1j6y n VAL 100 Ca 0.07 0.00 0.44 0.00 -0.01 0.00 0.00 64.34 64.84 1j6y n VAL 100 Cb 0.21 0.00 0.67 0.00 -0.91 0.00 0.00 33.84 33.81 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 0.00 -0.89 0.00 2.92 0.00 -1.26 -4.33 105.19 101.63 1j6y n GLY 101 Ca 0.00 0.56 0.00 0.00 0.00 0.00 0.00 46.02 46.58 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 -3.64 0.00 -3.19 1.61 8.00 -1.26 -5.03 116.55 113.04 1j6y n ASP 102 Ca 0.36 0.00 -0.23 0.00 0.71 0.00 0.00 54.79 55.64 1j6y n ASP 102 Cb 1.82 0.00 -0.05 0.00 -0.02 0.00 0.00 41.12 42.87 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 0.42 -1.80 0.53 5.41 -1.26 -4.61 119.36 118.05 1j6y n ILE 103 Ca 0.00 -4.60 0.00 0.00 1.00 0.00 0.00 62.75 59.15 1j6y n ILE 103 Cb 0.00 -1.27 -0.00 0.00 -0.71 0.00 0.00 39.64 37.66 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 0.69 -2.33 -3.41 4.38 2.88 -1.26 -4.73 113.62 109.84 1j6y n SER 104 Ca 0.25 0.04 0.02 0.00 -1.33 0.00 0.00 58.87 57.85 1j6y n SER 104 Cb 0.54 -0.13 -0.03 0.00 -0.75 0.00 0.00 64.21 63.84 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 -3.96 -0.93 0.00 -3.46 -4.77 -1.26 -4.99 116.67 97.30 1j6y s ASP 105 Ca 0.00 1.02 0.00 0.00 -3.30 0.00 0.00 52.55 50.27 1j6y s ASP 105 Cb 0.00 1.96 0.00 0.00 -1.09 0.00 0.00 42.92 43.79 1j6y s ASP 105 CO 0.00 -0.18 0.00 -0.38 0.70 0.00 0.00 175.17 175.31 1j6y n ILE 106 N 5.29 -1.25 -2.11 2.11 5.41 -1.26 -4.82 119.36 122.73 1j6y n ILE 106 Ca -0.08 0.17 -0.39 0.00 1.00 0.00 0.00 62.75 63.45 1j6y n ILE 106 Cb 0.51 -2.45 0.03 0.00 -0.71 0.00 0.00 39.64 37.02 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 1.97 3.86 -1.50 1.39 0.31 -0.97 -4.95 118.33 118.44 1j6y n VAL 107 Ca 0.00 -4.66 -0.43 0.00 -0.01 0.00 0.00 64.34 59.24 1j6y n VAL 107 Cb 0.17 -1.29 -0.08 0.00 -0.91 0.00 0.00 33.84 31.72 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 -0.45 1.67 -0.12 4.52 5.75 -1.26 -2.61 116.55 124.05 1j6y n ASP 108 Ca 0.51 0.02 0.00 0.00 -0.01 0.00 0.00 54.79 55.31 1j6y n ASP 108 Cb 0.28 -1.28 0.00 0.00 -1.03 0.00 0.00 41.12 39.09 1j6y n ASP 108 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 1j6y n THR 109 N 7.57 0.00 -1.09 2.12 -2.24 0.33 -4.92 114.28 116.06 1j6y n THR 109 Ca 0.47 0.00 -0.36 0.00 -2.27 0.00 0.00 64.05 61.89 1j6y n THR 109 Cb 0.28 0.00 0.05 0.00 -2.10 0.00 0.00 70.33 68.57 1j6y n THR 109 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1j6y n ASP 110 N -0.29 -3.73 0.00 3.42 9.92 -1.26 -1.55 116.55 123.06 1j6y n ASP 110 Ca 0.00 0.41 0.00 0.00 -0.53 0.00 0.00 54.79 54.67 1j6y n ASP 110 Cb 0.00 -0.96 0.00 0.00 -0.64 0.00 0.00 41.12 39.52 1j6y n ASP 110 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 1j6y n SER 111 N 1.62 0.00 0.00 -2.24 7.64 -1.26 -4.68 113.62 114.70 1j6y n SER 111 Ca 0.04 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.92 1j6y n SER 111 Cb 0.52 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.72 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 -0.77 3.73 0.23 0.00 -0.59 -4.66 105.19 103.13 1j6y n GLY 112 Ca 0.00 -0.14 -0.35 0.00 0.00 0.00 0.00 46.02 45.53 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 -3.56 5.38 0.54 1.61 -7.23 -1.26 0.12 120.40 115.99 1j6y s VAL 113 Ca 0.00 0.31 0.02 0.00 -1.81 0.00 0.00 61.98 60.50 1j6y s VAL 113 Cb 0.00 -3.52 0.02 0.00 0.56 0.00 0.00 36.38 33.43 1j6y s VAL 113 CO 0.00 0.42 0.16 -1.00 -0.31 0.00 0.00 175.10 174.38 1j6y s HIS 114 N 0.38 1.67 -0.06 2.82 4.02 -1.07 -2.39 115.29 120.66 1j6y s HIS 114 Ca 0.11 -0.95 -0.03 0.00 1.02 0.00 0.00 55.06 55.22 1j6y s HIS 114 Cb -0.12 -1.71 0.04 0.00 -1.02 0.00 0.00 32.58 29.77 1j6y s HIS 114 CO -0.00 -0.09 0.07 0.96 1.02 0.00 0.00 174.74 176.70 1j6y s ILE 115 N -2.86 -0.10 0.33 0.60 -4.36 -1.02 -2.30 121.20 111.49 1j6y s ILE 115 Ca 0.14 0.32 -0.04 0.00 -0.26 0.00 0.00 60.65 60.81 1j6y s ILE 115 Cb -0.01 -0.23 -0.05 0.00 1.25 0.00 0.00 42.46 43.43 1j6y s ILE 115 CO 0.09 0.10 0.58 -0.63 0.24 0.00 0.00 174.94 175.31 1j6y s ILE 116 N 2.16 5.03 -0.14 8.37 1.01 -1.26 -1.68 121.20 134.69 1j6y s ILE 116 Ca 0.04 -0.05 -0.04 0.00 0.00 0.00 0.00 60.65 60.61 1j6y s ILE 116 Cb -0.13 -3.78 0.07 0.00 0.01 0.00 0.00 42.46 38.63 1j6y s ILE 116 CO -0.04 -0.45 0.23 -0.75 0.00 0.00 0.00 174.94 173.94 1j6y s LYS 117 N -3.88 0.14 -0.00 2.79 2.20 -1.13 -4.36 119.74 115.50 1j6y s LYS 117 Ca 0.43 0.57 -0.00 0.00 -0.36 0.00 0.00 55.97 56.61 1j6y s LYS 117 Cb -0.10 -0.40 -0.00 0.00 -1.51 0.00 0.00 37.83 35.82 1j6y s LYS 117 CO 0.33 -0.39 -0.00 -2.13 -0.36 0.00 0.00 175.35 172.79 1j6y n ARG 118 N 5.34 0.01 -2.82 4.03 0.63 -1.26 -1.55 116.66 121.03 1j6y n ARG 118 Ca -0.06 0.00 -0.11 0.00 -0.92 0.00 0.00 57.85 56.77 1j6y n ARG 118 Cb 0.50 -0.41 0.07 0.00 0.45 0.00 0.00 32.46 33.07 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 -2.53 -0.01 0.42 5.15 -1.04 -1.26 -4.93 114.28 110.07 1j6y n THR 119 Ca -0.00 -2.18 0.05 0.00 -2.04 0.00 0.00 64.05 59.88 1j6y n THR 119 Cb 0.01 1.08 0.04 0.00 -1.82 0.00 0.00 70.33 69.63 1j6y n THR 119 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43