#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 -3.65 -0.41 -0.00 -1.26 -4.92 117.12 106.88 1j6y n MET 2 Ca 0.00 -1.25 -0.39 0.00 -0.00 0.00 0.00 57.70 56.06 1j6y n MET 2 Cb 0.00 -0.33 -0.11 0.00 -0.00 0.00 0.00 33.22 32.78 1j6y n MET 2 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1j6y s ALA 3 N 0.00 3.22 -1.28 3.17 0.00 -1.26 -4.65 121.76 120.96 1j6y s ALA 3 Ca 0.09 -1.95 -0.08 0.00 0.00 0.00 0.00 51.96 50.02 1j6y s ALA 3 Cb 0.11 -2.53 -0.00 0.00 0.00 0.00 0.00 23.12 20.70 1j6y s ALA 3 CO -0.05 -1.51 0.61 0.43 0.00 0.00 0.00 175.76 175.24 1j6y n SER 4 N 4.90 -2.39 -3.29 0.00 7.64 -1.26 -4.96 113.62 114.25 1j6y n SER 4 Ca -0.11 -0.98 0.00 0.00 1.01 0.00 0.00 58.87 58.79 1j6y n SER 4 Cb 0.44 -3.35 0.00 0.00 -1.01 0.00 0.00 64.21 60.29 1j6y n SER 4 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1j6y n ARG 5 N -4.30 0.78 0.00 1.43 5.12 -1.26 -5.08 116.66 113.35 1j6y n ARG 5 Ca -0.23 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.69 1j6y n ARG 5 Cb 0.65 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.95 1j6y n ARG 5 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 1j6y n ASP 6 N -0.37 0.00 -1.68 0.55 8.00 -1.26 -5.10 116.55 116.69 1j6y n ASP 6 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 1j6y n ASP 6 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 1j6y n ASP 6 CO 0.00 0.00 0.00 1.67 -0.39 0.00 0.00 177.20 178.48 1j6y n GLN 7 N 0.00 -4.83 -3.59 -1.24 7.27 -1.26 -4.99 117.38 108.74 1j6y n GLN 7 Ca 0.00 3.60 -0.22 0.00 0.07 0.00 0.00 57.00 60.45 1j6y n GLN 7 Cb 0.00 -4.04 -0.16 0.00 2.41 0.00 0.00 30.24 28.45 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 -3.43 -0.18 0.73 1.69 0.11 0.55 -4.95 120.40 114.92 1j6y s VAL 8 Ca 0.00 -0.02 -0.08 0.00 -2.93 0.00 0.00 61.98 58.95 1j6y s VAL 8 Cb 0.00 -0.52 0.07 0.00 -1.53 0.00 0.00 36.38 34.40 1j6y s VAL 8 CO 0.00 -0.16 1.06 -0.54 -3.33 0.00 0.00 175.10 172.13 1j6y s LYS 9 N 2.22 2.10 0.00 1.54 1.02 -1.26 -1.97 119.74 123.38 1j6y s LYS 9 Ca 0.04 -0.19 0.00 0.00 0.02 0.00 0.00 55.97 55.84 1j6y s LYS 9 Cb -0.15 -2.12 0.00 0.00 -0.52 0.00 0.00 37.83 35.04 1j6y s LYS 9 CO -0.09 -1.35 0.00 0.00 -0.92 0.00 0.00 175.35 172.99 1j6y n ALA 10 N -3.03 0.00 -2.62 5.17 0.00 -1.08 -4.80 120.51 114.15 1j6y n ALA 10 Ca 0.08 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.22 1j6y n ALA 10 Cb 0.61 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.99 1j6y n ALA 10 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1j6y s SER 11 N 0.00 4.26 0.19 0.00 0.15 -0.81 0.08 113.70 117.56 1j6y s SER 11 Ca 0.00 -1.46 -0.23 0.00 0.70 0.00 0.00 55.95 54.96 1j6y s SER 11 Cb 0.00 0.27 0.05 0.00 -1.71 0.00 0.00 66.02 64.63 1j6y s SER 11 CO 0.00 -0.83 0.76 -1.38 1.20 0.00 0.00 173.24 172.99 1j6y s HIS 12 N -2.80 -0.29 -0.27 3.44 -3.43 -1.20 -2.83 115.29 107.91 1j6y s HIS 12 Ca 0.20 -0.04 -0.09 0.00 -0.80 0.00 0.00 55.06 54.33 1j6y s HIS 12 Cb 0.02 0.64 0.12 0.00 -1.43 0.00 0.00 32.58 31.92 1j6y s HIS 12 CO 0.11 -0.97 0.59 0.42 -2.00 0.00 0.00 174.74 172.88 1j6y s ILE 13 N -3.65 -0.87 0.27 -5.38 1.01 -0.81 -4.68 121.20 107.09 1j6y s ILE 13 Ca 0.08 0.05 -0.11 0.00 0.00 0.00 0.00 60.65 60.66 1j6y s ILE 13 Cb -0.03 -0.90 -0.08 0.00 0.01 0.00 0.00 42.46 41.46 1j6y s ILE 13 CO -0.01 0.02 0.62 -0.22 0.00 0.00 0.00 174.94 175.35 1j6y s LEU 14 N 2.78 4.12 0.00 2.97 2.96 -1.19 -1.80 118.68 128.52 1j6y s LEU 14 Ca -0.05 1.05 0.00 0.00 -0.22 0.00 0.00 54.13 54.91 1j6y s LEU 14 Cb -0.12 -3.83 0.00 0.00 0.50 0.00 0.00 46.19 42.74 1j6y s LEU 14 CO -0.17 -0.13 0.00 -0.38 -1.32 0.00 0.00 176.35 174.34 1j6y n ILE 15 N -0.28 0.00 -3.65 6.68 5.41 -0.99 -3.01 119.36 123.52 1j6y n ILE 15 Ca 0.02 0.00 -0.02 0.00 1.00 0.00 0.00 62.75 63.75 1j6y n ILE 15 Cb 0.53 0.00 -0.07 0.00 -0.71 0.00 0.00 39.64 39.39 1j6y n ILE 15 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 176.55 174.96 1j6y s LYS 16 N 1.80 0.07 0.00 0.38 -2.85 -1.26 -4.81 119.74 113.06 1j6y s LYS 16 Ca 0.00 0.09 0.00 0.00 -1.00 0.00 0.00 55.97 55.06 1j6y s LYS 16 Cb 0.00 0.03 0.00 0.00 -2.06 0.00 0.00 37.83 35.80 1j6y s LYS 16 CO 0.00 -0.01 0.00 -2.39 0.10 0.00 0.00 175.35 173.05 1j6y n HIS 17 N 2.00 0.00 -1.74 1.78 1.44 -1.26 -4.51 115.22 112.93 1j6y n HIS 17 Ca -0.12 0.00 -0.41 0.00 -2.01 0.00 0.00 57.72 55.18 1j6y n HIS 17 Cb 0.57 0.00 -0.01 0.00 0.12 0.00 0.00 29.99 30.67 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 3.26 -1.33 -1.40 1.13 -1.24 -4.66 117.38 113.15 1j6y n GLN 18 Ca 0.00 -2.69 -0.31 0.00 -1.94 0.00 0.00 57.00 52.06 1j6y n GLN 18 Cb 0.00 -3.09 0.11 0.00 0.11 0.00 0.00 30.24 27.37 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 3.65 5.53 1.73 1.08 0.00 -1.26 -4.78 105.19 111.15 1j6y n GLY 19 Ca 0.57 -1.99 0.13 0.00 0.00 0.00 0.00 46.02 44.73 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 -0.97 -6.27 -0.55 1.61 7.64 -1.26 -4.90 113.62 108.91 1j6y n SER 20 Ca 0.60 1.05 0.00 0.00 1.01 0.00 0.00 58.87 61.53 1j6y n SER 20 Cb 0.94 -3.06 0.00 0.00 -1.01 0.00 0.00 64.21 61.08 1j6y n SER 20 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 1j6y n ARG 21 N -3.13 0.00 -3.89 1.43 3.00 -1.26 -4.65 116.66 108.16 1j6y n ARG 21 Ca 0.01 0.00 -0.30 0.00 -0.00 0.00 0.00 57.85 57.56 1j6y n ARG 21 Cb 0.44 0.00 -0.15 0.00 0.00 0.00 0.00 32.46 32.75 1j6y n ARG 21 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.63 176.65 1j6y s ARG 22 N 0.00 1.33 1.51 -0.14 1.70 -1.26 -4.99 118.95 117.09 1j6y s ARG 22 Ca 0.00 -1.05 0.00 0.00 -0.47 0.00 0.00 55.73 54.21 1j6y s ARG 22 Cb 0.00 -2.50 0.00 0.00 -0.57 0.00 0.00 34.95 31.88 1j6y s ARG 22 CO 0.00 -0.72 0.00 1.63 -1.08 0.00 0.00 175.30 175.13 1j6y n LYS 23 N 4.69 0.00 0.00 3.89 5.02 -1.26 -4.47 118.16 126.03 1j6y n LYS 23 Ca -0.08 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.21 1j6y n LYS 23 Cb 0.44 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.45 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 5.59 0.00 -2.68 7.82 0.00 -1.26 -5.04 120.51 124.93 1j6y n ALA 24 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.39 1j6y n ALA 24 Cb 0.00 0.00 0.11 0.00 0.00 0.00 0.00 19.45 19.56 1j6y n ALA 24 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1j6y n SER 25 N -0.41 -1.70 -4.18 0.00 2.88 -1.26 -5.08 113.62 103.87 1j6y n SER 25 Ca 0.00 -2.30 -0.39 0.00 -1.33 0.00 0.00 58.87 54.85 1j6y n SER 25 Cb 0.00 0.91 -0.10 0.00 -0.75 0.00 0.00 64.21 64.27 1j6y n SER 25 CO 0.00 0.00 0.00 0.26 -1.23 0.00 0.00 175.04 174.07 1j6y s TRP 26 N 0.16 3.49 0.00 0.66 0.52 -1.26 -4.98 118.94 117.53 1j6y s TRP 26 Ca 0.17 -2.07 0.00 0.00 0.02 0.00 0.00 56.10 54.21 1j6y s TRP 26 Cb 0.38 -3.35 0.00 0.00 -1.15 0.00 0.00 33.47 29.35 1j6y s TRP 26 CO -0.09 -0.98 0.00 1.63 0.02 0.00 0.00 176.95 177.53 1j6y n LYS 27 N 4.78 0.00 -3.43 4.98 5.02 -1.26 -4.78 118.16 123.47 1j6y n LYS 27 Ca -0.06 0.00 -0.33 0.00 -2.02 0.00 0.00 58.31 55.91 1j6y n LYS 27 Cb 0.41 0.00 0.03 0.00 -0.02 0.00 0.00 35.03 35.45 1j6y n LYS 27 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1j6y n ASP 28 N 3.02 -4.83 -3.80 4.39 -0.08 -1.26 -4.67 116.55 109.32 1j6y n ASP 28 Ca 0.00 -0.38 -0.41 0.00 -1.51 0.00 0.00 54.79 52.49 1j6y n ASP 28 Cb 0.00 -1.46 -0.05 0.00 2.34 0.00 0.00 41.12 41.95 1j6y n ASP 28 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 1j6y n PRO 29 N -0.85 1.76 -1.67 -0.67 -0.04 -1.26 -4.77 135.00 127.50 1j6y n PRO 29 Ca -0.15 -2.09 0.00 0.00 -0.04 0.00 0.00 63.50 61.23 1j6y n PRO 29 Cb 0.64 -3.10 0.00 0.00 -0.04 0.00 0.00 33.50 31.00 1j6y n PRO 29 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1j6y n GLU 30 N 7.11 -4.55 0.00 0.54 4.71 -1.26 -5.07 120.64 122.11 1j6y n GLU 30 Ca 0.49 3.44 0.00 0.00 -0.01 0.00 0.00 57.16 61.09 1j6y n GLU 30 Cb 0.41 -4.05 0.00 0.00 -1.01 0.00 0.00 31.44 26.79 1j6y n GLU 30 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1j6y n GLY 31 N -1.57 -0.34 3.93 0.62 0.00 -1.26 -5.19 105.19 101.38 1j6y n GLY 31 Ca 0.00 0.58 0.03 0.00 0.00 0.00 0.00 46.02 46.63 1j6y n GLY 31 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1j6y s LYS 32 N 2.04 0.34 0.41 1.61 0.00 -1.26 -5.17 119.74 117.72 1j6y s LYS 32 Ca 0.00 -0.22 0.02 0.00 0.00 0.00 0.00 55.97 55.77 1j6y s LYS 32 Cb 0.00 0.10 -0.01 0.00 0.00 0.00 0.00 37.83 37.92 1j6y s LYS 32 CO 0.00 -0.16 0.61 0.96 0.00 0.00 0.00 175.35 176.76 1j6y s ILE 33 N -2.07 4.15 0.00 3.79 -4.36 -1.26 -5.07 121.20 116.37 1j6y s ILE 33 Ca 0.27 -0.62 0.00 0.00 -0.26 0.00 0.00 60.65 60.04 1j6y s ILE 33 Cb 0.01 -3.51 0.00 0.00 1.25 0.00 0.00 42.46 40.21 1j6y s ILE 33 CO -0.02 -0.31 0.00 -0.38 0.24 0.00 0.00 174.94 174.47 1j6y n ILE 34 N -1.94 0.00 0.00 8.37 2.08 -1.26 -5.08 119.36 121.54 1j6y n ILE 34 Ca 0.00 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.31 1j6y n ILE 34 Cb 0.58 -0.19 0.00 0.00 -0.75 0.00 0.00 39.64 39.28 1j6y n ILE 34 CO 0.00 0.00 0.00 -0.11 0.56 0.00 0.00 176.55 177.00 1j6y n LEU 35 N -0.57 0.00 0.00 1.39 7.94 -1.26 -5.16 117.00 119.34 1j6y n LEU 35 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 1j6y n LEU 35 Cb 0.00 0.00 0.00 0.00 0.53 0.00 0.00 43.42 43.95 1j6y n LEU 35 CO 0.00 0.00 0.00 0.35 -1.11 0.00 0.00 177.39 176.63 1j6y n THR 36 N 0.00 0.00 -1.39 1.96 -2.24 -1.26 -4.89 114.28 106.46 1j6y n THR 36 Ca 0.00 0.00 -0.40 0.00 -2.27 0.00 0.00 64.05 61.38 1j6y n THR 36 Cb 0.00 -0.99 0.02 0.00 -2.10 0.00 0.00 70.33 67.25 1j6y n THR 36 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1j6y n THR 37 N -1.40 1.40 -4.36 4.28 -1.04 -1.26 -4.94 114.28 106.95 1j6y n THR 37 Ca 0.00 -0.50 -0.18 0.00 -2.04 0.00 0.00 64.05 61.33 1j6y n THR 37 Cb 0.00 -0.41 -0.05 0.00 -1.82 0.00 0.00 70.33 68.05 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 -1.35 0.00 -0.13 12.58 -2.24 -1.26 -3.61 114.28 118.27 1j6y n THR 38 Ca 0.11 -1.63 -0.14 0.00 -2.27 0.00 0.00 64.05 60.12 1j6y n THR 38 Cb 0.44 0.56 -0.09 0.00 -2.10 0.00 0.00 70.33 69.14 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 -0.39 0.51 -0.78 2.43 -1.91 1.88 114.38 116.13 1j6y h ARG 39 Ca -0.23 0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 58.95 1j6y h ARG 39 Cb 0.84 0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.48 1j6y h ARG 39 CO 0.36 -0.26 -0.24 1.49 -1.51 0.00 0.00 179.97 179.81 1j6y h GLU 40 N -0.40 -0.66 -0.96 0.20 4.81 -2.00 -3.00 114.58 112.57 1j6y h GLU 40 Ca 0.08 0.04 0.29 0.00 -0.13 0.00 0.00 59.36 59.64 1j6y h GLU 40 Cb 0.60 0.15 -0.15 0.00 0.63 0.00 0.00 28.75 29.98 1j6y h GLU 40 CO -0.59 -0.44 0.45 0.00 -0.73 0.00 0.00 179.01 177.70 1j6y h ALA 41 N -1.56 1.71 -0.16 2.92 0.00 -1.89 -1.08 119.26 119.20 1j6y h ALA 41 Ca -0.07 0.20 0.02 0.00 0.00 0.00 0.00 54.91 55.07 1j6y h ALA 41 Cb 0.52 0.21 -0.05 0.00 0.00 0.00 0.00 17.79 18.47 1j6y h ALA 41 CO 0.11 -0.52 -0.36 0.00 0.00 0.00 0.00 179.25 178.48 1j6y h ALA 42 N 1.82 -0.69 -0.80 0.00 0.00 0.31 0.26 119.26 120.16 1j6y h ALA 42 Ca 0.67 -0.02 0.19 0.00 0.00 0.00 0.00 54.91 55.74 1j6y h ALA 42 Cb 1.46 0.91 -0.12 0.00 0.00 0.00 0.00 17.79 20.04 1j6y h ALA 42 CO -0.62 -0.84 0.24 0.28 0.00 0.00 0.00 179.25 178.31 1j6y h VAL 43 N -0.33 0.47 -0.83 0.00 2.07 -1.12 0.57 116.25 117.07 1j6y h VAL 43 Ca 0.03 -0.10 0.07 0.00 0.82 0.00 0.00 66.70 67.52 1j6y h VAL 43 Cb 0.42 0.15 -0.06 0.00 -1.52 0.00 0.00 31.29 30.28 1j6y h VAL 43 CO -0.33 0.05 0.50 -0.08 0.02 0.00 0.00 177.57 177.74 1j6y h GLU 44 N 0.29 0.87 0.10 1.57 4.57 -0.61 1.54 114.58 122.91 1j6y h GLU 44 Ca 0.47 -0.05 -0.00 0.00 -1.18 0.00 0.00 59.36 58.60 1j6y h GLU 44 Cb 0.86 -0.20 0.00 0.00 -0.16 0.00 0.00 28.75 29.25 1j6y h GLU 44 CO -0.54 0.58 -0.05 0.37 -1.18 0.00 0.00 179.01 178.19 1j6y h GLN 45 N 0.90 -0.13 0.00 1.92 -0.00 0.31 -2.34 115.11 115.78 1j6y h GLN 45 Ca 0.37 0.01 0.00 0.00 -0.00 0.00 0.00 58.65 59.03 1j6y h GLN 45 Cb 0.22 0.03 0.00 0.00 0.00 0.00 0.00 27.48 27.73 1j6y h GLN 45 CO -0.19 0.34 0.00 1.25 0.00 0.00 0.00 178.83 180.23 1j6y h LEU 46 N -0.67 0.00 0.08 -2.39 6.46 0.12 -0.35 115.31 118.56 1j6y h LEU 46 Ca -0.01 0.00 -0.26 0.00 -0.12 0.00 0.00 57.88 57.49 1j6y h LEU 46 Cb 0.53 0.00 0.02 0.00 -0.73 0.00 0.00 40.66 40.48 1j6y h LEU 46 CO 0.02 0.00 -1.06 0.50 -0.62 0.00 0.00 178.44 177.28 1j6y h LYS 47 N 0.00 0.58 0.00 1.25 3.64 0.24 -2.87 116.57 119.42 1j6y h LYS 47 Ca 0.00 -0.73 -0.15 0.00 -1.27 0.00 0.00 60.65 58.50 1j6y h LYS 47 Cb 0.24 0.23 -0.02 0.00 -0.41 0.00 0.00 32.23 32.28 1j6y h LYS 47 CO 0.00 1.32 -0.70 0.77 -2.27 0.00 0.00 179.45 178.57 1j6y h SER 48 N 0.18 0.00 0.19 4.20 0.02 -0.87 -2.35 113.55 114.92 1j6y h SER 48 Ca -0.15 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.79 1j6y h SER 48 Cb 1.75 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.29 1j6y h SER 48 CO 0.21 0.70 -0.09 -0.29 -1.14 0.00 0.00 176.83 176.21 1j6y h ILE 49 N 0.00 0.91 -0.46 3.27 -0.00 -1.12 1.53 117.51 121.64 1j6y h ILE 49 Ca -0.01 -0.54 -0.03 0.00 -0.00 0.00 0.00 64.86 64.28 1j6y h ILE 49 Cb 1.51 1.24 -0.02 0.00 -0.00 0.00 0.00 36.82 39.54 1j6y h ILE 49 CO 0.09 0.12 0.14 0.08 -0.00 0.00 0.00 178.15 178.59 1j6y h ARG 50 N -0.52 0.68 -0.10 2.19 0.11 -1.59 0.57 114.38 115.72 1j6y h ARG 50 Ca -0.03 -0.11 -0.00 0.00 0.10 0.00 0.00 59.98 59.94 1j6y h ARG 50 Cb 0.39 -0.12 -0.00 0.00 1.11 0.00 0.00 29.97 31.35 1j6y h ARG 50 CO 0.04 0.59 0.05 1.49 0.10 0.00 0.00 179.97 182.24 1j6y h GLU 51 N 0.67 0.15 -0.11 0.08 4.57 -0.98 1.46 114.58 120.42 1j6y h GLU 51 Ca 0.16 -0.02 -0.00 0.00 -1.18 0.00 0.00 59.36 58.31 1j6y h GLU 51 Cb 0.20 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.76 1j6y h GLU 51 CO -0.01 0.23 0.06 -0.44 -1.18 0.00 0.00 179.01 177.67 1j6y h ASP 52 N 0.04 0.13 0.31 1.04 5.19 0.31 0.50 116.42 123.93 1j6y h ASP 52 Ca 0.04 -0.05 -0.01 0.00 -0.62 0.00 0.00 57.03 56.39 1j6y h ASP 52 Cb 0.13 -0.03 -0.00 0.00 0.18 0.00 0.00 39.33 39.60 1j6y h ASP 52 CO -0.00 0.14 -0.04 0.40 -3.12 0.00 0.00 179.24 176.61 1j6y h ILE 53 N 0.11 0.27 0.21 0.35 2.04 0.48 -2.90 117.51 118.07 1j6y h ILE 53 Ca 0.04 -0.28 -0.01 0.00 1.00 0.00 0.00 64.86 65.60 1j6y h ILE 53 Cb 0.03 1.22 0.00 0.00 -0.74 0.00 0.00 36.82 37.33 1j6y h ILE 53 CO -0.01 0.04 -0.10 0.58 0.00 0.00 0.00 178.15 178.66 1j6y h VAL 54 N 0.00 0.02 -2.92 1.67 2.07 0.45 -3.45 116.25 114.10 1j6y h VAL 54 Ca -0.00 -0.81 -0.63 0.00 0.82 0.00 0.00 66.70 66.08 1j6y h VAL 54 Cb 0.21 0.04 -0.06 0.00 -1.52 0.00 0.00 31.29 29.96 1j6y h VAL 54 CO 0.01 0.01 -0.30 -0.44 0.02 0.00 0.00 177.57 176.86 1j6y s SER 55 N -5.24 6.64 0.00 0.57 0.01 0.15 -4.85 113.70 110.98 1j6y s SER 55 Ca -0.04 0.76 0.00 0.00 1.31 0.00 0.00 55.95 57.98 1j6y s SER 55 Cb 0.00 -2.19 0.00 0.00 0.21 0.00 0.00 66.02 64.05 1j6y s SER 55 CO 0.13 0.33 0.00 0.61 0.41 0.00 0.00 173.24 174.73 1j6y n GLY 56 N 2.02 -1.19 2.55 3.44 0.00 -1.26 -4.60 105.19 106.14 1j6y n GLY 56 Ca -0.16 -0.83 -0.08 0.00 0.00 0.00 0.00 46.02 44.95 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 1.40 0.87 0.00 1.61 3.00 -1.26 -4.76 118.16 119.02 1j6y n LYS 57 Ca 0.00 -0.64 0.00 0.00 -0.00 0.00 0.00 58.31 57.67 1j6y n LYS 57 Cb 0.00 -1.93 0.00 0.00 0.00 0.00 0.00 35.03 33.10 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 3.63 0.00 -2.51 3.14 0.00 -1.26 -5.07 120.51 118.44 1j6y n ALA 58 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.63 1j6y n ALA 58 Cb 0.19 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.64 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 -0.18 0.31 0.00 0.00 2.85 -1.26 -5.08 115.26 111.90 1j6y n ASN 59 Ca 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.47 1j6y n ASN 59 Cb 0.00 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.02 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 0.00 0.00 0.00 1.20 -0.00 -1.26 -4.94 117.46 112.46 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 -0.69 0.00 -0.45 -4.13 1.02 -1.26 -0.11 120.64 115.02 1j6y n GLU 61 Ca 0.00 0.00 0.39 0.00 -0.02 0.00 0.00 57.16 57.53 1j6y n GLU 61 Cb 0.00 -0.65 0.73 0.00 -0.02 0.00 0.00 31.44 31.50 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 0.06 -0.87 3.49 4.81 -1.97 1.67 114.58 121.77 1j6y h GLU 62 Ca 0.00 -0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.21 1j6y h GLU 62 Cb 0.00 -0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.33 1j6y h GLU 62 CO 0.00 0.04 0.49 0.28 -0.73 0.00 0.00 179.01 179.09 1j6y h VAL 63 N 0.06 1.25 0.32 0.32 2.07 -1.90 -2.72 116.25 115.64 1j6y h VAL 63 Ca 0.72 -0.59 -0.02 0.00 0.82 0.00 0.00 66.70 67.63 1j6y h VAL 63 Cb 2.67 0.06 0.00 0.00 -1.52 0.00 0.00 31.29 32.50 1j6y h VAL 63 CO -0.11 0.27 -0.15 0.00 0.02 0.00 0.00 177.57 177.60 1j6y h ALA 64 N 1.33 -0.43 -1.74 1.67 0.00 0.60 -2.25 119.26 118.44 1j6y h ALA 64 Ca 0.31 -0.12 0.53 0.00 0.00 0.00 0.00 54.91 55.63 1j6y h ALA 64 Cb 0.00 0.16 -0.10 0.00 0.00 0.00 0.00 17.79 17.86 1j6y h ALA 64 CO -0.05 -0.41 1.22 0.25 0.00 0.00 0.00 179.25 180.26 1j6y n THR 65 N -5.06 -0.08 -0.03 0.00 -2.24 -0.76 -1.03 114.28 105.09 1j6y n THR 65 Ca -0.06 1.54 -0.01 0.00 -2.27 0.00 0.00 64.05 63.25 1j6y n THR 65 Cb 0.20 -2.56 -0.00 0.00 -2.10 0.00 0.00 70.33 65.86 1j6y n THR 65 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 1j6y h ARG 66 N 0.00 0.00 -3.08 -0.78 2.43 -1.48 -3.40 114.38 108.07 1j6y h ARG 66 Ca 0.90 0.00 -0.79 0.00 -0.81 0.00 0.00 59.98 59.28 1j6y h ARG 66 Cb 3.39 0.00 -0.22 0.00 -0.42 0.00 0.00 29.97 32.72 1j6y h ARG 66 CO -0.15 0.00 1.39 1.55 -1.51 0.00 0.00 179.97 181.25 1j6y n VAL 67 N -3.41 5.00 -3.99 0.20 3.14 -0.49 -4.95 118.33 113.84 1j6y n VAL 67 Ca -0.01 -5.25 0.00 0.00 -2.96 0.00 0.00 64.34 56.12 1j6y n VAL 67 Cb 0.05 -2.15 0.00 0.00 -1.06 0.00 0.00 33.84 30.68 1j6y n VAL 67 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 1j6y n SER 68 N 2.25 1.25 -4.44 6.55 3.41 -0.19 -3.17 113.62 119.27 1j6y n SER 68 Ca 0.35 -0.99 -0.44 0.00 -0.26 0.00 0.00 58.87 57.53 1j6y n SER 68 Cb 0.33 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 64.28 1j6y n SER 68 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1j6y s ASP 69 N -0.98 7.08 0.00 4.04 2.15 -1.26 -4.52 116.67 123.18 1j6y s ASP 69 Ca 0.00 -3.03 0.00 0.00 0.43 0.00 0.00 52.55 49.95 1j6y s ASP 69 Cb 0.00 -2.37 0.00 0.00 -0.30 0.00 0.00 42.92 40.25 1j6y s ASP 69 CO 0.00 -0.69 0.00 0.00 -0.17 0.00 0.00 175.17 174.31 1j6y h SER 71 N 0.00 -0.59 -0.80 0.00 0.87 -1.98 2.48 113.55 113.53 1j6y h SER 71 Ca 0.00 0.19 0.21 0.00 -1.23 0.00 0.00 61.79 60.96 1j6y h SER 71 Cb 0.00 0.40 -0.04 0.00 -0.44 0.00 0.00 62.40 62.32 1j6y h SER 71 CO 0.00 -0.21 0.56 0.28 -0.53 0.00 0.00 176.83 176.92 1j6y h SER 72 N 0.00 0.16 -0.93 6.23 0.02 0.24 0.80 113.55 120.07 1j6y h SER 72 Ca 0.32 0.01 0.16 0.00 -0.84 0.00 0.00 61.79 61.44 1j6y h SER 72 Cb 0.48 -0.01 -0.10 0.00 0.14 0.00 0.00 62.40 62.91 1j6y h SER 72 CO -0.67 0.07 0.53 0.00 -1.14 0.00 0.00 176.83 175.62 1j6y h ALA 73 N 1.62 1.47 0.00 3.77 0.00 0.44 2.85 119.26 129.41 1j6y h ALA 73 Ca 0.39 0.08 -0.03 0.00 0.00 0.00 0.00 54.91 55.36 1j6y h ALA 73 Cb 1.31 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 19.03 1j6y h ALA 73 CO -0.07 -0.04 -0.12 -0.22 0.00 0.00 0.00 179.25 178.80 1j6y h LYS 74 N 0.72 0.00 -0.86 0.00 1.63 0.77 -1.82 116.57 117.01 1j6y h LYS 74 Ca 0.52 0.00 -0.57 0.00 -0.85 0.00 0.00 60.65 59.75 1j6y h LYS 74 Cb 0.75 0.00 -0.41 0.00 -0.60 0.00 0.00 32.23 31.97 1j6y h LYS 74 CO -0.36 0.12 -0.59 -2.13 -3.45 0.00 0.00 179.45 173.04 1j6y n ARG 75 N -4.13 3.48 0.00 1.90 0.63 0.79 -4.77 116.66 114.56 1j6y n ARG 75 Ca -0.02 -4.09 0.03 0.00 -0.92 0.00 0.00 57.85 52.84 1j6y n ARG 75 Cb 0.20 -2.28 0.12 0.00 0.45 0.00 0.00 32.46 30.95 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 -0.71 -0.69 0.00 5.14 0.00 0.70 -4.11 105.19 105.53 1j6y n GLY 76 Ca 0.46 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.46 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 -0.93 -1.89 3.28 -0.02 0.00 -1.26 -4.48 105.19 99.89 1j6y n GLY 77 Ca 0.01 0.00 -0.09 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 -1.94 -0.00 0.00 1.61 1.47 -1.26 -3.27 116.67 113.27 1j6y s ASP 78 Ca 0.00 -0.61 0.00 0.00 1.18 0.00 0.00 52.55 53.12 1j6y s ASP 78 Cb 0.00 0.41 0.00 0.00 -0.34 0.00 0.00 42.92 42.99 1j6y s ASP 78 CO 0.00 -0.82 0.82 0.18 0.68 0.00 0.00 175.17 176.04 1j6y n LEU 79 N -0.15 0.02 0.00 2.11 4.32 0.11 -4.89 117.00 118.52 1j6y n LEU 79 Ca -0.13 0.90 0.00 0.00 -0.02 0.00 0.00 56.01 56.76 1j6y n LEU 79 Cb 0.63 -0.48 0.00 0.00 -1.62 0.00 0.00 43.42 41.95 1j6y n LEU 79 CO 0.21 -0.48 0.00 0.61 -1.22 0.00 0.00 177.39 176.51 1j6y n GLY 80 N -0.50 1.47 3.34 -0.72 0.00 -0.85 -4.95 105.19 102.98 1j6y n GLY 80 Ca 0.00 -0.43 -0.11 0.00 0.00 0.00 0.00 46.02 45.48 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 -0.54 0.09 1.61 1.04 -1.26 -2.63 113.70 108.00 1j6y s SER 81 Ca 0.00 0.97 -0.03 0.00 0.48 0.00 0.00 55.95 57.37 1j6y s SER 81 Cb 0.00 0.90 0.01 0.00 0.10 0.00 0.00 66.02 67.03 1j6y s SER 81 CO 0.00 -0.18 0.18 2.22 0.98 0.00 0.00 173.24 176.43 1j6y n PHE 82 N 3.71 -1.24 0.00 5.02 -1.74 -0.83 -4.93 117.46 117.44 1j6y n PHE 82 Ca -0.19 -0.45 0.00 0.00 -0.56 0.00 0.00 57.45 56.24 1j6y n PHE 82 Cb 0.56 0.21 0.00 0.00 1.52 0.00 0.00 39.48 41.77 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 -0.13 -1.13 3.89 4.97 0.00 -1.26 0.20 105.19 111.73 1j6y n GLY 83 Ca -0.02 0.57 -0.31 0.00 0.00 0.00 0.00 46.02 46.27 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 0.21 3.73 0.00 1.61 1.81 -1.26 -4.28 118.95 120.78 1j6y s ARG 84 Ca 0.00 0.18 0.00 0.00 -1.72 0.00 0.00 55.73 54.19 1j6y s ARG 84 Cb 0.00 -2.63 0.00 0.00 -0.45 0.00 0.00 34.95 31.87 1j6y s ARG 84 CO 0.00 0.26 0.00 0.41 -0.68 0.00 0.00 175.30 175.29 1j6y n GLY 85 N -0.51 1.42 2.98 -3.53 0.00 -1.26 -4.94 105.19 99.35 1j6y n GLY 85 Ca -0.00 -0.01 -0.38 0.00 0.00 0.00 0.00 46.02 45.63 1j6y n GLY 85 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j6y n GLN 86 N 0.00 0.00 0.00 1.61 -0.00 -1.26 -4.07 117.38 113.66 1j6y n GLN 86 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 57.00 1j6y n GLN 86 Cb 0.00 -1.00 0.00 0.00 -0.00 0.00 0.00 30.24 29.24 1j6y n GLN 86 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.06 175.73 1j6y n MET 87 N 2.48 0.00 0.06 2.61 2.81 -1.26 -4.50 117.12 119.32 1j6y n MET 87 Ca -0.02 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.87 1j6y n MET 87 Cb 0.73 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 33.24 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 0.00 0.00 0.00 0.03 6.02 -1.26 -5.05 117.38 117.12 1j6y n GLN 88 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 1j6y n GLN 88 Cb 0.00 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.26 1j6y n GLN 88 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.06 177.22 1j6y n LYS 89 N -2.92 0.00 -0.10 -1.09 4.81 -1.26 -4.90 118.16 112.70 1j6y n LYS 89 Ca 0.00 0.00 -0.11 0.00 -0.87 0.00 0.00 58.31 57.33 1j6y n LYS 89 Cb 0.00 0.00 -0.03 0.00 0.02 0.00 0.00 35.03 35.02 1j6y n LYS 89 CO 0.00 0.00 0.00 -1.00 1.17 0.00 0.00 177.40 177.57 1j6y h PRO 90 N 0.00 0.50 0.78 1.64 0.13 -1.97 -2.38 132.00 130.69 1j6y h PRO 90 Ca 0.00 -0.13 -0.04 0.00 -0.87 0.00 0.00 66.00 64.96 1j6y h PRO 90 Cb 0.00 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 31.08 1j6y h PRO 90 CO 0.00 0.60 -0.40 0.35 -0.23 0.00 0.00 178.00 178.32 1j6y h PHE 91 N 0.32 -1.06 -0.68 1.56 3.04 -1.93 -2.32 116.94 115.87 1j6y h PHE 91 Ca 0.09 -0.02 0.07 0.00 3.98 0.00 0.00 57.97 62.09 1j6y h PHE 91 Cb 0.35 0.36 -0.10 0.00 2.56 0.00 0.00 35.95 39.12 1j6y h PHE 91 CO 0.02 -0.64 -0.56 1.49 -2.02 0.00 0.00 178.31 176.61 1j6y h GLU 92 N -1.08 -0.19 -0.31 1.11 4.81 -1.90 2.15 114.58 119.17 1j6y h GLU 92 Ca -0.10 0.01 0.09 0.00 -0.13 0.00 0.00 59.36 59.23 1j6y h GLU 92 Cb 0.85 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.26 1j6y h GLU 92 CO 0.15 -0.13 0.50 1.05 -0.73 0.00 0.00 179.01 179.86 1j6y h GLU 93 N -0.20 0.00 0.42 1.92 -0.00 -1.34 0.66 114.58 116.05 1j6y h GLU 93 Ca 0.11 0.00 -0.02 0.00 -0.00 0.00 0.00 59.36 59.45 1j6y h GLU 93 Cb 0.49 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.25 1j6y h GLU 93 CO -0.75 0.00 -0.20 0.00 -0.00 0.00 0.00 179.01 178.06 1j6y h ALA 94 N 1.29 -0.57 0.00 1.06 0.00 0.41 0.42 119.26 121.88 1j6y h ALA 94 Ca 0.15 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 1j6y h ALA 94 Cb 1.15 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 19.15 1j6y h ALA 94 CO -0.00 -0.54 -0.28 1.15 0.00 0.00 0.00 179.25 179.58 1j6y h THR 95 N -1.13 1.04 0.00 0.00 2.02 -0.23 -1.87 112.91 112.74 1j6y h THR 95 Ca -0.06 -1.00 -0.15 0.00 0.77 0.00 0.00 66.41 65.96 1j6y h THR 95 Cb 0.47 1.57 -0.02 0.00 -1.74 0.00 0.00 68.15 68.42 1j6y h THR 95 CO 0.10 0.27 -0.73 1.88 0.37 0.00 0.00 175.52 177.40 1j6y h TYR 96 N 0.00 0.00 0.00 3.16 0.05 0.27 -3.13 116.97 117.32 1j6y h TYR 96 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1j6y h TYR 96 Cb 0.54 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.28 1j6y h TYR 96 CO 0.00 0.73 -0.12 0.00 -1.05 0.00 0.00 178.16 177.72 1j6y h ALA 97 N 1.27 0.93 -4.67 3.88 0.00 0.57 -3.46 119.26 117.78 1j6y h ALA 97 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 54.91 54.48 1j6y h ALA 97 Cb 1.45 0.00 0.12 0.00 0.00 0.00 0.00 17.79 19.36 1j6y h ALA 97 CO 0.10 0.00 0.24 -0.11 0.00 0.00 0.00 179.25 179.48 1j6y n LEU 98 N -2.74 0.00 -2.74 0.00 7.94 -0.77 -5.06 117.00 113.63 1j6y n LEU 98 Ca 0.04 -1.69 -0.09 0.00 -1.11 0.00 0.00 56.01 53.16 1j6y n LEU 98 Cb 0.49 -0.77 0.08 0.00 0.53 0.00 0.00 43.42 43.76 1j6y n LEU 98 CO 0.34 -1.16 0.32 2.29 -1.11 0.00 0.00 177.39 178.06 1j6y n LYS 99 N -3.15 1.00 -3.73 1.96 2.85 -1.26 -5.00 118.16 110.83 1j6y n LYS 99 Ca 0.15 -1.94 -0.30 0.00 -1.05 0.00 0.00 58.31 55.17 1j6y n LYS 99 Cb 0.55 -1.08 0.03 0.00 -0.65 0.00 0.00 35.03 33.87 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 0.47 -5.13 0.00 0.58 0.31 -1.26 -4.85 118.33 108.44 1j6y n VAL 100 Ca 0.07 -0.62 0.00 0.00 -0.01 0.00 0.00 64.34 63.78 1j6y n VAL 100 Cb 0.69 -3.89 0.00 0.00 -0.91 0.00 0.00 33.84 29.73 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 -1.77 -1.56 0.00 2.92 0.00 -1.26 -4.52 105.19 98.99 1j6y n GLY 101 Ca -0.13 0.61 0.00 0.00 0.00 0.00 0.00 46.02 46.50 1j6y n GLY 101 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1j6y n ASP 102 N 0.00 0.00 -3.33 1.61 8.00 -1.26 -5.02 116.55 116.54 1j6y n ASP 102 Ca 0.00 0.00 -0.18 0.00 0.71 0.00 0.00 54.79 55.32 1j6y n ASP 102 Cb 0.00 0.00 0.07 0.00 -0.02 0.00 0.00 41.12 41.17 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 -8.54 -2.04 0.53 5.41 -1.26 -4.71 119.36 108.74 1j6y n ILE 103 Ca 0.00 -1.27 0.00 0.00 1.00 0.00 0.00 62.75 62.48 1j6y n ILE 103 Cb 0.00 -6.11 0.00 0.00 -0.71 0.00 0.00 39.64 32.82 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 -3.12 -1.85 -2.91 4.38 3.41 -1.11 -4.65 113.62 107.78 1j6y n SER 104 Ca -0.08 0.00 -0.02 0.00 -0.26 0.00 0.00 58.87 58.51 1j6y n SER 104 Cb 0.62 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.57 1j6y n SER 104 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1j6y s ASP 105 N -4.00 -1.46 -0.38 4.04 1.01 -1.26 -5.00 116.67 109.63 1j6y s ASP 105 Ca 0.00 -1.39 -0.15 0.00 0.71 0.00 0.00 52.55 51.72 1j6y s ASP 105 Cb 0.00 1.89 0.02 0.00 1.01 0.00 0.00 42.92 45.84 1j6y s ASP 105 CO 0.00 -0.09 0.43 -0.38 0.21 0.00 0.00 175.17 175.34 1j6y n ILE 106 N 3.43 -9.72 -3.25 0.77 5.41 -1.26 -4.93 119.36 109.81 1j6y n ILE 106 Ca 0.16 0.98 -0.39 0.00 1.00 0.00 0.00 62.75 64.50 1j6y n ILE 106 Cb 0.57 -6.40 -0.07 0.00 -0.71 0.00 0.00 39.64 33.03 1j6y n ILE 106 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 1j6y s VAL 107 N -2.11 5.11 -0.25 1.39 1.01 -0.99 -4.97 120.40 119.59 1j6y s VAL 107 Ca 0.20 0.97 -0.00 0.00 0.00 0.00 0.00 61.98 63.15 1j6y s VAL 107 Cb -0.04 -3.85 0.07 0.00 0.00 0.00 0.00 36.38 32.56 1j6y s VAL 107 CO 0.74 0.20 0.01 1.51 0.00 0.00 0.00 175.10 177.56 1j6y s ASP 108 N 1.07 3.77 0.00 3.32 1.47 -1.26 0.14 116.67 125.17 1j6y s ASP 108 Ca 0.25 -1.29 0.00 0.00 1.18 0.00 0.00 52.55 52.69 1j6y s ASP 108 Cb -0.15 -1.02 0.00 0.00 -0.34 0.00 0.00 42.92 41.40 1j6y s ASP 108 CO 0.10 -0.30 0.00 0.35 0.68 0.00 0.00 175.17 175.99 1j6y n THR 109 N 4.75 0.00 -0.93 2.11 -2.24 0.13 -4.93 114.28 113.17 1j6y n THR 109 Ca -0.08 0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.35 1j6y n THR 109 Cb 0.44 0.00 0.07 0.00 -2.10 0.00 0.00 70.33 68.74 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 -4.57 0.00 3.42 -0.08 -1.26 -1.56 116.55 112.50 1j6y n ASP 110 Ca 0.00 0.20 0.00 0.00 -1.51 0.00 0.00 54.79 53.48 1j6y n ASP 110 Cb 0.00 -0.87 0.00 0.00 2.34 0.00 0.00 41.12 42.59 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 1.95 0.00 0.00 1.67 7.64 -1.26 -4.66 113.62 118.96 1j6y n SER 111 Ca 0.01 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.89 1j6y n SER 111 Cb 0.57 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.77 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 -0.56 3.64 0.23 0.00 -0.60 -4.62 105.19 103.28 1j6y n GLY 112 Ca 0.00 -0.13 -0.35 0.00 0.00 0.00 0.00 46.02 45.54 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 -1.23 4.48 0.22 1.61 -7.23 -1.26 0.21 120.40 117.19 1j6y s VAL 113 Ca 0.00 -0.16 0.01 0.00 -1.81 0.00 0.00 61.98 60.02 1j6y s VAL 113 Cb 0.00 -2.96 -0.00 0.00 0.56 0.00 0.00 36.38 33.98 1j6y s VAL 113 CO 0.00 0.53 0.03 1.41 -0.31 0.00 0.00 175.10 176.76 1j6y n HIS 114 N 2.92 0.32 -3.71 2.82 -0.00 0.36 -2.33 115.22 115.60 1j6y n HIS 114 Ca -0.18 -1.21 -0.16 0.00 -0.00 0.00 0.00 57.72 56.18 1j6y n HIS 114 Cb 0.53 -0.08 -0.15 0.00 -0.00 0.00 0.00 29.99 30.28 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 -2.05 -0.15 0.20 1.59 -4.36 -0.74 -2.35 121.20 113.33 1j6y s ILE 115 Ca 0.05 0.28 0.07 0.00 -0.26 0.00 0.00 60.65 60.79 1j6y s ILE 115 Cb 0.00 -0.25 -0.04 0.00 1.25 0.00 0.00 42.46 43.43 1j6y s ILE 115 CO 0.03 0.12 0.08 -0.63 0.24 0.00 0.00 174.94 174.78 1j6y s ILE 116 N 1.76 4.06 -0.05 8.37 1.01 -1.26 -1.92 121.20 133.17 1j6y s ILE 116 Ca -0.02 -1.40 -0.02 0.00 0.00 0.00 0.00 60.65 59.20 1j6y s ILE 116 Cb -0.12 -3.11 0.03 0.00 0.01 0.00 0.00 42.46 39.28 1j6y s ILE 116 CO -0.05 -0.21 0.08 -0.54 0.00 0.00 0.00 174.94 174.22 1j6y s LYS 117 N -3.31 -0.05 0.00 2.79 1.02 -1.13 -2.74 119.74 116.32 1j6y s LYS 117 Ca 0.30 0.40 0.00 0.00 0.02 0.00 0.00 55.97 56.69 1j6y s LYS 117 Cb -0.09 -0.44 0.00 0.00 -0.52 0.00 0.00 37.83 36.79 1j6y s LYS 117 CO 0.22 -0.31 0.00 -2.13 -0.92 0.00 0.00 175.35 172.21 1j6y n ARG 118 N 5.18 1.38 -0.06 1.68 0.63 -1.26 -1.92 116.66 122.29 1j6y n ARG 118 Ca -0.06 0.00 0.24 0.00 -0.92 0.00 0.00 57.85 57.11 1j6y n ARG 118 Cb 0.50 0.00 0.52 0.00 0.45 0.00 0.00 32.46 33.93 1j6y n ARG 118 CO 0.00 0.00 0.00 1.15 -2.51 0.00 0.00 177.63 176.27 1j6y h THR 119 N -0.18 0.11 0.00 5.15 2.02 -1.94 -3.48 112.91 114.59 1j6y h THR 119 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1j6y h THR 119 Cb 0.00 0.23 0.00 0.00 -1.74 0.00 0.00 68.15 66.64 1j6y h THR 119 CO 0.00 0.00 0.00 0.00 0.37 0.00 0.00 175.52 175.89