#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 4.53 0.00 1.57 -2.45 -1.26 -4.66 119.30 117.03 1j6y s MET 2 Ca 0.00 1.19 0.00 0.00 -1.25 0.00 0.00 55.69 55.63 1j6y s MET 2 Cb 0.00 -3.42 0.00 0.00 1.25 0.00 0.00 34.83 32.66 1j6y s MET 2 CO 0.00 0.09 0.00 0.00 1.05 0.00 0.00 175.02 176.16 1j6y n ALA 3 N 3.48 0.00 -1.43 4.11 0.00 -1.26 -5.16 120.51 120.26 1j6y n ALA 3 Ca 0.02 0.00 0.18 0.00 0.00 0.00 0.00 53.44 53.63 1j6y n ALA 3 Cb 0.51 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.88 1j6y n ALA 3 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1j6y n SER 4 N -1.06 -8.08 0.00 0.00 7.64 -1.26 -5.04 113.62 105.82 1j6y n SER 4 Ca 0.00 1.16 0.00 0.00 1.01 0.00 0.00 58.87 61.04 1j6y n SER 4 Cb 0.00 -4.72 0.00 0.00 -1.01 0.00 0.00 64.21 58.48 1j6y n SER 4 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 1j6y n ARG 5 N -4.27 0.94 0.00 1.43 0.00 -1.26 -5.13 116.66 108.37 1j6y n ARG 5 Ca -0.06 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.79 1j6y n ARG 5 Cb 0.67 0.00 0.00 0.00 -0.00 0.00 0.00 32.46 33.13 1j6y n ARG 5 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.63 174.16 1j6y n ASP 6 N 0.00 0.00 -1.22 2.89 2.03 -1.26 -5.15 116.55 113.84 1j6y n ASP 6 Ca 0.00 0.00 0.14 0.00 0.52 0.00 0.00 54.79 55.45 1j6y n ASP 6 Cb 0.00 0.03 -0.06 0.00 -0.72 0.00 0.00 41.12 40.38 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 -2.46 -2.40 -3.55 -0.67 7.27 -1.26 -4.85 117.38 109.45 1j6y n GLN 7 Ca 0.00 1.85 -0.29 0.00 0.07 0.00 0.00 57.00 58.63 1j6y n GLN 7 Cb 0.00 -2.98 -0.15 0.00 2.41 0.00 0.00 30.24 29.51 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 -3.57 -0.04 0.76 1.69 0.11 -0.92 -5.00 120.40 113.43 1j6y s VAL 8 Ca 0.00 -0.74 -0.11 0.00 -2.93 0.00 0.00 61.98 58.20 1j6y s VAL 8 Cb 0.00 -0.98 0.06 0.00 -1.53 0.00 0.00 36.38 33.93 1j6y s VAL 8 CO 0.00 -0.70 1.12 -0.54 -3.33 0.00 0.00 175.10 171.65 1j6y s LYS 9 N 2.08 2.25 0.00 1.54 1.02 -1.26 -2.82 119.74 122.56 1j6y s LYS 9 Ca 0.09 0.12 0.00 0.00 0.02 0.00 0.00 55.97 56.19 1j6y s LYS 9 Cb -0.16 -2.02 0.00 0.00 -0.52 0.00 0.00 37.83 35.13 1j6y s LYS 9 CO -0.35 -1.36 0.00 0.00 -0.92 0.00 0.00 175.35 172.72 1j6y n ALA 10 N -3.14 0.00 -2.53 5.17 0.00 -1.13 -4.79 120.51 114.09 1j6y n ALA 10 Ca 0.08 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.25 1j6y n ALA 10 Cb 0.60 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.97 1j6y n ALA 10 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1j6y s SER 11 N 0.00 2.89 0.05 0.00 1.04 -0.86 -0.41 113.70 116.41 1j6y s SER 11 Ca 0.00 -1.70 -0.20 0.00 0.48 0.00 0.00 55.95 54.53 1j6y s SER 11 Cb 0.00 0.55 0.07 0.00 0.10 0.00 0.00 66.02 66.74 1j6y s SER 11 CO 0.00 -0.96 0.92 0.00 0.98 0.00 0.00 173.24 174.19 1j6y n HIS 12 N -0.95 -0.68 -4.01 5.02 1.44 -1.21 -2.78 115.22 112.06 1j6y n HIS 12 Ca -0.07 -0.74 -0.11 0.00 -2.01 0.00 0.00 57.72 54.80 1j6y n HIS 12 Cb 0.65 0.35 -0.04 0.00 0.12 0.00 0.00 29.99 31.06 1j6y n HIS 12 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 1j6y s ILE 13 N -2.10 0.00 -0.07 0.61 1.01 -1.09 -4.77 121.20 114.79 1j6y s ILE 13 Ca 0.21 -1.44 -0.08 0.00 0.00 0.00 0.00 60.65 59.35 1j6y s ILE 13 Cb -0.01 -2.44 0.02 0.00 0.01 0.00 0.00 42.46 40.04 1j6y s ILE 13 CO 0.01 0.00 0.21 -0.22 0.00 0.00 0.00 174.94 174.95 1j6y s LEU 14 N -3.10 1.19 0.44 2.97 2.96 0.14 -2.41 118.68 120.86 1j6y s LEU 14 Ca 0.25 0.38 0.08 0.00 -0.22 0.00 0.00 54.13 54.62 1j6y s LEU 14 Cb -0.01 0.75 0.00 0.00 0.50 0.00 0.00 46.19 47.44 1j6y s LEU 14 CO 0.13 -0.11 0.47 -0.63 -1.32 0.00 0.00 176.35 174.90 1j6y s ILE 15 N -0.03 2.66 -0.11 6.68 1.01 -1.17 -2.55 121.20 127.69 1j6y s ILE 15 Ca -0.01 -1.22 -0.11 0.00 0.00 0.00 0.00 60.65 59.30 1j6y s ILE 15 Cb -0.02 -2.88 -0.05 0.00 0.01 0.00 0.00 42.46 39.52 1j6y s ILE 15 CO 0.00 0.00 0.26 -0.54 0.00 0.00 0.00 174.94 174.66 1j6y s LYS 16 N -4.25 3.90 0.00 2.79 1.02 -1.26 -4.71 119.74 117.24 1j6y s LYS 16 Ca 0.50 0.07 0.00 0.00 0.02 0.00 0.00 55.97 56.57 1j6y s LYS 16 Cb -0.05 -3.30 0.00 0.00 -0.52 0.00 0.00 37.83 33.96 1j6y s LYS 16 CO 0.30 0.53 0.00 -2.39 -0.92 0.00 0.00 175.35 172.87 1j6y n HIS 17 N 2.62 -0.15 0.00 3.18 1.44 -1.26 -4.08 115.22 116.97 1j6y n HIS 17 Ca -0.15 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.56 1j6y n HIS 17 Cb 0.53 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.64 1j6y n HIS 17 CO 0.00 0.00 0.00 1.04 -2.81 0.00 0.00 176.34 174.57 1j6y n GLN 18 N 0.00 0.00 -2.26 -1.40 1.13 -1.25 -4.28 117.38 109.32 1j6y n GLN 18 Ca 0.00 0.00 -0.02 0.00 -1.94 0.00 0.00 57.00 55.04 1j6y n GLN 18 Cb 0.00 -0.54 -0.02 0.00 0.11 0.00 0.00 30.24 29.79 1j6y n GLN 18 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1j6y n GLY 19 N -0.04 -4.24 7.00 1.08 0.00 -1.26 -4.65 105.19 103.08 1j6y n GLY 19 Ca 0.00 0.74 0.00 0.00 0.00 0.00 0.00 46.02 46.76 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 0.86 -1.10 -1.51 1.61 7.64 -1.26 -3.13 113.62 116.73 1j6y n SER 20 Ca -0.17 0.00 0.09 0.00 1.01 0.00 0.00 58.87 59.80 1j6y n SER 20 Cb 0.26 0.00 0.34 0.00 -1.01 0.00 0.00 64.21 63.80 1j6y n SER 20 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 1j6y n ARG 21 N 0.00 3.52 -4.46 1.43 1.85 -1.26 -4.94 116.66 112.80 1j6y n ARG 21 Ca 0.00 -2.68 -0.23 0.00 -1.00 0.00 0.00 57.85 53.94 1j6y n ARG 21 Cb 0.00 -1.84 -0.09 0.00 -1.05 0.00 0.00 32.46 29.48 1j6y n ARG 21 CO 0.00 0.00 0.00 -0.98 -0.01 0.00 0.00 177.63 176.64 1j6y s ARG 22 N -1.79 1.79 0.00 2.89 1.70 -1.18 -5.10 118.95 117.26 1j6y s ARG 22 Ca 0.48 -2.06 0.00 0.00 -0.47 0.00 0.00 55.73 53.68 1j6y s ARG 22 Cb 0.31 -0.54 0.00 0.00 -0.57 0.00 0.00 34.95 34.15 1j6y s ARG 22 CO 0.24 -0.41 0.00 1.17 -1.08 0.00 0.00 175.30 175.21 1j6y n LYS 23 N -0.79 0.00 -3.77 3.89 4.81 -1.26 -4.65 118.16 116.39 1j6y n LYS 23 Ca -0.04 0.00 -0.09 0.00 -0.87 0.00 0.00 58.31 57.31 1j6y n LYS 23 Cb 0.65 0.00 -0.06 0.00 0.02 0.00 0.00 35.03 35.64 1j6y n LYS 23 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1j6y s ALA 24 N -1.66 -0.51 -0.30 3.14 0.00 -1.26 -4.94 121.76 116.23 1j6y s ALA 24 Ca 0.00 -0.39 0.03 0.00 0.00 0.00 0.00 51.96 51.60 1j6y s ALA 24 Cb 0.00 0.58 0.08 0.00 0.00 0.00 0.00 23.12 23.78 1j6y s ALA 24 CO 0.00 -0.57 -0.01 -1.12 0.00 0.00 0.00 175.76 174.06 1j6y s SER 25 N -2.84 4.50 0.14 0.00 0.01 -1.26 -5.01 113.70 109.24 1j6y s SER 25 Ca 0.04 -1.76 0.08 0.00 1.31 0.00 0.00 55.95 55.62 1j6y s SER 25 Cb 0.04 -1.49 -0.04 0.00 0.21 0.00 0.00 66.02 64.74 1j6y s SER 25 CO -0.11 -0.31 -0.17 0.26 0.41 0.00 0.00 173.24 173.32 1j6y s TRP 26 N 1.08 1.68 -0.95 2.43 0.52 -1.26 -5.01 118.94 117.42 1j6y s TRP 26 Ca 0.03 -0.49 -0.16 0.00 0.02 0.00 0.00 56.10 55.50 1j6y s TRP 26 Cb -0.19 -0.86 0.18 0.00 -1.15 0.00 0.00 33.47 31.45 1j6y s TRP 26 CO -0.08 0.26 1.05 -1.59 0.02 0.00 0.00 176.95 176.61 1j6y s LYS 27 N -2.67 3.73 0.00 4.98 -2.85 -1.26 -4.33 119.74 117.35 1j6y s LYS 27 Ca 0.13 -2.25 0.00 0.00 -1.00 0.00 0.00 55.97 52.85 1j6y s LYS 27 Cb -0.06 -4.74 0.00 0.00 -2.06 0.00 0.00 37.83 30.97 1j6y s LYS 27 CO 0.05 -1.56 0.00 -0.25 0.10 0.00 0.00 175.35 173.69 1j6y n ASP 28 N 5.21 0.00 -3.11 0.03 8.00 -1.26 -5.01 116.55 120.41 1j6y n ASP 28 Ca 0.22 0.00 -0.26 0.00 0.71 0.00 0.00 54.79 55.47 1j6y n ASP 28 Cb 0.47 0.00 -0.03 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 2.53 0.00 -0.24 -0.04 -1.26 -4.90 135.00 131.09 1j6y n PRO 29 Ca 0.00 -1.62 0.00 0.00 -0.04 0.00 0.00 63.50 61.84 1j6y n PRO 29 Cb 0.00 -2.50 0.00 0.00 -0.04 0.00 0.00 33.50 30.96 1j6y n PRO 29 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 1j6y n GLU 30 N 3.85 0.09 -1.17 0.54 0.28 -1.26 -4.88 120.64 118.09 1j6y n GLU 30 Ca 0.54 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.54 1j6y n GLU 30 Cb 0.21 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.08 1j6y n GLU 30 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1j6y n GLY 31 N 4.89 -2.63 3.32 -1.84 0.00 -1.26 -4.95 105.19 102.72 1j6y n GLY 31 Ca 0.00 -0.51 0.03 0.00 0.00 0.00 0.00 46.02 45.54 1j6y n GLY 31 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1j6y n LYS 32 N 0.14 -0.45 -1.96 1.61 2.85 -1.26 -4.77 118.16 114.33 1j6y n LYS 32 Ca 0.00 0.29 -0.30 0.00 -1.05 0.00 0.00 58.31 57.26 1j6y n LYS 32 Cb 0.00 -0.54 0.19 0.00 -0.65 0.00 0.00 35.03 34.03 1j6y n LYS 32 CO 0.00 0.00 0.00 0.96 -0.05 0.00 0.00 177.40 178.31 1j6y s ILE 33 N -0.74 2.00 -0.19 0.58 -0.00 -1.26 -5.03 121.20 116.55 1j6y s ILE 33 Ca 0.00 -0.03 -0.14 0.00 -0.00 0.00 0.00 60.65 60.49 1j6y s ILE 33 Cb 0.00 -2.98 -0.04 0.00 -0.00 0.00 0.00 42.46 39.44 1j6y s ILE 33 CO 0.00 0.00 0.30 -0.63 -0.00 0.00 0.00 174.94 174.61 1j6y s ILE 34 N -3.90 5.28 1.00 8.37 1.01 -1.26 -5.06 121.20 126.64 1j6y s ILE 34 Ca 0.75 0.52 -0.16 0.00 0.00 0.00 0.00 60.65 61.77 1j6y s ILE 34 Cb -0.03 -3.64 -0.02 0.00 0.01 0.00 0.00 42.46 38.79 1j6y s ILE 34 CO 0.53 0.33 -0.13 0.18 0.00 0.00 0.00 174.94 175.86 1j6y n LEU 35 N 4.01 -2.30 -3.75 2.97 7.99 -1.26 -5.00 117.00 119.66 1j6y n LEU 35 Ca -0.11 0.19 -0.13 0.00 -0.01 0.00 0.00 56.01 55.94 1j6y n LEU 35 Cb 0.52 -0.99 -0.10 0.00 -0.11 0.00 0.00 43.42 42.73 1j6y n LEU 35 CO 0.39 -4.08 0.03 0.42 -1.51 0.00 0.00 177.39 172.64 1j6y s THR 36 N -2.24 0.02 0.00 -5.08 -4.23 -1.26 -4.92 115.64 97.94 1j6y s THR 36 Ca 0.51 -0.19 0.00 0.00 -1.18 0.00 0.00 61.69 60.83 1j6y s THR 36 Cb -0.16 -0.56 0.00 0.00 1.34 0.00 0.00 72.50 73.12 1j6y s THR 36 CO 0.71 -0.10 0.32 0.41 -0.54 0.00 0.00 174.62 175.41 1j6y n THR 37 N 2.21 0.00 0.00 3.99 -1.04 -1.26 -4.59 114.28 113.59 1j6y n THR 37 Ca -0.17 0.74 0.00 0.00 -2.04 0.00 0.00 64.05 62.58 1j6y n THR 37 Cb 0.57 -1.59 0.00 0.00 -1.82 0.00 0.00 70.33 67.49 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 -0.37 0.00 -0.08 12.58 -2.24 -1.26 -4.44 114.28 118.47 1j6y n THR 38 Ca 0.00 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.66 1j6y n THR 38 Cb 0.00 0.00 -0.05 0.00 -2.10 0.00 0.00 70.33 68.18 1j6y n THR 38 CO 0.00 0.00 0.00 0.08 -0.57 0.00 0.00 175.07 174.58 1j6y h ARG 39 N 0.00 0.48 0.03 -0.78 0.11 -1.93 0.16 114.38 112.46 1j6y h ARG 39 Ca 0.00 -0.21 -0.00 0.00 0.10 0.00 0.00 59.98 59.87 1j6y h ARG 39 Cb 0.00 -0.02 0.00 0.00 1.11 0.00 0.00 29.97 31.06 1j6y h ARG 39 CO 0.00 0.75 -0.02 1.49 0.10 0.00 0.00 179.97 182.29 1j6y h GLU 40 N 0.20 -0.04 0.27 0.08 4.81 -2.00 -2.81 114.58 115.08 1j6y h GLU 40 Ca 0.05 0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.29 1j6y h GLU 40 Cb 0.60 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.95 1j6y h GLU 40 CO 0.03 0.25 -0.39 0.00 -0.73 0.00 0.00 179.01 178.17 1j6y h ALA 41 N 0.61 -0.78 -0.43 2.92 0.00 -1.90 -2.41 119.26 117.27 1j6y h ALA 41 Ca -0.00 -0.11 0.04 0.00 0.00 0.00 0.00 54.91 54.84 1j6y h ALA 41 Cb 0.31 0.61 -0.06 0.00 0.00 0.00 0.00 17.79 18.65 1j6y h ALA 41 CO 0.01 -0.99 -0.30 0.00 0.00 0.00 0.00 179.25 177.97 1j6y h ALA 42 N -0.28 -0.37 -1.19 0.00 0.00 -0.68 1.17 119.26 117.92 1j6y h ALA 42 Ca -0.01 0.04 0.38 0.00 0.00 0.00 0.00 54.91 55.32 1j6y h ALA 42 Cb 0.69 1.12 -0.13 0.00 0.00 0.00 0.00 17.79 19.47 1j6y h ALA 42 CO -0.14 -0.56 0.75 0.28 0.00 0.00 0.00 179.25 179.58 1j6y h VAL 43 N -0.06 0.24 -0.13 0.00 2.07 -1.33 1.38 116.25 118.41 1j6y h VAL 43 Ca 0.07 -0.06 -0.03 0.00 0.82 0.00 0.00 66.70 67.49 1j6y h VAL 43 Cb 0.24 0.03 -0.00 0.00 -1.52 0.00 0.00 31.29 30.04 1j6y h VAL 43 CO -0.44 0.03 -0.05 -0.08 0.02 0.00 0.00 177.57 177.06 1j6y h GLU 44 N 0.19 0.26 -0.43 1.57 4.57 0.18 1.63 114.58 122.54 1j6y h GLU 44 Ca 0.76 -0.11 -0.13 0.00 -1.18 0.00 0.00 59.36 58.70 1j6y h GLU 44 Cb 2.18 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 30.75 1j6y h GLU 44 CO -0.43 0.58 -0.25 0.37 -1.18 0.00 0.00 179.01 178.09 1j6y h GLN 45 N -0.07 0.94 -0.15 1.92 5.75 0.34 -3.04 115.11 120.80 1j6y h GLN 45 Ca 0.03 -0.43 -0.21 0.00 -0.15 0.00 0.00 58.65 57.89 1j6y h GLN 45 Cb 0.49 -0.02 0.01 0.00 1.07 0.00 0.00 27.48 29.03 1j6y h GLN 45 CO 0.02 1.09 -0.73 1.25 -2.65 0.00 0.00 178.83 177.81 1j6y h LEU 46 N 0.77 0.89 -0.77 -2.39 6.46 0.15 -2.86 115.31 117.57 1j6y h LEU 46 Ca 0.09 -0.63 0.15 0.00 -0.12 0.00 0.00 57.88 57.37 1j6y h LEU 46 Cb 0.83 -0.26 -0.15 0.00 -0.73 0.00 0.00 40.66 40.35 1j6y h LEU 46 CO 0.07 1.38 -0.20 0.50 -0.62 0.00 0.00 178.44 179.58 1j6y h LYS 47 N 0.47 -0.00 0.00 1.25 3.64 0.25 0.98 116.57 123.15 1j6y h LYS 47 Ca -0.05 0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.24 1j6y h LYS 47 Cb 1.36 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.17 1j6y h LYS 47 CO 0.15 -0.00 -0.43 0.77 -2.27 0.00 0.00 179.45 177.67 1j6y h SER 48 N -0.00 0.00 0.17 4.20 0.02 -1.54 -3.11 113.55 113.29 1j6y h SER 48 Ca 0.37 0.00 0.02 0.00 -0.84 0.00 0.00 61.79 61.33 1j6y h SER 48 Cb 0.56 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.06 1j6y h SER 48 CO -0.79 0.43 -0.34 -0.29 -1.14 0.00 0.00 176.83 174.70 1j6y h ILE 49 N 0.00 0.29 -0.51 3.27 -0.00 0.12 1.95 117.51 122.63 1j6y h ILE 49 Ca -0.00 0.00 0.09 0.00 -0.00 0.00 0.00 64.86 64.94 1j6y h ILE 49 Cb 0.80 0.29 -0.07 0.00 -0.00 0.00 0.00 36.82 37.83 1j6y h ILE 49 CO 0.06 0.00 0.09 -0.09 -0.00 0.00 0.00 178.15 178.21 1j6y h ARG 50 N -0.60 0.22 0.53 2.19 1.12 -1.40 1.60 114.38 118.04 1j6y h ARG 50 Ca 0.02 -0.01 -0.03 0.00 -1.11 0.00 0.00 59.98 58.85 1j6y h ARG 50 Cb 0.61 -0.05 0.01 0.00 -0.01 0.00 0.00 29.97 30.52 1j6y h ARG 50 CO -0.17 0.14 -0.25 1.49 -3.11 0.00 0.00 179.97 178.07 1j6y h GLU 51 N 0.23 -0.68 0.03 0.20 4.57 -1.22 1.22 114.58 118.92 1j6y h GLU 51 Ca 0.26 0.05 0.02 0.00 -1.18 0.00 0.00 59.36 58.50 1j6y h GLU 51 Cb 0.35 0.16 -0.03 0.00 -0.16 0.00 0.00 28.75 29.07 1j6y h GLU 51 CO -0.34 -0.45 -0.17 0.22 -1.18 0.00 0.00 179.01 177.08 1j6y h ASP 52 N -0.72 -0.50 0.11 1.04 1.82 0.39 0.17 116.42 118.72 1j6y h ASP 52 Ca -0.07 0.07 -0.01 0.00 -0.39 0.00 0.00 57.03 56.63 1j6y h ASP 52 Cb 0.55 0.20 -0.00 0.00 0.68 0.00 0.00 39.33 40.76 1j6y h ASP 52 CO 0.12 -0.24 -0.04 0.40 -1.61 0.00 0.00 179.24 177.87 1j6y h ILE 53 N -0.30 0.54 -0.32 2.25 2.04 0.25 -1.83 117.51 120.13 1j6y h ILE 53 Ca 0.05 -0.16 -0.03 0.00 1.00 0.00 0.00 64.86 65.72 1j6y h ILE 53 Cb 0.36 1.10 -0.01 0.00 -0.74 0.00 0.00 36.82 37.53 1j6y h ILE 53 CO -0.14 0.04 0.09 0.58 0.00 0.00 0.00 178.15 178.71 1j6y h VAL 54 N 0.00 1.21 -1.62 1.67 2.07 0.44 -3.35 116.25 116.67 1j6y h VAL 54 Ca -0.00 -0.69 -0.46 0.00 0.82 0.00 0.00 66.70 66.37 1j6y h VAL 54 Cb 0.10 1.06 0.05 0.00 -1.52 0.00 0.00 31.29 30.98 1j6y h VAL 54 CO 0.00 0.23 -0.04 -0.44 0.02 0.00 0.00 177.57 177.35 1j6y s SER 55 N -5.85 4.93 -1.69 0.57 0.01 -0.64 -4.46 113.70 106.58 1j6y s SER 55 Ca -0.13 -0.49 -0.14 0.00 1.31 0.00 0.00 55.95 56.50 1j6y s SER 55 Cb 0.09 -0.11 0.14 0.00 0.21 0.00 0.00 66.02 66.34 1j6y s SER 55 CO 0.74 -1.42 0.34 0.61 0.41 0.00 0.00 173.24 173.92 1j6y n GLY 56 N -2.42 -0.28 1.54 3.44 0.00 -1.26 -3.02 105.19 103.20 1j6y n GLY 56 Ca 0.13 0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.26 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 -4.15 -0.47 -0.56 1.61 0.00 -1.26 -4.75 118.16 108.58 1j6y n LYS 57 Ca -0.06 -0.19 -0.25 0.00 0.00 0.00 0.00 58.31 57.81 1j6y n LYS 57 Cb 0.53 0.33 0.17 0.00 0.00 0.00 0.00 35.03 36.07 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 -0.42 -2.62 -1.16 3.14 0.00 -1.17 -5.02 120.51 113.27 1j6y n ALA 58 Ca 0.00 -1.24 0.00 0.00 0.00 0.00 0.00 53.44 52.20 1j6y n ALA 58 Cb 0.00 -1.20 0.00 0.00 0.00 0.00 0.00 19.45 18.25 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 -1.80 0.00 0.00 0.00 4.13 -1.26 -5.04 115.26 111.29 1j6y n ASN 59 Ca 0.04 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.30 1j6y n ASN 59 Cb 0.49 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.73 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 -0.21 0.00 3.10 -0.00 -1.26 -4.99 117.46 114.10 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 0.04 0.00 0.00 -0.00 0.00 0.00 39.48 39.52 1j6y n PHE 60 CO 0.00 0.00 0.00 -0.85 -0.00 0.00 0.00 176.76 175.91 1j6y n GLU 61 N -1.55 0.00 -0.54 -4.13 0.00 -1.26 -0.97 120.64 112.18 1j6y n GLU 61 Ca 0.00 0.00 0.43 0.00 0.00 0.00 0.00 57.16 57.60 1j6y n GLU 61 Cb 0.00 -0.52 0.70 0.00 0.00 0.00 0.00 31.44 31.62 1j6y n GLU 61 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 1j6y n GLU 62 N -0.02 -0.02 -0.31 3.44 -0.58 -1.26 0.26 120.64 122.15 1j6y n GLU 62 Ca 0.00 1.12 -0.04 0.00 -0.42 0.00 0.00 57.16 57.82 1j6y n GLU 62 Cb 0.00 -2.35 0.08 0.00 -0.57 0.00 0.00 31.44 28.60 1j6y n GLU 62 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 1j6y h VAL 63 N 0.00 1.23 0.52 2.62 2.07 -1.90 -2.73 116.25 118.07 1j6y h VAL 63 Ca 0.86 -0.50 -0.03 0.00 0.82 0.00 0.00 66.70 67.85 1j6y h VAL 63 Cb 3.07 0.05 0.01 0.00 -1.52 0.00 0.00 31.29 32.90 1j6y h VAL 63 CO -0.26 0.24 -0.25 0.00 0.02 0.00 0.00 177.57 177.32 1j6y h ALA 64 N 1.28 -0.70 -1.45 1.67 0.00 0.53 0.29 119.26 120.87 1j6y h ALA 64 Ca 0.30 -0.19 0.45 0.00 0.00 0.00 0.00 54.91 55.47 1j6y h ALA 64 Cb -0.05 0.27 -0.11 0.00 0.00 0.00 0.00 17.79 17.90 1j6y h ALA 64 CO -0.06 -0.79 0.98 1.15 0.00 0.00 0.00 179.25 180.53 1j6y h THR 65 N -0.92 0.14 0.00 0.00 2.02 -1.34 -0.90 112.91 111.91 1j6y h THR 65 Ca -0.07 -0.02 -0.08 0.00 0.77 0.00 0.00 66.41 67.00 1j6y h THR 65 Cb 0.61 0.07 -0.01 0.00 -1.74 0.00 0.00 68.15 67.08 1j6y h THR 65 CO 0.12 0.01 -0.69 -0.09 0.37 0.00 0.00 175.52 175.24 1j6y h ARG 66 N 0.07 0.00 -2.91 6.66 2.43 -1.17 -3.39 114.38 116.07 1j6y h ARG 66 Ca 0.81 0.00 -0.79 0.00 -0.81 0.00 0.00 59.98 59.20 1j6y h ARG 66 Cb 2.77 0.00 -0.22 0.00 -0.42 0.00 0.00 29.97 32.10 1j6y h ARG 66 CO -0.28 0.41 1.41 1.55 -1.51 0.00 0.00 179.97 181.56 1j6y n VAL 67 N -4.57 5.20 -4.43 0.20 3.14 1.00 -4.96 118.33 113.90 1j6y n VAL 67 Ca -0.15 -5.29 -0.22 0.00 -2.96 0.00 0.00 64.34 55.72 1j6y n VAL 67 Cb 0.40 -2.06 -0.09 0.00 -1.06 0.00 0.00 33.84 31.02 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 -0.68 2.20 -0.95 6.55 1.04 -0.44 0.25 113.70 121.67 1j6y s SER 68 Ca 0.38 -1.50 -0.18 0.00 0.48 0.00 0.00 55.95 55.13 1j6y s SER 68 Cb 0.11 0.22 -0.10 0.00 0.10 0.00 0.00 66.02 66.35 1j6y s SER 68 CO 0.01 -0.78 2.04 -0.67 0.98 0.00 0.00 173.24 174.82 1j6y n ASP 69 N -0.89 3.30 0.00 7.02 -0.08 -1.26 -4.54 116.55 120.10 1j6y n ASP 69 Ca -0.03 -2.65 0.00 0.00 -1.51 0.00 0.00 54.79 50.60 1j6y n ASP 69 Cb 0.66 -1.23 0.00 0.00 2.34 0.00 0.00 41.12 42.89 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 -0.44 -0.97 0.00 0.87 -1.95 2.21 113.55 113.28 1j6y h SER 71 Ca 0.00 0.22 0.21 0.00 -1.23 0.00 0.00 61.79 60.99 1j6y h SER 71 Cb 0.00 0.40 -0.08 0.00 -0.44 0.00 0.00 62.40 62.27 1j6y h SER 71 CO 0.00 -0.22 0.62 0.28 -0.53 0.00 0.00 176.83 176.98 1j6y h SER 72 N 0.07 0.54 -1.02 6.23 0.02 -1.35 1.41 113.55 119.45 1j6y h SER 72 Ca 0.44 0.07 0.26 0.00 -0.84 0.00 0.00 61.79 61.72 1j6y h SER 72 Cb 0.79 -0.03 -0.08 0.00 0.14 0.00 0.00 62.40 63.22 1j6y h SER 72 CO -0.74 0.19 0.67 0.00 -1.14 0.00 0.00 176.83 175.82 1j6y h ALA 73 N 1.62 2.34 0.02 3.77 0.00 0.35 2.85 119.26 130.21 1j6y h ALA 73 Ca 0.53 0.04 -0.21 0.00 0.00 0.00 0.00 54.91 55.27 1j6y h ALA 73 Cb 1.14 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.94 1j6y h ALA 73 CO -0.26 -0.71 -0.97 -0.22 0.00 0.00 0.00 179.25 177.09 1j6y h LYS 74 N 0.34 0.09 -2.03 0.00 3.64 0.19 -3.33 116.57 115.48 1j6y h LYS 74 Ca 0.56 -0.13 -0.59 0.00 -1.27 0.00 0.00 60.65 59.22 1j6y h LYS 74 Cb 1.53 0.04 -0.42 0.00 -0.41 0.00 0.00 32.23 32.97 1j6y h LYS 74 CO -0.23 0.98 -0.65 -2.13 -2.27 0.00 0.00 179.45 175.16 1j6y n ARG 75 N -3.50 3.33 0.00 1.90 0.63 0.73 -4.82 116.66 114.92 1j6y n ARG 75 Ca -0.02 -4.74 0.11 0.00 -0.92 0.00 0.00 57.85 52.27 1j6y n ARG 75 Cb 0.89 -2.25 0.59 0.00 0.45 0.00 0.00 32.46 32.14 1j6y n ARG 75 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1j6y n GLY 76 N -0.33 -0.86 0.00 5.14 0.00 0.79 -4.39 105.19 105.54 1j6y n GLY 76 Ca 0.34 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.24 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 0.47 -0.63 3.39 -0.02 0.00 -1.26 -4.55 105.19 102.59 1j6y n GLY 77 Ca 0.13 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.04 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 -1.63 0.18 -0.01 1.61 -4.77 -1.26 -3.31 116.67 107.49 1j6y s ASP 78 Ca 0.00 -1.22 -0.22 0.00 -3.30 0.00 0.00 52.55 47.81 1j6y s ASP 78 Cb 0.00 0.50 -0.21 0.00 -1.09 0.00 0.00 42.92 42.12 1j6y s ASP 78 CO 0.00 -1.02 1.14 -0.07 0.70 0.00 0.00 175.17 175.92 1j6y h LEU 79 N 2.40 0.36 0.00 2.11 4.07 -1.03 -3.47 115.31 119.74 1j6y h LEU 79 Ca -0.31 -0.68 0.00 0.00 0.08 0.00 0.00 57.88 56.97 1j6y h LEU 79 Cb 1.25 -0.11 0.00 0.00 1.08 0.00 0.00 40.66 42.88 1j6y h LEU 79 CO 0.44 0.99 0.00 0.61 -1.08 0.00 0.00 178.44 179.39 1j6y n GLY 80 N 0.80 2.15 3.52 0.83 0.00 -0.80 -4.94 105.19 106.73 1j6y n GLY 80 Ca -0.09 -0.68 -0.12 0.00 0.00 0.00 0.00 46.02 45.13 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 -2.30 -0.69 0.00 1.61 1.04 -1.26 -2.83 113.70 109.28 1j6y s SER 81 Ca 0.00 1.26 0.00 0.00 0.48 0.00 0.00 55.95 57.69 1j6y s SER 81 Cb 0.00 1.23 0.00 0.00 0.10 0.00 0.00 66.02 67.35 1j6y s SER 81 CO 0.00 -0.22 0.00 2.22 0.98 0.00 0.00 173.24 176.22 1j6y n PHE 82 N 3.21 0.00 0.00 5.02 -1.74 -1.13 -4.95 117.46 117.88 1j6y n PHE 82 Ca -0.16 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.73 1j6y n PHE 82 Cb 0.56 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.56 1j6y n PHE 82 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 1j6y n GLY 83 N 0.00 2.75 1.61 4.97 0.00 -1.26 -2.17 105.19 111.08 1j6y n GLY 83 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.97 1j6y n GLY 83 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1j6y n ARG 84 N 0.00 -4.54 0.00 1.61 5.12 -1.26 -4.40 116.66 113.18 1j6y n ARG 84 Ca 0.00 3.32 0.00 0.00 -1.93 0.00 0.00 57.85 59.24 1j6y n ARG 84 Cb 0.00 -3.70 0.00 0.00 -1.16 0.00 0.00 32.46 27.60 1j6y n ARG 84 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1j6y n GLY 85 N -0.16 0.81 0.00 -0.13 0.00 -1.26 -4.59 105.19 99.86 1j6y n GLY 85 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 -1.48 1.61 1.13 -1.26 -1.85 117.38 115.53 1j6y n GLN 86 Ca 0.00 0.53 -0.33 0.00 -1.94 0.00 0.00 57.00 55.25 1j6y n GLN 86 Cb 0.00 -0.98 0.05 0.00 0.11 0.00 0.00 30.24 29.42 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 -1.27 2.56 0.00 -1.09 2.81 -1.26 -5.04 117.12 113.84 1j6y n MET 87 Ca 0.00 -3.03 0.00 0.00 -1.81 0.00 0.00 57.70 52.86 1j6y n MET 87 Cb 0.00 -2.18 0.00 0.00 -0.71 0.00 0.00 33.22 30.33 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 -0.43 0.00 -0.01 0.03 6.02 -0.77 -2.37 117.38 119.85 1j6y n GLN 88 Ca 0.54 0.00 -0.07 0.00 -0.01 0.00 0.00 57.00 57.46 1j6y n GLN 88 Cb 0.50 0.00 -0.13 0.00 1.02 0.00 0.00 30.24 31.63 1j6y n GLN 88 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 177.06 175.83 1j6y h LYS 89 N 0.00 0.00 0.19 -1.09 3.64 -1.96 -3.32 116.57 114.04 1j6y h LYS 89 Ca 0.00 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 1j6y h LYS 89 Cb 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 1j6y h LYS 89 CO 0.00 0.50 -0.09 -1.00 -2.27 0.00 0.00 179.45 176.59 1j6y h PRO 90 N 0.00 -0.25 0.20 1.90 0.13 -1.99 -1.74 132.00 130.24 1j6y h PRO 90 Ca -0.25 0.02 0.01 0.00 -0.87 0.00 0.00 66.00 64.91 1j6y h PRO 90 Cb 1.93 0.06 -0.04 0.00 0.13 0.00 0.00 31.00 33.08 1j6y h PRO 90 CO 0.08 -0.17 -0.50 0.35 -0.23 0.00 0.00 178.00 177.53 1j6y h PHE 91 N -0.48 -1.43 -0.65 1.56 3.04 -1.78 -0.47 116.94 116.73 1j6y h PHE 91 Ca -0.03 0.03 0.08 0.00 3.98 0.00 0.00 57.97 62.04 1j6y h PHE 91 Cb 0.20 0.60 -0.11 0.00 2.56 0.00 0.00 35.95 39.20 1j6y h PHE 91 CO 0.06 -0.58 -0.50 1.49 -2.02 0.00 0.00 178.31 176.76 1j6y h GLU 92 N -0.77 -0.21 -1.08 1.11 4.57 -1.56 2.29 114.58 118.94 1j6y h GLU 92 Ca -0.02 0.01 0.31 0.00 -1.18 0.00 0.00 59.36 58.49 1j6y h GLU 92 Cb 0.74 0.05 -0.04 0.00 -0.16 0.00 0.00 28.75 29.34 1j6y h GLU 92 CO -0.22 -0.14 0.82 1.49 -1.18 0.00 0.00 179.01 179.77 1j6y h GLU 93 N -0.21 0.00 0.62 1.92 4.81 -0.78 0.84 114.58 121.78 1j6y h GLU 93 Ca 0.15 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.35 1j6y h GLU 93 Cb 0.54 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.93 1j6y h GLU 93 CO -0.74 0.00 -0.30 0.00 -0.73 0.00 0.00 179.01 177.24 1j6y h ALA 94 N 1.38 -0.90 0.00 2.92 0.00 0.55 0.83 119.26 124.05 1j6y h ALA 94 Ca 0.51 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 55.18 1j6y h ALA 94 Cb 2.14 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 20.25 1j6y h ALA 94 CO -0.01 -0.83 -0.27 1.15 0.00 0.00 0.00 179.25 179.29 1j6y h THR 95 N -1.13 0.92 0.00 0.00 2.02 -0.43 0.13 112.91 114.42 1j6y h THR 95 Ca -0.09 -1.04 -0.10 0.00 0.77 0.00 0.00 66.41 65.95 1j6y h THR 95 Cb 0.64 1.61 -0.01 0.00 -1.74 0.00 0.00 68.15 68.65 1j6y h THR 95 CO 0.14 0.27 -0.47 1.88 0.37 0.00 0.00 175.52 177.71 1j6y h TYR 96 N 0.00 0.00 0.11 3.16 0.05 0.70 -3.31 116.97 117.68 1j6y h TYR 96 Ca -0.00 0.00 -0.30 0.00 0.05 0.00 0.00 58.73 58.48 1j6y h TYR 96 Cb 0.59 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.32 1j6y h TYR 96 CO 0.00 0.47 -1.58 0.00 -1.05 0.00 0.00 178.16 176.00 1j6y h ALA 97 N 1.53 0.25 -2.67 3.88 0.00 0.15 -3.46 119.26 118.95 1j6y h ALA 97 Ca -0.00 -1.19 -0.55 0.00 0.00 0.00 0.00 54.91 53.17 1j6y h ALA 97 Cb 1.27 0.57 -0.04 0.00 0.00 0.00 0.00 17.79 19.59 1j6y h ALA 97 CO 0.06 0.96 0.13 -1.17 0.00 0.00 0.00 179.25 179.23 1j6y s LEU 98 N -7.43 4.42 -0.87 0.00 2.96 0.39 -4.99 118.68 113.15 1j6y s LEU 98 Ca -0.21 1.37 0.01 0.00 -0.22 0.00 0.00 54.13 55.08 1j6y s LEU 98 Cb 0.05 -3.18 0.29 0.00 0.50 0.00 0.00 46.19 43.85 1j6y s LEU 98 CO 0.75 -0.01 1.20 2.29 -1.32 0.00 0.00 176.35 179.26 1j6y n LYS 99 N 3.04 3.74 -2.15 1.98 2.85 -1.26 -4.76 118.16 121.59 1j6y n LYS 99 Ca -0.02 -4.64 0.00 0.00 -1.05 0.00 0.00 58.31 52.60 1j6y n LYS 99 Cb 0.51 -2.39 0.00 0.00 -0.65 0.00 0.00 35.03 32.49 1j6y n LYS 99 CO 0.00 0.00 0.00 1.55 -0.05 0.00 0.00 177.40 178.90 1j6y n VAL 100 N 0.91 0.00 0.49 0.58 3.14 -1.26 -4.64 118.33 117.55 1j6y n VAL 100 Ca 0.30 0.00 0.09 0.00 -2.96 0.00 0.00 64.34 61.76 1j6y n VAL 100 Cb 0.36 0.00 -0.12 0.00 -1.06 0.00 0.00 33.84 33.02 1j6y n VAL 100 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1j6y n GLY 101 N -0.40 -0.72 0.00 7.55 0.00 -1.26 -4.83 105.19 105.53 1j6y n GLY 101 Ca 0.00 -0.47 0.00 0.00 0.00 0.00 0.00 46.02 45.55 1j6y n GLY 101 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1j6y n ASP 102 N -1.70 0.00 -2.68 1.61 9.92 -1.26 -5.08 116.55 117.36 1j6y n ASP 102 Ca 0.01 0.00 -0.16 0.00 -0.53 0.00 0.00 54.79 54.11 1j6y n ASP 102 Cb 0.35 0.00 0.01 0.00 -0.64 0.00 0.00 41.12 40.84 1j6y n ASP 102 CO 0.00 0.00 0.00 -0.38 0.13 0.00 0.00 177.20 176.95 1j6y n ILE 103 N 0.00 1.34 -2.80 0.53 5.41 -1.26 -5.00 119.36 117.58 1j6y n ILE 103 Ca 0.00 -3.82 0.00 0.00 1.00 0.00 0.00 62.75 59.93 1j6y n ILE 103 Cb 0.00 -0.03 0.00 0.00 -0.71 0.00 0.00 39.64 38.90 1j6y n ILE 103 CO 0.00 0.00 0.00 -1.20 0.00 0.00 0.00 176.55 175.35 1j6y n SER 104 N -0.15 -6.34 -3.72 4.38 7.64 -1.26 -4.47 113.62 109.71 1j6y n SER 104 Ca 0.20 0.62 -0.21 0.00 1.01 0.00 0.00 58.87 60.49 1j6y n SER 104 Cb 0.74 -1.38 0.15 0.00 -1.01 0.00 0.00 64.21 62.71 1j6y n SER 104 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1j6y n ASP 105 N 1.88 -2.92 -4.00 6.43 9.92 -1.26 -4.47 116.55 122.12 1j6y n ASP 105 Ca 0.00 -0.34 -0.53 0.00 -0.53 0.00 0.00 54.79 53.39 1j6y n ASP 105 Cb 0.21 -0.79 -0.07 0.00 -0.64 0.00 0.00 41.12 39.82 1j6y n ASP 105 CO 0.00 0.00 0.00 2.30 0.13 0.00 0.00 177.20 179.63 1j6y n ILE 106 N -4.40 0.00 -3.19 0.53 -5.35 -1.26 -4.87 119.36 100.82 1j6y n ILE 106 Ca 0.05 0.00 -0.28 0.00 -0.27 0.00 0.00 62.75 62.25 1j6y n ILE 106 Cb 0.41 -0.06 -0.06 0.00 -1.74 0.00 0.00 39.64 38.20 1j6y n ILE 106 CO 0.00 0.00 0.00 0.52 -1.76 0.00 0.00 176.55 175.31 1j6y n VAL 107 N 1.61 2.81 -2.35 7.28 0.31 -0.84 -4.90 118.33 122.25 1j6y n VAL 107 Ca 0.19 -5.41 -0.37 0.00 -0.01 0.00 0.00 64.34 58.74 1j6y n VAL 107 Cb 0.05 -1.79 -0.04 0.00 -0.91 0.00 0.00 33.84 31.16 1j6y n VAL 107 CO 0.00 0.00 0.00 1.51 -1.32 0.00 0.00 176.83 177.02 1j6y s ASP 108 N -2.88 5.90 0.00 4.52 -4.77 -1.26 -0.11 116.67 118.07 1j6y s ASP 108 Ca 0.44 -0.83 0.00 0.00 -3.30 0.00 0.00 52.55 48.86 1j6y s ASP 108 Cb 0.20 -2.56 0.00 0.00 -1.09 0.00 0.00 42.92 39.47 1j6y s ASP 108 CO -0.07 -2.02 0.00 1.07 0.70 0.00 0.00 175.17 174.85 1j6y n THR 109 N 7.11 0.00 -1.41 2.11 5.66 -0.54 -4.79 114.28 122.43 1j6y n THR 109 Ca 0.28 0.00 -0.48 0.00 -3.05 0.00 0.00 64.05 60.80 1j6y n THR 109 Cb 0.50 0.00 -0.14 0.00 -1.55 0.00 0.00 70.33 69.14 1j6y n THR 109 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 1j6y n ASP 110 N 0.00 0.50 0.00 1.09 2.03 -1.26 -0.53 116.55 118.38 1j6y n ASP 110 Ca 0.00 0.36 0.00 0.00 0.52 0.00 0.00 54.79 55.67 1j6y n ASP 110 Cb 0.00 -0.92 0.00 0.00 -0.72 0.00 0.00 41.12 39.48 1j6y n ASP 110 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 1j6y n SER 111 N 9.45 0.00 0.00 1.67 2.88 -1.26 -4.75 113.62 121.61 1j6y n SER 111 Ca 0.61 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 58.15 1j6y n SER 111 Cb 0.01 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.47 1j6y n SER 111 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1j6y n GLY 112 N 0.00 -0.50 3.65 0.46 0.00 0.31 -4.74 105.19 104.37 1j6y n GLY 112 Ca 0.00 -0.98 -0.46 0.00 0.00 0.00 0.00 46.02 44.59 1j6y n GLY 112 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1j6y n VAL 113 N 8.71 1.03 -4.16 1.61 0.24 -1.25 -1.47 118.33 123.04 1j6y n VAL 113 Ca 0.00 -0.26 -0.11 0.00 -2.04 0.00 0.00 64.34 61.94 1j6y n VAL 113 Cb 0.00 -1.32 -0.10 0.00 -1.47 0.00 0.00 33.84 30.96 1j6y n VAL 113 CO 0.00 0.00 0.00 -1.00 -2.14 0.00 0.00 176.83 173.69 1j6y s HIS 114 N -0.18 0.96 0.18 6.34 4.02 0.84 -3.02 115.29 124.42 1j6y s HIS 114 Ca 0.68 -1.27 0.06 0.00 1.02 0.00 0.00 55.06 55.56 1j6y s HIS 114 Cb -0.69 -0.48 -0.05 0.00 -1.02 0.00 0.00 32.58 30.34 1j6y s HIS 114 CO 0.51 -0.59 -0.12 0.96 1.02 0.00 0.00 174.74 176.53 1j6y s ILE 115 N -4.09 1.45 0.11 0.60 -4.36 -1.01 -1.99 121.20 111.91 1j6y s ILE 115 Ca 0.30 -2.14 -0.07 0.00 -0.26 0.00 0.00 60.65 58.48 1j6y s ILE 115 Cb 0.07 -1.96 -0.01 0.00 1.25 0.00 0.00 42.46 41.80 1j6y s ILE 115 CO 0.06 -0.66 0.17 -0.63 0.24 0.00 0.00 174.94 174.13 1j6y s ILE 116 N -3.15 0.13 -0.04 8.37 1.01 -1.26 -2.65 121.20 123.61 1j6y s ILE 116 Ca 0.20 -1.37 -0.15 0.00 0.00 0.00 0.00 60.65 59.32 1j6y s ILE 116 Cb 0.01 -1.55 0.03 0.00 0.01 0.00 0.00 42.46 40.96 1j6y s ILE 116 CO 0.04 -0.59 0.34 -0.75 0.00 0.00 0.00 174.94 173.98 1j6y s LYS 117 N -3.91 0.65 0.15 2.79 2.20 -1.12 -4.03 119.74 116.47 1j6y s LYS 117 Ca 0.10 -0.05 -0.24 0.00 -0.36 0.00 0.00 55.97 55.42 1j6y s LYS 117 Cb 0.05 0.29 0.07 0.00 -1.51 0.00 0.00 37.83 36.73 1j6y s LYS 117 CO -0.07 -0.17 0.69 0.50 -0.36 0.00 0.00 175.35 175.94 1j6y s ARG 118 N -1.06 1.29 2.58 4.03 3.52 -1.26 -2.04 118.95 126.01 1j6y s ARG 118 Ca -0.11 -0.54 0.00 0.00 -0.13 0.00 0.00 55.73 54.95 1j6y s ARG 118 Cb -0.04 0.55 0.00 0.00 -1.56 0.00 0.00 34.95 33.89 1j6y s ARG 118 CO 0.04 -0.57 0.00 2.41 -0.81 0.00 0.00 175.30 176.37 1j6y n THR 119 N -0.38 0.00 -0.73 4.11 -1.04 -1.26 -4.31 114.28 110.67 1j6y n THR 119 Ca -0.13 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.88 1j6y n THR 119 Cb 0.63 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.14 1j6y n THR 119 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43