#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j6y h MET 2 N 0.00 0.00 -3.04 -0.41 -0.00 -2.14 -3.14 114.93 106.20 1j6y h MET 2 Ca 0.00 0.00 -0.75 0.00 -0.00 0.00 0.00 59.70 58.95 1j6y h MET 2 Cb 0.00 0.00 -0.32 0.00 -0.00 0.00 0.00 31.60 31.28 1j6y h MET 2 CO 0.00 0.00 0.32 0.00 -0.00 0.00 0.00 176.91 177.23 1j6y n ALA 3 N -2.37 4.51 -2.76 -3.00 0.00 -1.26 -5.01 120.51 110.63 1j6y n ALA 3 Ca 0.01 -4.73 -0.16 0.00 0.00 0.00 0.00 53.44 48.56 1j6y n ALA 3 Cb 0.29 -2.03 -0.12 0.00 0.00 0.00 0.00 19.45 17.59 1j6y n ALA 3 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1j6y s SER 4 N -0.84 1.21 0.00 0.00 1.04 -1.19 -5.15 113.70 108.77 1j6y s SER 4 Ca 0.32 -0.48 0.00 0.00 0.48 0.00 0.00 55.95 56.27 1j6y s SER 4 Cb 0.00 -0.03 0.00 0.00 0.10 0.00 0.00 66.02 66.09 1j6y s SER 4 CO -0.00 -0.08 0.00 -2.11 0.98 0.00 0.00 173.24 172.03 1j6y n ARG 5 N 1.74 0.39 0.03 4.02 -4.01 -1.26 -5.12 116.66 112.45 1j6y n ARG 5 Ca -0.20 0.00 0.00 0.00 -1.04 0.00 0.00 57.85 56.61 1j6y n ARG 5 Cb 0.55 0.00 0.00 0.00 -3.04 0.00 0.00 32.46 29.97 1j6y n ARG 5 CO 0.00 0.00 0.00 -3.47 -3.04 0.00 0.00 177.63 171.12 1j6y n ASP 6 N -1.28 -0.18 -1.20 2.89 2.03 -1.26 -5.16 116.55 112.39 1j6y n ASP 6 Ca 0.00 0.09 0.00 0.00 0.52 0.00 0.00 54.79 55.40 1j6y n ASP 6 Cb 0.00 0.30 0.00 0.00 -0.72 0.00 0.00 41.12 40.70 1j6y n ASP 6 CO 0.00 0.00 0.00 1.67 -1.92 0.00 0.00 177.20 176.95 1j6y n GLN 7 N -2.65 -3.29 -3.94 -0.67 -0.06 -1.26 -4.88 117.38 100.64 1j6y n GLN 7 Ca 0.00 2.50 -0.33 0.00 -2.00 0.00 0.00 57.00 57.17 1j6y n GLN 7 Cb 0.00 -2.97 -0.14 0.00 -4.06 0.00 0.00 30.24 23.08 1j6y n GLN 7 CO 0.00 0.00 0.00 0.54 -0.20 0.00 0.00 177.06 177.40 1j6y s VAL 8 N -4.10 2.67 0.63 1.69 0.11 -1.18 -4.78 120.40 115.44 1j6y s VAL 8 Ca 0.00 -1.97 -0.12 0.00 -2.93 0.00 0.00 61.98 56.96 1j6y s VAL 8 Cb 0.00 -2.78 -0.03 0.00 -1.53 0.00 0.00 36.38 32.04 1j6y s VAL 8 CO 0.00 -0.44 1.04 -0.54 -3.33 0.00 0.00 175.10 171.83 1j6y s LYS 9 N 1.06 3.40 -0.12 1.54 1.02 -1.25 -2.82 119.74 122.57 1j6y s LYS 9 Ca 0.04 0.88 -0.33 0.00 0.02 0.00 0.00 55.97 56.57 1j6y s LYS 9 Cb -0.20 -2.05 0.14 0.00 -0.52 0.00 0.00 37.83 35.19 1j6y s LYS 9 CO -0.05 -0.73 1.33 0.00 -0.92 0.00 0.00 175.35 174.98 1j6y s ALA 10 N -3.01 -2.27 0.44 5.17 0.00 -1.06 -4.89 121.76 116.15 1j6y s ALA 10 Ca 0.57 1.17 0.03 0.00 0.00 0.00 0.00 51.96 53.73 1j6y s ALA 10 Cb -0.12 0.09 -0.03 0.00 0.00 0.00 0.00 23.12 23.06 1j6y s ALA 10 CO 0.50 -0.87 0.04 0.45 0.00 0.00 0.00 175.76 175.89 1j6y s SER 11 N -2.65 3.52 -0.06 0.00 0.15 -1.04 0.33 113.70 113.94 1j6y s SER 11 Ca 0.13 -1.58 -0.31 0.00 0.70 0.00 0.00 55.95 54.90 1j6y s SER 11 Cb 0.03 0.28 0.11 0.00 -1.71 0.00 0.00 66.02 64.74 1j6y s SER 11 CO -0.04 -0.77 1.35 -1.38 1.20 0.00 0.00 173.24 173.60 1j6y s HIS 12 N -2.99 0.00 -0.07 3.44 -3.43 -1.20 -2.64 115.29 108.40 1j6y s HIS 12 Ca 0.19 -0.05 -0.19 0.00 -0.80 0.00 0.00 55.06 54.21 1j6y s HIS 12 Cb 0.04 0.52 0.04 0.00 -1.43 0.00 0.00 32.58 31.76 1j6y s HIS 12 CO 0.10 -0.12 0.44 0.42 -2.00 0.00 0.00 174.74 173.59 1j6y s ILE 13 N -2.06 0.03 0.14 -5.38 1.01 -1.11 -4.75 121.20 109.07 1j6y s ILE 13 Ca 0.26 -0.23 0.06 0.00 0.00 0.00 0.00 60.65 60.74 1j6y s ILE 13 Cb 0.02 -0.72 -0.04 0.00 0.01 0.00 0.00 42.46 41.74 1j6y s ILE 13 CO -0.03 -0.12 0.04 -0.22 0.00 0.00 0.00 174.94 174.60 1j6y s LEU 14 N -0.84 3.51 0.00 2.97 2.96 -0.68 -1.47 118.68 125.13 1j6y s LEU 14 Ca -0.09 -0.24 0.00 0.00 -0.22 0.00 0.00 54.13 53.58 1j6y s LEU 14 Cb -0.03 -2.18 0.00 0.00 0.50 0.00 0.00 46.19 44.47 1j6y s LEU 14 CO 0.05 0.12 0.15 0.00 -1.32 0.00 0.00 176.35 175.34 1j6y n ILE 15 N 0.07 0.00 -1.25 6.68 3.06 -1.13 -3.63 119.36 123.17 1j6y n ILE 15 Ca -0.10 -0.41 0.03 0.00 -2.50 0.00 0.00 62.75 59.78 1j6y n ILE 15 Cb 0.54 1.07 -0.02 0.00 0.54 0.00 0.00 39.64 41.77 1j6y n ILE 15 CO 0.00 0.00 0.00 0.29 -2.50 0.00 0.00 176.55 174.34 1j6y n LYS 16 N -0.52 -3.20 0.00 9.51 5.02 -1.26 -5.02 118.16 122.68 1j6y n LYS 16 Ca 0.00 2.51 0.00 0.00 -2.02 0.00 0.00 58.31 58.80 1j6y n LYS 16 Cb 0.02 -3.24 0.00 0.00 -0.02 0.00 0.00 35.03 31.79 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 -2.76 0.00 0.02 2.13 1.44 -1.26 -4.80 115.22 109.99 1j6y n HIS 17 Ca -0.02 0.00 -0.02 0.00 -2.01 0.00 0.00 57.72 55.67 1j6y n HIS 17 Cb 0.43 0.00 -0.01 0.00 0.12 0.00 0.00 29.99 30.53 1j6y n HIS 17 CO 0.00 0.00 0.00 1.96 -2.81 0.00 0.00 176.34 175.49 1j6y h GLN 18 N 0.00 -0.15 0.00 -1.40 1.08 -1.69 -3.40 115.11 109.55 1j6y h GLN 18 Ca 0.00 0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.21 1j6y h GLN 18 Cb 0.00 0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.46 1j6y h GLN 18 CO 0.00 -0.10 0.00 0.41 -0.95 0.00 0.00 178.83 178.19 1j6y n GLY 19 N 1.38 0.29 2.14 3.46 0.00 -1.26 -4.18 105.19 107.02 1j6y n GLY 19 Ca -0.02 0.66 0.00 0.00 0.00 0.00 0.00 46.02 46.66 1j6y n GLY 19 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1j6y n SER 20 N 5.99 -2.63 0.00 1.61 3.41 -1.26 -5.04 113.62 115.70 1j6y n SER 20 Ca 0.00 0.70 0.00 0.00 -0.26 0.00 0.00 58.87 59.31 1j6y n SER 20 Cb 0.00 2.55 0.00 0.00 -0.26 0.00 0.00 64.21 66.50 1j6y n SER 20 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1j6y n ARG 21 N -3.36 0.00 0.00 4.33 1.74 -1.26 -5.09 116.66 113.02 1j6y n ARG 21 Ca 0.00 0.06 0.00 0.00 -0.77 0.00 0.00 57.85 57.14 1j6y n ARG 21 Cb 0.00 -0.58 0.00 0.00 -1.02 0.00 0.00 32.46 30.86 1j6y n ARG 21 CO 0.00 0.00 0.00 2.89 -1.52 0.00 0.00 177.63 179.00 1j6y n ARG 22 N -0.67 0.00 0.00 5.56 1.85 -1.26 -5.09 116.66 117.05 1j6y n ARG 22 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 1j6y n ARG 22 Cb 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.41 1j6y n ARG 22 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 1j6y n LYS 23 N 0.00 0.00 -3.13 2.89 5.02 -1.26 -4.74 118.16 116.94 1j6y n LYS 23 Ca 0.00 0.04 0.00 0.00 -2.02 0.00 0.00 58.31 56.33 1j6y n LYS 23 Cb 0.00 -0.88 0.00 0.00 -0.02 0.00 0.00 35.03 34.13 1j6y n LYS 23 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1j6y n ALA 24 N -1.12 0.00 -2.41 7.82 0.00 -1.26 -4.80 120.51 118.74 1j6y n ALA 24 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.16 1j6y n ALA 24 Cb 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.31 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 -4.00 3.01 0.00 0.00 0.15 -1.26 -4.70 113.70 106.90 1j6y s SER 25 Ca 0.00 -0.64 0.00 0.00 0.70 0.00 0.00 55.95 56.01 1j6y s SER 25 Cb 0.00 -0.23 0.00 0.00 -1.71 0.00 0.00 66.02 64.08 1j6y s SER 25 CO 0.00 0.19 0.00 1.87 1.20 0.00 0.00 173.24 176.50 1j6y n TRP 26 N 1.42 0.00 0.00 3.44 -0.00 -1.26 -4.80 117.44 116.25 1j6y n TRP 26 Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.32 1j6y n TRP 26 Cb 0.53 0.03 0.00 0.00 -0.00 0.00 0.00 31.31 31.87 1j6y n TRP 26 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 177.69 178.86 1j6y n LYS 27 N -1.33 0.00 0.00 5.87 3.00 -1.26 -5.04 118.16 119.41 1j6y n LYS 27 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 1j6y n LYS 27 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.03 1j6y n LYS 27 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1j6y n ASP 28 N 0.00 0.00 0.00 3.14 8.00 -1.26 -5.06 116.55 121.37 1j6y n ASP 28 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 1j6y n ASP 28 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 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 0.00 -1.79 -0.24 -0.04 -1.26 -4.80 135.00 126.87 1j6y n PRO 29 Ca 0.00 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.35 1j6y n PRO 29 Cb 0.00 -0.35 -0.03 0.00 -0.04 0.00 0.00 33.50 33.08 1j6y n PRO 29 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1j6y n GLU 30 N -0.08 -1.68 0.00 0.54 2.13 -1.26 -4.61 120.64 115.68 1j6y n GLU 30 Ca 0.00 0.61 0.00 0.00 0.66 0.00 0.00 57.16 58.43 1j6y n GLU 30 Cb 0.00 -4.98 0.00 0.00 0.27 0.00 0.00 31.44 26.73 1j6y n GLU 30 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1j6y n GLY 31 N -0.44 0.00 3.61 8.31 0.00 -1.26 -5.03 105.19 110.38 1j6y n GLY 31 Ca -0.12 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.46 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 -1.40 2.13 -1.34 1.61 3.00 -1.26 -4.83 118.16 116.07 1j6y n LYS 32 Ca 0.00 0.67 -0.23 0.00 -0.00 0.00 0.00 58.31 58.76 1j6y n LYS 32 Cb 0.16 -3.03 0.11 0.00 0.00 0.00 0.00 35.03 32.27 1j6y n LYS 32 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.40 177.84 1j6y n ILE 33 N 6.83 3.03 -2.34 3.15 -5.35 -1.26 -4.87 119.36 118.55 1j6y n ILE 33 Ca 0.28 -3.03 -0.42 0.00 -0.27 0.00 0.00 62.75 59.31 1j6y n ILE 33 Cb 0.40 -0.82 -0.03 0.00 -1.74 0.00 0.00 39.64 37.45 1j6y n ILE 33 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 1j6y s ILE 34 N -4.12 3.98 0.41 7.28 -1.09 -1.26 -5.00 121.20 121.40 1j6y s ILE 34 Ca 0.55 1.34 -0.22 0.00 -2.23 0.00 0.00 60.65 60.09 1j6y s ILE 34 Cb 0.46 -3.86 -0.11 0.00 -1.58 0.00 0.00 42.46 37.37 1j6y s ILE 34 CO 0.02 0.00 0.95 -0.76 -1.23 0.00 0.00 174.94 173.93 1j6y s LEU 35 N 2.26 4.01 0.00 2.97 1.02 -1.26 -4.87 118.68 122.80 1j6y s LEU 35 Ca 0.60 1.73 0.00 0.00 0.02 0.00 0.00 54.13 56.48 1j6y s LEU 35 Cb -0.28 -4.44 0.00 0.00 0.02 0.00 0.00 46.19 41.49 1j6y s LEU 35 CO 0.24 -0.33 0.00 1.07 0.02 0.00 0.00 176.35 177.35 1j6y n THR 36 N -0.43 0.00 -1.35 5.49 5.66 -1.26 -5.11 114.28 117.27 1j6y n THR 36 Ca 0.06 0.00 -0.44 0.00 -3.05 0.00 0.00 64.05 60.62 1j6y n THR 36 Cb 0.53 0.00 -0.01 0.00 -1.55 0.00 0.00 70.33 69.30 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 1.25 -4.74 1.09 -1.04 -1.26 -4.79 114.28 104.79 1j6y n THR 37 Ca 0.00 -0.50 -0.33 0.00 -2.04 0.00 0.00 64.05 61.18 1j6y n THR 37 Cb 0.00 -0.03 -0.07 0.00 -1.82 0.00 0.00 70.33 68.40 1j6y n THR 37 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 1j6y s THR 38 N -1.39 1.16 0.00 12.58 -4.23 -1.26 -2.19 115.64 120.31 1j6y s THR 38 Ca 0.61 -1.99 0.00 0.00 -1.18 0.00 0.00 61.69 59.14 1j6y s THR 38 Cb -0.75 -2.14 0.00 0.00 1.34 0.00 0.00 72.50 70.94 1j6y s THR 38 CO 0.60 0.00 0.76 -1.14 -0.54 0.00 0.00 174.62 174.29 1j6y n ARG 39 N -1.28 0.00 0.04 3.99 0.00 -1.26 0.20 116.66 118.35 1j6y n ARG 39 Ca -0.19 0.74 -0.12 0.00 -0.00 0.00 0.00 57.85 58.28 1j6y n ARG 39 Cb 0.67 -1.26 -0.08 0.00 0.00 0.00 0.00 32.46 31.80 1j6y n ARG 39 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.63 179.12 1j6y h GLU 40 N 0.00 -0.50 -0.96 -0.14 4.81 -2.01 -0.35 114.58 115.43 1j6y h GLU 40 Ca 0.00 0.03 0.31 0.00 -0.13 0.00 0.00 59.36 59.57 1j6y h GLU 40 Cb 0.00 0.11 -0.16 0.00 0.63 0.00 0.00 28.75 29.33 1j6y h GLU 40 CO 0.00 -0.33 0.38 0.00 -0.73 0.00 0.00 179.01 178.32 1j6y h ALA 41 N -0.69 1.67 0.08 2.92 0.00 -1.84 -0.94 119.26 120.47 1j6y h ALA 41 Ca 0.01 0.24 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1j6y h ALA 41 Cb 0.55 0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 1j6y h ALA 41 CO -0.27 -0.63 -0.15 0.00 0.00 0.00 0.00 179.25 178.20 1j6y h ALA 42 N 1.88 -0.75 -0.97 0.00 0.00 0.41 1.69 119.26 121.51 1j6y h ALA 42 Ca 0.68 -0.04 0.26 0.00 0.00 0.00 0.00 54.91 55.81 1j6y h ALA 42 Cb 1.56 0.51 -0.13 0.00 0.00 0.00 0.00 17.79 19.73 1j6y h ALA 42 CO -0.71 -0.78 0.53 0.28 0.00 0.00 0.00 179.25 178.57 1j6y h VAL 43 N -0.24 0.46 0.58 0.00 2.07 -0.93 1.00 116.25 119.19 1j6y h VAL 43 Ca -0.01 -0.16 -0.03 0.00 0.82 0.00 0.00 66.70 67.32 1j6y h VAL 43 Cb 0.23 -0.05 0.01 0.00 -1.52 0.00 0.00 31.29 29.96 1j6y h VAL 43 CO -0.06 0.09 -0.28 -0.33 0.02 0.00 0.00 177.57 177.01 1j6y h GLU 44 N 0.47 -0.75 -0.70 1.57 5.08 -0.00 1.18 114.58 121.42 1j6y h GLU 44 Ca 0.64 0.05 0.18 0.00 -1.00 0.00 0.00 59.36 59.23 1j6y h GLU 44 Cb 1.28 0.17 -0.04 0.00 0.50 0.00 0.00 28.75 30.67 1j6y h GLU 44 CO -0.52 -0.45 0.49 1.96 -1.00 0.00 0.00 179.01 179.48 1j6y h GLN 45 N -0.93 0.15 0.03 2.33 1.08 0.51 0.41 115.11 118.69 1j6y h GLN 45 Ca -0.08 -0.01 -0.21 0.00 -1.45 0.00 0.00 58.65 56.90 1j6y h GLN 45 Cb 0.65 -0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 28.02 1j6y h GLN 45 CO 0.13 0.10 -0.99 -0.07 -0.95 0.00 0.00 178.83 177.05 1j6y h LEU 46 N 0.15 0.13 -0.09 1.46 -0.00 0.18 -2.94 115.31 114.21 1j6y h LEU 46 Ca 0.34 -0.13 0.03 0.00 -0.00 0.00 0.00 57.88 58.12 1j6y h LEU 46 Cb 1.12 -0.04 -0.03 0.00 -0.00 0.00 0.00 40.66 41.71 1j6y h LEU 46 CO -0.05 1.04 -0.07 0.50 -0.00 0.00 0.00 178.44 179.86 1j6y h LYS 47 N 0.04 -0.08 -0.45 1.13 1.63 0.59 -0.75 116.57 118.68 1j6y h LYS 47 Ca -0.04 0.01 -0.02 0.00 -0.85 0.00 0.00 60.65 59.75 1j6y h LYS 47 Cb 1.70 0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 33.32 1j6y h LYS 47 CO 0.14 -0.05 0.21 0.66 -3.45 0.00 0.00 179.45 176.96 1j6y h SER 48 N -0.08 0.56 -0.64 4.20 4.64 -1.50 -2.07 113.55 118.66 1j6y h SER 48 Ca 0.06 -0.05 0.13 0.00 -0.47 0.00 0.00 61.79 61.47 1j6y h SER 48 Cb 0.17 -0.14 -0.11 0.00 -0.31 0.00 0.00 62.40 62.00 1j6y h SER 48 CO -0.14 0.48 -0.06 0.40 -0.87 0.00 0.00 176.83 176.64 1j6y h ILE 49 N 0.63 0.42 -0.56 0.95 1.08 -0.95 2.11 117.51 121.19 1j6y h ILE 49 Ca 0.16 -0.02 0.08 0.00 -0.39 0.00 0.00 64.86 64.69 1j6y h ILE 49 Cb 0.07 0.35 -0.07 0.00 -3.07 0.00 0.00 36.82 34.10 1j6y h ILE 49 CO -0.02 0.01 0.19 -0.09 -0.69 0.00 0.00 178.15 177.55 1j6y h ARG 50 N 0.06 0.36 0.63 2.37 2.43 -1.11 2.13 114.38 121.25 1j6y h ARG 50 Ca 0.33 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.44 1j6y h ARG 50 Cb 0.53 -0.08 0.01 0.00 -0.42 0.00 0.00 29.97 30.00 1j6y h ARG 50 CO -0.60 0.24 -0.30 1.49 -1.51 0.00 0.00 179.97 179.29 1j6y h GLU 51 N 0.37 -0.81 -0.59 0.20 4.57 0.48 1.04 114.58 119.84 1j6y h GLU 51 Ca 0.28 0.06 0.12 0.00 -1.18 0.00 0.00 59.36 58.63 1j6y h GLU 51 Cb 0.33 0.18 -0.12 0.00 -0.16 0.00 0.00 28.75 28.99 1j6y h GLU 51 CO -0.29 -0.54 -0.21 -0.44 -1.18 0.00 0.00 179.01 176.35 1j6y h ASP 52 N -1.00 -0.76 -0.05 1.04 3.32 0.34 2.32 116.42 121.64 1j6y h ASP 52 Ca -0.09 0.20 0.01 0.00 0.02 0.00 0.00 57.03 57.17 1j6y h ASP 52 Cb 0.65 0.44 -0.00 0.00 0.22 0.00 0.00 39.33 40.64 1j6y h ASP 52 CO 0.14 -0.24 0.04 0.40 -1.72 0.00 0.00 179.24 177.85 1j6y h ILE 53 N -0.07 0.97 0.32 0.35 1.08 0.36 -2.82 117.51 117.71 1j6y h ILE 53 Ca 0.27 0.00 -0.02 0.00 -0.39 0.00 0.00 64.86 64.73 1j6y h ILE 53 Cb 0.49 0.98 0.00 0.00 -3.07 0.00 0.00 36.82 35.22 1j6y h ILE 53 CO -0.64 0.00 -0.15 0.58 -0.69 0.00 0.00 178.15 177.25 1j6y h VAL 54 N 0.00 0.00 -2.83 1.67 2.07 1.19 -3.45 116.25 114.90 1j6y h VAL 54 Ca 0.02 -0.55 -0.64 0.00 0.82 0.00 0.00 66.70 66.35 1j6y h VAL 54 Cb 0.09 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 29.80 1j6y h VAL 54 CO -0.00 0.00 -0.37 -0.44 0.02 0.00 0.00 177.57 176.78 1j6y s SER 55 N -4.66 6.54 0.00 0.57 0.01 0.33 -4.88 113.70 111.61 1j6y s SER 55 Ca -0.06 0.65 0.00 0.00 1.31 0.00 0.00 55.95 57.85 1j6y s SER 55 Cb 0.01 -2.14 0.00 0.00 0.21 0.00 0.00 66.02 64.09 1j6y s SER 55 CO 0.19 0.35 0.00 0.61 0.41 0.00 0.00 173.24 174.80 1j6y n GLY 56 N 2.05 -0.10 2.55 3.44 0.00 -1.26 -4.48 105.19 107.39 1j6y n GLY 56 Ca -0.17 -0.96 -0.10 0.00 0.00 0.00 0.00 46.02 44.78 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 2.22 1.13 0.12 1.61 4.81 -1.26 -4.47 118.16 122.31 1j6y n LYS 57 Ca 0.00 -0.81 0.08 0.00 -0.87 0.00 0.00 58.31 56.71 1j6y n LYS 57 Cb 0.00 -2.03 0.43 0.00 0.02 0.00 0.00 35.03 33.44 1j6y n LYS 57 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1j6y n ALA 58 N 3.72 1.01 -0.56 3.14 0.00 -1.26 -4.90 120.51 121.65 1j6y n ALA 58 Ca 0.24 0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.83 1j6y n ALA 58 Cb 0.21 -1.21 0.00 0.00 0.00 0.00 0.00 19.45 18.45 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 -2.05 0.00 0.04 0.00 2.85 -1.26 -4.63 115.26 110.21 1j6y n ASN 59 Ca -0.01 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.46 1j6y n ASN 59 Cb 0.04 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.06 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 13.13 -2.55 0.00 1.20 7.35 -1.26 -4.98 117.46 130.35 1j6y n PHE 60 Ca 0.00 0.28 0.00 0.00 -0.76 0.00 0.00 57.45 56.97 1j6y n PHE 60 Cb 0.00 1.05 0.00 0.00 0.35 0.00 0.00 39.48 40.88 1j6y n PHE 60 CO 0.00 0.00 0.00 0.39 -0.76 0.00 0.00 176.76 176.39 1j6y n GLU 61 N -2.93 0.00 -0.34 -4.13 1.02 -1.26 0.19 120.64 113.19 1j6y n GLU 61 Ca 0.00 0.26 0.13 0.00 -0.02 0.00 0.00 57.16 57.53 1j6y n GLU 61 Cb 0.00 -0.85 0.26 0.00 -0.02 0.00 0.00 31.44 30.83 1j6y n GLU 61 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1j6y h GLU 62 N 0.00 0.01 -0.69 3.49 5.08 -1.91 1.37 114.58 121.92 1j6y h GLU 62 Ca 0.00 -0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.40 1j6y h GLU 62 Cb 0.00 -0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.20 1j6y h GLU 62 CO 0.00 0.01 0.42 0.28 -1.00 0.00 0.00 179.01 178.71 1j6y h VAL 63 N 0.01 1.04 0.12 3.13 2.07 -1.64 -2.57 116.25 118.41 1j6y h VAL 63 Ca 0.57 -0.27 -0.01 0.00 0.82 0.00 0.00 66.70 67.81 1j6y h VAL 63 Cb 1.11 0.18 0.00 0.00 -1.52 0.00 0.00 31.29 31.06 1j6y h VAL 63 CO -0.93 0.14 -0.06 0.00 0.02 0.00 0.00 177.57 176.75 1j6y h ALA 64 N 1.33 -0.16 -1.16 1.67 0.00 1.19 -1.01 119.26 121.11 1j6y h ALA 64 Ca 0.29 -0.22 0.42 0.00 0.00 0.00 0.00 54.91 55.40 1j6y h ALA 64 Cb 0.10 0.06 -0.15 0.00 0.00 0.00 0.00 17.79 17.80 1j6y h ALA 64 CO -0.14 -0.35 0.70 1.79 0.00 0.00 0.00 179.25 181.24 1j6y h THR 65 N -0.63 0.09 0.00 0.00 1.35 0.01 0.20 112.91 113.93 1j6y h THR 65 Ca -0.02 -0.03 -0.01 0.00 -0.55 0.00 0.00 66.41 65.81 1j6y h THR 65 Cb 0.49 0.00 -0.00 0.00 -1.73 0.00 0.00 68.15 66.91 1j6y h THR 65 CO 0.03 0.01 -0.20 -0.09 -0.25 0.00 0.00 175.52 175.02 1j6y h ARG 66 N 0.08 0.00 -2.60 4.72 1.12 -1.37 -3.39 114.38 112.95 1j6y h ARG 66 Ca 0.83 0.00 -0.78 0.00 -1.11 0.00 0.00 59.98 58.92 1j6y h ARG 66 Cb 2.36 0.00 -0.21 0.00 -0.01 0.00 0.00 29.97 32.11 1j6y h ARG 66 CO -0.59 0.16 1.62 1.55 -3.11 0.00 0.00 179.97 179.60 1j6y n VAL 67 N -4.70 5.52 -4.56 0.20 3.14 -0.39 -4.97 118.33 112.57 1j6y n VAL 67 Ca -0.05 -5.21 -0.26 0.00 -2.96 0.00 0.00 64.34 55.87 1j6y n VAL 67 Cb 0.16 -1.89 -0.11 0.00 -1.06 0.00 0.00 33.84 30.94 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 -0.55 3.46 -1.19 6.55 1.04 0.60 -1.69 113.70 121.92 1j6y s SER 68 Ca 0.44 -1.34 -0.17 0.00 0.48 0.00 0.00 55.95 55.36 1j6y s SER 68 Cb 0.16 -0.31 -0.03 0.00 0.10 0.00 0.00 66.02 65.94 1j6y s SER 68 CO -0.07 -0.44 2.08 -0.67 0.98 0.00 0.00 173.24 175.12 1j6y n ASP 69 N -0.86 3.42 0.00 7.02 -0.08 -1.26 -4.54 116.55 120.24 1j6y n ASP 69 Ca -0.04 -2.78 0.00 0.00 -1.51 0.00 0.00 54.79 50.45 1j6y n ASP 69 Cb 0.66 -1.47 0.00 0.00 2.34 0.00 0.00 41.12 42.65 1j6y n ASP 69 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1j6y h SER 71 N 0.00 0.00 -0.76 0.00 0.87 -1.90 2.16 113.55 113.91 1j6y h SER 71 Ca 0.00 0.17 0.15 0.00 -1.23 0.00 0.00 61.79 60.88 1j6y h SER 71 Cb 0.00 0.24 -0.05 0.00 -0.44 0.00 0.00 62.40 62.15 1j6y h SER 71 CO 0.00 -0.10 0.51 -1.28 -0.53 0.00 0.00 176.83 175.43 1j6y h SER 72 N 0.24 0.40 -0.76 6.23 0.87 -0.38 0.41 113.55 120.55 1j6y h SER 72 Ca 0.49 0.02 0.16 0.00 -1.23 0.00 0.00 61.79 61.23 1j6y h SER 72 Cb 0.92 -0.06 -0.10 0.00 -0.44 0.00 0.00 62.40 62.72 1j6y h SER 72 CO -0.59 0.21 0.27 0.00 -0.53 0.00 0.00 176.83 176.18 1j6y h ALA 73 N 1.64 1.06 -0.09 6.23 0.00 0.34 2.62 119.26 131.06 1j6y h ALA 73 Ca 0.37 0.14 -0.03 0.00 0.00 0.00 0.00 54.91 55.39 1j6y h ALA 73 Cb 0.85 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 1j6y h ALA 73 CO -0.12 -0.27 -0.08 -0.22 0.00 0.00 0.00 179.25 178.56 1j6y h LYS 74 N 0.38 0.14 -1.10 0.00 3.11 -0.10 -2.07 116.57 116.92 1j6y h LYS 74 Ca 0.43 -0.02 -0.61 0.00 -2.81 0.00 0.00 60.65 57.63 1j6y h LYS 74 Cb 0.70 -0.02 -0.38 0.00 -1.00 0.00 0.00 32.23 31.53 1j6y h LYS 74 CO -0.45 0.23 -0.19 0.54 -2.81 0.00 0.00 179.45 176.76 1j6y n ARG 75 N -4.37 3.27 0.13 1.90 1.74 0.72 -4.77 116.66 115.29 1j6y n ARG 75 Ca -0.01 -3.96 0.18 0.00 -0.77 0.00 0.00 57.85 53.29 1j6y n ARG 75 Cb 0.20 -2.28 0.65 0.00 -1.02 0.00 0.00 32.46 30.01 1j6y n ARG 75 CO 0.00 0.00 0.00 0.78 -1.52 0.00 0.00 177.63 176.89 1j6y h GLY 76 N 2.30 0.00 0.00 -0.13 0.00 0.40 -3.22 103.07 102.42 1j6y h GLY 76 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.76 1j6y h GLY 76 CO 1.05 0.00 0.00 0.61 0.00 0.00 0.00 176.54 178.20 1j6y n GLY 77 N -1.45 -0.38 3.27 4.60 0.00 -1.26 -4.42 105.19 105.55 1j6y n GLY 77 Ca 0.07 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.98 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 0.13 0.00 1.61 -4.77 -1.22 -3.26 116.67 107.59 1j6y s ASP 78 Ca 0.00 -1.18 0.00 0.00 -3.30 0.00 0.00 52.55 48.07 1j6y s ASP 78 Cb 0.00 0.40 0.00 0.00 -1.09 0.00 0.00 42.92 42.23 1j6y s ASP 78 CO 0.00 -0.87 0.37 0.18 0.70 0.00 0.00 175.17 175.56 1j6y n LEU 79 N -0.23 0.90 0.00 2.11 4.32 0.15 -4.90 117.00 119.36 1j6y n LEU 79 Ca -0.02 0.41 0.00 0.00 -0.02 0.00 0.00 56.01 56.38 1j6y n LEU 79 Cb 0.64 -0.10 0.00 0.00 -1.62 0.00 0.00 43.42 42.34 1j6y n LEU 79 CO 0.29 -0.10 0.00 0.61 -1.22 0.00 0.00 177.39 176.97 1j6y n GLY 80 N 0.53 -0.01 3.27 -0.72 0.00 -1.10 -4.95 105.19 102.21 1j6y n GLY 80 Ca 0.00 0.04 -0.11 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.29 1.61 1.04 -1.26 -2.55 113.70 107.76 1j6y s SER 81 Ca 0.00 0.85 0.02 0.00 0.48 0.00 0.00 55.95 57.30 1j6y s SER 81 Cb 0.00 0.77 0.19 0.00 0.10 0.00 0.00 66.02 67.08 1j6y s SER 81 CO 0.00 -0.18 0.62 0.72 0.98 0.00 0.00 173.24 175.39 1j6y s PHE 82 N 1.06 -1.68 0.00 5.02 -0.71 -1.13 -4.91 117.98 115.64 1j6y s PHE 82 Ca -0.07 1.29 0.00 0.00 -1.04 0.00 0.00 56.93 57.11 1j6y s PHE 82 Cb -0.07 0.40 0.00 0.00 -1.21 0.00 0.00 43.02 42.14 1j6y s PHE 82 CO -0.09 -0.96 0.00 0.41 -1.34 0.00 0.00 175.22 173.25 1j6y n GLY 83 N 5.41 1.56 3.52 1.99 0.00 -1.26 -3.07 105.19 113.33 1j6y n GLY 83 Ca 0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.61 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 4.01 0.00 1.61 1.81 -1.26 -4.74 118.95 120.37 1j6y s ARG 84 Ca 0.00 -2.25 0.00 0.00 -1.72 0.00 0.00 55.73 51.76 1j6y s ARG 84 Cb 0.00 -5.27 0.00 0.00 -0.45 0.00 0.00 34.95 29.23 1j6y s ARG 84 CO 0.00 -1.99 0.00 0.41 -0.68 0.00 0.00 175.30 173.04 1j6y n GLY 85 N 4.82 -1.73 7.00 -3.53 0.00 -1.26 -5.12 105.19 105.37 1j6y n GLY 85 Ca 0.41 -1.12 0.00 0.00 0.00 0.00 0.00 46.02 45.31 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 -0.35 0.00 -0.83 1.61 1.13 -1.26 -4.72 117.38 112.96 1j6y n GLN 86 Ca 0.00 0.00 -0.33 0.00 -1.94 0.00 0.00 57.00 54.73 1j6y n GLN 86 Cb 0.00 0.00 -0.05 0.00 0.11 0.00 0.00 30.24 30.30 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 14.00 0.00 0.00 -1.09 2.81 -1.26 -4.92 117.12 126.66 1j6y n MET 87 Ca 0.00 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.89 1j6y n MET 87 Cb 0.00 -0.80 0.00 0.00 -0.71 0.00 0.00 33.22 31.71 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 1.10 0.74 -0.03 0.03 6.02 -1.26 -4.64 117.38 119.33 1j6y n GLN 88 Ca 0.12 0.00 -0.00 0.00 -0.01 0.00 0.00 57.00 57.11 1j6y n GLN 88 Cb 0.03 0.00 -0.14 0.00 1.02 0.00 0.00 30.24 31.15 1j6y n GLN 88 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1j6y n LYS 89 N 0.00 0.66 0.17 -1.09 5.02 -1.26 -4.18 118.16 117.47 1j6y n LYS 89 Ca 0.00 -0.01 -0.09 0.00 -2.02 0.00 0.00 58.31 56.20 1j6y n LYS 89 Cb 0.00 -1.60 -0.04 0.00 -0.02 0.00 0.00 35.03 33.37 1j6y n LYS 89 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 1j6y h PRO 90 N 0.00 -0.49 0.43 1.97 0.13 -1.95 -3.04 132.00 129.06 1j6y h PRO 90 Ca -0.26 0.03 -0.01 0.00 -0.87 0.00 0.00 66.00 64.89 1j6y h PRO 90 Cb 1.66 0.11 -0.02 0.00 0.13 0.00 0.00 31.00 32.88 1j6y h PRO 90 CO 0.02 -0.29 -0.41 0.35 -0.23 0.00 0.00 178.00 177.45 1j6y h PHE 91 N -1.11 -1.12 -0.54 1.56 3.04 -1.89 -2.61 116.94 114.27 1j6y h PHE 91 Ca -0.05 0.01 0.05 0.00 3.98 0.00 0.00 57.97 61.95 1j6y h PHE 91 Cb 0.42 0.43 -0.06 0.00 2.56 0.00 0.00 35.95 39.30 1j6y h PHE 91 CO 0.01 -0.55 -0.32 -1.91 -2.02 0.00 0.00 178.31 173.52 1j6y n GLU 92 N -4.88 -0.24 0.04 1.11 2.13 -1.26 0.27 120.64 117.82 1j6y n GLU 92 Ca -0.10 1.25 0.21 0.00 0.66 0.00 0.00 57.16 59.18 1j6y n GLU 92 Cb 0.38 -1.85 0.60 0.00 0.27 0.00 0.00 31.44 30.84 1j6y n GLU 92 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 1j6y h GLU 93 N 0.00 0.00 0.32 5.31 4.39 -1.48 0.60 114.58 123.72 1j6y h GLU 93 Ca 0.09 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.77 1j6y h GLU 93 Cb 0.22 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.87 1j6y h GLU 93 CO -0.50 0.00 -0.15 0.00 -1.16 0.00 0.00 179.01 177.19 1j6y h ALA 94 N 1.06 -0.43 0.00 3.43 0.00 0.43 -0.42 119.26 123.33 1j6y h ALA 94 Ca 0.25 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 1j6y h ALA 94 Cb 1.69 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 19.64 1j6y h ALA 94 CO -0.00 -0.43 -0.21 1.15 0.00 0.00 0.00 179.25 179.76 1j6y h THR 95 N -1.06 0.72 0.00 0.00 2.02 -0.19 -1.19 112.91 113.20 1j6y h THR 95 Ca -0.04 -0.89 -0.05 0.00 0.77 0.00 0.00 66.41 66.20 1j6y h THR 95 Cb 0.42 1.56 -0.01 0.00 -1.74 0.00 0.00 68.15 68.38 1j6y h THR 95 CO 0.07 0.21 -0.22 1.88 0.37 0.00 0.00 175.52 177.83 1j6y h TYR 96 N 0.00 0.00 0.05 3.16 0.05 0.10 -3.20 116.97 117.13 1j6y h TYR 96 Ca -0.00 0.00 -0.29 0.00 0.05 0.00 0.00 58.73 58.48 1j6y h TYR 96 Cb 0.54 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 38.25 1j6y h TYR 96 CO 0.00 0.22 -1.60 0.00 -1.05 0.00 0.00 178.16 175.73 1j6y h ALA 97 N 1.78 0.52 -2.70 3.88 0.00 0.03 -3.46 119.26 119.31 1j6y h ALA 97 Ca -0.00 -1.28 -0.57 0.00 0.00 0.00 0.00 54.91 53.06 1j6y h ALA 97 Cb 1.01 0.37 -0.04 0.00 0.00 0.00 0.00 17.79 19.13 1j6y h ALA 97 CO 0.03 1.37 -0.02 -1.17 0.00 0.00 0.00 179.25 179.47 1j6y s LEU 98 N -6.57 4.53 -0.41 0.00 0.20 -0.56 -5.03 118.68 110.84 1j6y s LEU 98 Ca -0.08 1.29 0.06 0.00 0.69 0.00 0.00 54.13 56.10 1j6y s LEU 98 Cb 0.08 -2.95 0.20 0.00 -0.43 0.00 0.00 46.19 43.09 1j6y s LEU 98 CO 0.82 0.26 0.46 2.29 -0.29 0.00 0.00 176.35 179.89 1j6y n LYS 99 N 1.67 0.43 -2.27 1.98 2.85 -1.26 -4.86 118.16 116.70 1j6y n LYS 99 Ca -0.10 -3.06 0.00 0.00 -1.05 0.00 0.00 58.31 54.11 1j6y n LYS 99 Cb 0.51 -1.47 0.00 0.00 -0.65 0.00 0.00 35.03 33.41 1j6y n LYS 99 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 177.40 177.63 1j6y n VAL 100 N 2.25-13.45 0.00 0.58 0.31 -1.26 -4.90 118.33 101.86 1j6y n VAL 100 Ca 0.25 3.27 0.00 0.00 -0.01 0.00 0.00 64.34 67.85 1j6y n VAL 100 Cb 0.51 -5.87 0.00 0.00 -0.91 0.00 0.00 33.84 27.57 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 1.91 0.90 3.49 2.92 0.00 -1.26 -4.88 105.19 108.27 1j6y n GLY 101 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 1j6y n GLY 101 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1j6y s ASP 102 N 0.00 1.03 -0.05 1.61 1.01 -1.26 -5.06 116.67 113.95 1j6y s ASP 102 Ca 0.00 -1.53 0.08 0.00 0.71 0.00 0.00 52.55 51.80 1j6y s ASP 102 Cb 0.00 0.67 0.11 0.00 1.01 0.00 0.00 42.92 44.72 1j6y s ASP 102 CO 0.00 -1.32 1.01 -0.38 0.21 0.00 0.00 175.17 174.70 1j6y n ILE 103 N -0.59 1.18 0.00 0.77 5.41 -1.26 -4.58 119.36 120.29 1j6y n ILE 103 Ca 0.01 -1.33 0.00 0.00 1.00 0.00 0.00 62.75 62.44 1j6y n ILE 103 Cb 0.61 0.25 0.00 0.00 -0.71 0.00 0.00 39.64 39.80 1j6y n ILE 103 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 1j6y n SER 104 N -0.78 0.00 0.00 4.38 3.41 -1.24 -0.60 113.62 118.79 1j6y n SER 104 Ca 0.06 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.67 1j6y n SER 104 Cb 0.47 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.42 1j6y n SER 104 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1j6y n ASP 105 N 1.58 0.00 -4.53 4.04 8.00 -1.26 -4.57 116.55 119.80 1j6y n ASP 105 Ca 0.00 0.00 -0.43 0.00 0.71 0.00 0.00 54.79 55.07 1j6y n ASP 105 Cb 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.06 1j6y n ASP 105 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 1j6y s ILE 106 N 0.00 4.35 -0.41 0.53 -4.36 -1.26 -3.46 121.20 116.59 1j6y s ILE 106 Ca 0.00 0.41 0.11 0.00 -0.26 0.00 0.00 60.65 60.91 1j6y s ILE 106 Cb 0.00 -4.55 0.36 0.00 1.25 0.00 0.00 42.46 39.51 1j6y s ILE 106 CO 0.00 -1.11 0.80 0.52 0.24 0.00 0.00 174.94 175.39 1j6y n VAL 107 N 6.28 0.68 -1.37 8.37 0.31 -0.32 -4.91 118.33 127.37 1j6y n VAL 107 Ca 0.03 -4.71 -0.55 0.00 -0.01 0.00 0.00 64.34 59.10 1j6y n VAL 107 Cb 0.48 -0.47 -0.09 0.00 -0.91 0.00 0.00 33.84 32.85 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 0.12 1.53 0.00 4.52 5.68 -1.26 -2.80 116.55 124.34 1j6y n ASP 108 Ca 0.26 0.56 0.00 0.00 -0.50 0.00 0.00 54.79 55.10 1j6y n ASP 108 Cb 0.61 -1.10 0.00 0.00 -1.14 0.00 0.00 41.12 39.49 1j6y n ASP 108 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1j6y n THR 109 N 6.78 0.00 -1.30 2.12 -2.24 0.50 -4.86 114.28 115.28 1j6y n THR 109 Ca 0.47 0.00 -0.40 0.00 -2.27 0.00 0.00 64.05 61.85 1j6y n THR 109 Cb 0.11 0.00 0.01 0.00 -2.10 0.00 0.00 70.33 68.35 1j6y n THR 109 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1j6y n ASP 110 N 0.00 -3.01 0.00 3.42 -0.08 -1.26 -1.22 116.55 114.40 1j6y n ASP 110 Ca 0.00 0.72 0.00 0.00 -1.51 0.00 0.00 54.79 54.00 1j6y n ASP 110 Cb 0.00 -0.91 0.00 0.00 2.34 0.00 0.00 41.12 42.55 1j6y n ASP 110 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 1j6y n SER 111 N 2.17 0.00 0.00 1.67 7.64 -1.26 -4.67 113.62 119.17 1j6y n SER 111 Ca 0.09 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.97 1j6y n SER 111 Cb 0.45 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.65 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 -0.89 3.84 0.23 0.00 -0.35 -4.73 105.19 103.29 1j6y n GLY 112 Ca 0.00 -0.09 -0.37 0.00 0.00 0.00 0.00 46.02 45.56 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 -4.00 5.28 0.32 1.61 -7.23 -1.26 0.19 120.40 115.31 1j6y s VAL 113 Ca 0.00 0.52 0.03 0.00 -1.81 0.00 0.00 61.98 60.73 1j6y s VAL 113 Cb 0.00 -3.56 -0.01 0.00 0.56 0.00 0.00 36.38 33.36 1j6y s VAL 113 CO 0.00 0.57 0.13 1.41 -0.31 0.00 0.00 175.10 176.90 1j6y n HIS 114 N 2.15 0.05 -4.38 2.82 -0.00 -1.12 -2.82 115.22 111.92 1j6y n HIS 114 Ca -0.16 -2.12 -0.19 0.00 -0.00 0.00 0.00 57.72 55.25 1j6y n HIS 114 Cb 0.53 0.02 -0.10 0.00 -0.00 0.00 0.00 29.99 30.44 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 -2.81 1.23 0.05 1.59 -4.36 -0.54 -1.17 121.20 115.19 1j6y s ILE 115 Ca 0.18 -2.05 -0.08 0.00 -0.26 0.00 0.00 60.65 58.43 1j6y s ILE 115 Cb 0.01 -2.46 -0.00 0.00 1.25 0.00 0.00 42.46 41.25 1j6y s ILE 115 CO 0.13 -0.25 0.17 -0.63 0.24 0.00 0.00 174.94 174.60 1j6y s ILE 116 N -3.29 0.12 -0.05 8.37 1.09 0.23 -2.77 121.20 124.91 1j6y s ILE 116 Ca 0.30 -0.99 0.02 0.00 -1.10 0.00 0.00 60.65 58.88 1j6y s ILE 116 Cb 0.06 -0.99 0.01 0.00 -1.06 0.00 0.00 42.46 40.48 1j6y s ILE 116 CO 0.11 -0.55 -0.08 -0.75 -0.10 0.00 0.00 174.94 173.57 1j6y s LYS 117 N -2.81 1.17 0.00 2.79 2.20 -1.08 -3.61 119.74 118.40 1j6y s LYS 117 Ca -0.03 -0.26 0.00 0.00 -0.36 0.00 0.00 55.97 55.32 1j6y s LYS 117 Cb 0.00 -1.05 0.00 0.00 -1.51 0.00 0.00 37.83 35.27 1j6y s LYS 117 CO -0.05 0.00 0.00 0.54 -0.36 0.00 0.00 175.35 175.48 1j6y n ARG 118 N 3.80 0.00 0.00 4.03 5.12 -1.26 -2.49 116.66 125.85 1j6y n ARG 118 Ca -0.23 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.69 1j6y n ARG 118 Cb 0.52 -0.01 0.00 0.00 -1.16 0.00 0.00 32.46 31.81 1j6y n ARG 118 CO 0.00 0.00 0.00 2.41 -1.93 0.00 0.00 177.63 178.11 1j6y n THR 119 N -0.40 0.05 1.26 0.55 -1.04 -1.26 -4.92 114.28 108.52 1j6y n THR 119 Ca 0.00 -0.19 0.10 0.00 -2.04 0.00 0.00 64.05 61.92 1j6y n THR 119 Cb 0.00 1.54 0.60 0.00 -1.82 0.00 0.00 70.33 70.65 1j6y n THR 119 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43