#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 -3.71 -0.37 -0.41 2.81 -1.26 -4.96 117.12 109.22 1j6y n MET 2 Ca 0.00 0.67 0.00 0.00 -1.81 0.00 0.00 57.70 56.56 1j6y n MET 2 Cb 0.00 -5.18 0.00 0.00 -0.71 0.00 0.00 33.22 27.33 1j6y n MET 2 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1j6y n ALA 3 N -4.00 0.00 -1.63 3.04 0.00 -1.26 -5.12 120.51 111.55 1j6y n ALA 3 Ca -0.20 0.00 -0.46 0.00 0.00 0.00 0.00 53.44 52.78 1j6y n ALA 3 Cb 0.65 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.07 1j6y n ALA 3 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1j6y n SER 4 N -0.33 2.01 -2.38 0.00 3.41 -1.26 -4.98 113.62 110.09 1j6y n SER 4 Ca 0.00 1.16 -0.04 0.00 -0.26 0.00 0.00 58.87 59.73 1j6y n SER 4 Cb 0.00 -1.34 -0.00 0.00 -0.26 0.00 0.00 64.21 62.61 1j6y n SER 4 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 1j6y n ARG 5 N 1.53 1.57 0.23 4.33 0.00 -1.26 -5.08 116.66 117.98 1j6y n ARG 5 Ca 0.12 -0.49 0.00 0.00 -0.00 0.00 0.00 57.85 57.48 1j6y n ARG 5 Cb 0.30 0.09 0.00 0.00 -0.00 0.00 0.00 32.46 32.85 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 -1.59 -4.12 -1.24 2.89 2.03 -1.26 -5.17 116.55 108.10 1j6y n ASP 6 Ca -0.01 0.90 0.15 0.00 0.52 0.00 0.00 54.79 56.35 1j6y n ASP 6 Cb 0.09 3.84 -0.07 0.00 -0.72 0.00 0.00 41.12 44.25 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 -3.43 -2.79 -3.95 -0.67 7.27 -1.26 -4.76 117.38 107.78 1j6y n GLN 7 Ca 0.00 2.19 -0.30 0.00 0.07 0.00 0.00 57.00 58.95 1j6y n GLN 7 Cb 0.00 -3.29 -0.14 0.00 2.41 0.00 0.00 30.24 29.22 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 -3.61 2.60 0.91 1.69 0.11 0.36 -4.87 120.40 117.58 1j6y s VAL 8 Ca 0.00 -3.17 -0.11 0.00 -2.93 0.00 0.00 61.98 55.77 1j6y s VAL 8 Cb 0.00 -2.82 0.14 0.00 -1.53 0.00 0.00 36.38 32.17 1j6y s VAL 8 CO 0.00 -0.77 1.09 -0.54 -3.33 0.00 0.00 175.10 171.55 1j6y s LYS 9 N -0.11 1.16 0.00 1.54 1.02 -1.25 -3.10 119.74 119.00 1j6y s LYS 9 Ca 0.16 1.02 0.00 0.00 0.02 0.00 0.00 55.97 57.17 1j6y s LYS 9 Cb -0.25 -1.78 0.00 0.00 -0.52 0.00 0.00 37.83 35.28 1j6y s LYS 9 CO -0.01 -2.36 0.00 0.00 -0.92 0.00 0.00 175.35 172.05 1j6y n ALA 10 N -3.99 0.00 -4.18 5.17 0.00 -1.12 -4.90 120.51 111.49 1j6y n ALA 10 Ca 0.08 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.37 1j6y n ALA 10 Cb 0.54 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.96 1j6y n ALA 10 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1j6y n SER 11 N 0.00 1.92 -3.59 0.00 2.88 0.26 -0.36 113.62 114.72 1j6y n SER 11 Ca 0.00 -2.08 -0.05 0.00 -1.33 0.00 0.00 58.87 55.41 1j6y n SER 11 Cb 0.00 0.33 -0.02 0.00 -0.75 0.00 0.00 64.21 63.77 1j6y n SER 11 CO 0.00 0.00 0.00 -1.38 -1.23 0.00 0.00 175.04 172.43 1j6y s HIS 12 N -2.09 -0.15 0.25 0.66 -3.43 -1.21 -2.73 115.29 106.60 1j6y s HIS 12 Ca 0.05 0.12 -0.02 0.00 -0.80 0.00 0.00 55.06 54.41 1j6y s HIS 12 Cb 0.00 0.51 -0.03 0.00 -1.43 0.00 0.00 32.58 31.64 1j6y s HIS 12 CO 0.03 -0.21 0.26 0.42 -2.00 0.00 0.00 174.74 173.25 1j6y s ILE 13 N -2.23 0.00 -0.12 -5.38 1.01 -0.60 -4.73 121.20 109.16 1j6y s ILE 13 Ca 0.08 -1.84 -0.09 0.00 0.00 0.00 0.00 60.65 58.80 1j6y s ILE 13 Cb -0.01 -2.46 0.04 0.00 0.01 0.00 0.00 42.46 40.04 1j6y s ILE 13 CO -0.05 0.00 0.30 -0.22 0.00 0.00 0.00 174.94 174.98 1j6y s LEU 14 N -3.18 0.65 0.00 2.97 2.96 -0.54 -1.57 118.68 119.97 1j6y s LEU 14 Ca 0.35 0.62 0.07 0.00 -0.22 0.00 0.00 54.13 54.96 1j6y s LEU 14 Cb 0.04 1.01 -0.04 0.00 0.50 0.00 0.00 46.19 47.70 1j6y s LEU 14 CO 0.15 -0.13 0.42 0.00 -1.32 0.00 0.00 176.35 175.47 1j6y n ILE 15 N 3.34 0.00 -1.18 6.68 3.06 -1.16 -3.00 119.36 127.10 1j6y n ILE 15 Ca -0.17 -0.38 0.15 0.00 -2.50 0.00 0.00 62.75 59.85 1j6y n ILE 15 Cb 0.57 1.04 -0.07 0.00 0.54 0.00 0.00 39.64 41.72 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 -0.73 -2.68 0.00 9.51 5.02 -1.26 -5.02 118.16 123.00 1j6y n LYS 16 Ca 0.02 2.14 0.00 0.00 -2.02 0.00 0.00 58.31 58.45 1j6y n LYS 16 Cb 0.13 -3.15 0.00 0.00 -0.02 0.00 0.00 35.03 31.99 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 -3.94 0.00 0.00 2.13 1.44 -1.26 -4.77 115.22 108.82 1j6y n HIS 17 Ca -0.06 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.65 1j6y n HIS 17 Cb 0.56 0.00 0.00 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 0.00 0.00 -1.40 1.13 -0.67 -4.89 117.38 111.54 1j6y n GLN 18 Ca 0.00 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.06 1j6y n GLN 18 Cb 0.00 -0.59 0.00 0.00 0.11 0.00 0.00 30.24 29.76 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 0.41 2.58 3.29 1.08 0.00 -1.26 -4.70 105.19 106.59 1j6y n GLY 19 Ca 0.00 -0.37 0.03 0.00 0.00 0.00 0.00 46.02 45.68 1j6y n GLY 19 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1j6y s SER 20 N -4.00 -1.14 0.00 1.61 0.15 -1.26 -5.10 113.70 103.96 1j6y s SER 20 Ca 0.00 0.95 0.00 0.00 0.70 0.00 0.00 55.95 57.60 1j6y s SER 20 Cb 0.00 2.05 0.00 0.00 -1.71 0.00 0.00 66.02 66.36 1j6y s SER 20 CO 0.00 -0.21 0.00 0.54 1.20 0.00 0.00 173.24 174.77 1j6y n ARG 21 N 5.40 0.00 0.00 5.44 5.12 -1.26 -5.06 116.66 126.30 1j6y n ARG 21 Ca -0.05 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.87 1j6y n ARG 21 Cb 0.51 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.81 1j6y n ARG 21 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 1j6y n ARG 22 N 0.00 0.00 0.00 5.56 5.12 -1.26 -4.80 116.66 121.28 1j6y n ARG 22 Ca 0.00 0.00 0.06 0.00 -1.93 0.00 0.00 57.85 55.98 1j6y n ARG 22 Cb 0.00 -0.15 0.04 0.00 -1.16 0.00 0.00 32.46 31.19 1j6y n ARG 22 CO 0.00 0.00 0.00 1.17 -1.93 0.00 0.00 177.63 176.87 1j6y n LYS 23 N -0.47 0.71 -2.20 5.56 0.00 -1.26 -5.03 118.16 115.46 1j6y n LYS 23 Ca 0.00 -1.14 -0.01 0.00 0.00 0.00 0.00 58.31 57.16 1j6y n LYS 23 Cb 0.00 -1.21 0.00 0.00 0.00 0.00 0.00 35.03 33.82 1j6y n LYS 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1j6y n ALA 24 N 0.58 -2.19 -1.09 3.14 0.00 -1.26 -4.88 120.51 114.81 1j6y n ALA 24 Ca 0.07 0.12 0.14 0.00 0.00 0.00 0.00 53.44 53.77 1j6y n ALA 24 Cb 0.28 -0.93 -0.05 0.00 0.00 0.00 0.00 19.45 18.75 1j6y n ALA 24 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1j6y n SER 25 N -1.15 -6.47 -1.37 0.00 2.88 -1.26 -4.99 113.62 101.26 1j6y n SER 25 Ca 0.01 0.83 0.18 0.00 -1.33 0.00 0.00 58.87 58.56 1j6y n SER 25 Cb 0.44 -3.56 -0.06 0.00 -0.75 0.00 0.00 64.21 60.28 1j6y n SER 25 CO 0.00 0.00 0.00 0.79 -1.23 0.00 0.00 175.04 174.60 1j6y n TRP 26 N -3.86 -3.43 0.00 0.66 5.03 -1.26 -5.04 117.44 109.54 1j6y n TRP 26 Ca -0.04 1.76 0.00 0.00 3.03 0.00 0.00 57.50 62.25 1j6y n TRP 26 Cb 0.51 -3.12 0.00 0.00 -1.03 0.00 0.00 31.31 27.67 1j6y n TRP 26 CO 0.00 0.00 0.00 0.36 -0.03 0.00 0.00 177.69 178.02 1j6y n LYS 27 N -4.06 0.00 -0.03 -0.99 2.85 -1.26 -4.91 118.16 109.76 1j6y n LYS 27 Ca -0.02 0.00 -0.11 0.00 -1.05 0.00 0.00 58.31 57.13 1j6y n LYS 27 Cb 0.66 0.00 -0.06 0.00 -0.65 0.00 0.00 35.03 34.99 1j6y n LYS 27 CO 0.00 0.00 0.00 0.22 -0.05 0.00 0.00 177.40 177.57 1j6y h ASP 28 N 0.00 0.18 -3.13 -5.58 3.58 -2.01 -3.40 116.42 106.05 1j6y h ASP 28 Ca 0.00 -0.16 -0.57 0.00 0.42 0.00 0.00 57.03 56.72 1j6y h ASP 28 Cb 0.00 -0.05 -0.05 0.00 1.72 0.00 0.00 39.33 40.96 1j6y h ASP 28 CO 0.00 0.29 1.11 -2.16 -2.88 0.00 0.00 179.24 175.60 1j6y s PRO 29 N -5.56 3.55 0.00 0.28 0.04 -1.26 -4.03 135.00 128.02 1j6y s PRO 29 Ca -0.14 1.08 0.00 0.00 0.04 0.00 0.00 61.00 61.98 1j6y s PRO 29 Cb 0.06 -4.05 0.00 0.00 0.04 0.00 0.00 34.50 30.55 1j6y s PRO 29 CO 0.69 -1.59 0.00 -0.85 0.04 0.00 0.00 177.00 175.29 1j6y n GLU 30 N 8.10 0.00 0.00 4.56 0.28 -1.26 -4.99 120.64 127.33 1j6y n GLU 30 Ca 0.18 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.18 1j6y n GLU 30 Cb 0.48 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.35 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 0.00 1.73 3.81 -1.84 0.00 -1.26 -4.87 105.19 102.76 1j6y n GLY 31 Ca 0.00 -0.31 -0.33 0.00 0.00 0.00 0.00 46.02 45.38 1j6y n GLY 31 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1j6y s LYS 32 N 0.00 3.97 -0.89 1.61 2.20 -1.26 -4.96 119.74 120.41 1j6y s LYS 32 Ca 0.00 1.22 -0.02 0.00 -0.36 0.00 0.00 55.97 56.81 1j6y s LYS 32 Cb 0.00 -2.13 0.31 0.00 -1.51 0.00 0.00 37.83 34.50 1j6y s LYS 32 CO 0.00 -0.26 2.05 0.44 -0.36 0.00 0.00 175.35 177.22 1j6y n ILE 33 N -0.92 4.38 -3.07 5.43 -5.35 -1.26 -4.98 119.36 113.58 1j6y n ILE 33 Ca 0.08 -4.68 -0.40 0.00 -0.27 0.00 0.00 62.75 57.48 1j6y n ILE 33 Cb 0.53 -1.39 -0.05 0.00 -1.74 0.00 0.00 39.64 36.99 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 -4.47 5.04 -0.09 7.28 -1.09 -1.26 -5.06 121.20 121.56 1j6y s ILE 34 Ca 0.49 1.38 0.00 0.00 -2.23 0.00 0.00 60.65 60.29 1j6y s ILE 34 Cb 0.35 -4.01 -0.03 0.00 -1.58 0.00 0.00 42.46 37.19 1j6y s ILE 34 CO -0.31 0.22 -0.08 -0.22 -1.23 0.00 0.00 174.94 173.32 1j6y s LEU 35 N 1.05 3.07 0.00 2.97 0.20 -1.26 -5.10 118.68 119.61 1j6y s LEU 35 Ca 0.35 -0.11 0.00 0.00 0.69 0.00 0.00 54.13 55.07 1j6y s LEU 35 Cb -0.17 -1.68 0.00 0.00 -0.43 0.00 0.00 46.19 43.91 1j6y s LEU 35 CO 0.16 0.30 0.00 1.07 -0.29 0.00 0.00 176.35 177.58 1j6y n THR 36 N 2.66 0.00 -3.10 3.68 5.66 -1.26 -5.05 114.28 116.88 1j6y n THR 36 Ca -0.18 0.00 -0.00 0.00 -3.05 0.00 0.00 64.05 60.82 1j6y n THR 36 Cb 0.53 0.00 -0.00 0.00 -1.55 0.00 0.00 70.33 69.31 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 -2.19 -2.49 1.09 -1.04 -1.26 -4.27 114.28 104.11 1j6y n THR 37 Ca 0.00 0.37 0.00 0.00 -2.04 0.00 0.00 64.05 62.38 1j6y n THR 37 Cb 0.00 -2.99 0.00 0.00 -1.82 0.00 0.00 70.33 65.52 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 1.94 0.00 0.11 12.58 -2.24 -1.26 -1.67 114.28 123.73 1j6y n THR 38 Ca -0.02 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.64 1j6y n THR 38 Cb 0.23 -1.24 -0.06 0.00 -2.10 0.00 0.00 70.33 67.16 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 -0.49 0.47 -0.78 2.43 -1.94 2.17 114.38 116.25 1j6y h ARG 39 Ca 0.00 0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.18 1j6y h ARG 39 Cb 0.00 0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.67 1j6y h ARG 39 CO 0.00 -0.33 -0.23 1.49 -1.51 0.00 0.00 179.97 179.39 1j6y h GLU 40 N -0.51 -0.62 -0.44 0.20 4.57 -2.00 -2.36 114.58 113.42 1j6y h GLU 40 Ca 0.03 0.04 0.03 0.00 -1.18 0.00 0.00 59.36 58.29 1j6y h GLU 40 Cb 0.55 0.14 -0.04 0.00 -0.16 0.00 0.00 28.75 29.24 1j6y h GLU 40 CO -0.19 -0.41 0.22 0.00 -1.18 0.00 0.00 179.01 177.45 1j6y h ALA 41 N -0.11 0.55 -0.03 2.92 0.00 -1.85 -2.45 119.26 118.29 1j6y h ALA 41 Ca -0.06 0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.86 1j6y h ALA 41 Cb 0.50 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1j6y h ALA 41 CO 0.10 -0.13 -0.08 0.00 0.00 0.00 0.00 179.25 179.15 1j6y h ALA 42 N 1.23 -0.44 -1.08 0.00 0.00 0.38 0.46 119.26 119.80 1j6y h ALA 42 Ca 0.19 -0.01 0.34 0.00 0.00 0.00 0.00 54.91 55.43 1j6y h ALA 42 Cb 0.08 0.68 -0.13 0.00 0.00 0.00 0.00 17.79 18.42 1j6y h ALA 42 CO -0.12 -0.48 0.65 0.28 0.00 0.00 0.00 179.25 179.58 1j6y h VAL 43 N -0.07 0.30 0.18 0.00 2.07 -1.36 0.34 116.25 117.70 1j6y h VAL 43 Ca 0.01 -0.10 -0.01 0.00 0.82 0.00 0.00 66.70 67.42 1j6y h VAL 43 Cb 0.09 -0.01 0.00 0.00 -1.52 0.00 0.00 31.29 29.85 1j6y h VAL 43 CO -0.07 0.05 -0.08 -0.33 0.02 0.00 0.00 177.57 177.16 1j6y h GLU 44 N 0.29 -0.23 -0.73 1.57 5.08 -0.30 1.57 114.58 121.83 1j6y h GLU 44 Ca 0.73 0.02 0.17 0.00 -1.00 0.00 0.00 59.36 59.28 1j6y h GLU 44 Cb 1.84 0.05 -0.04 0.00 0.50 0.00 0.00 28.75 31.10 1j6y h GLU 44 CO -0.51 0.01 0.50 0.37 -1.00 0.00 0.00 179.01 178.37 1j6y h GLN 45 N -0.44 0.24 0.10 2.33 5.75 0.36 0.78 115.11 124.24 1j6y h GLN 45 Ca -0.02 -0.01 -0.29 0.00 -0.15 0.00 0.00 58.65 58.17 1j6y h GLN 45 Cb 0.34 -0.05 -0.01 0.00 1.07 0.00 0.00 27.48 28.82 1j6y h GLN 45 CO 0.04 0.16 -1.47 -0.07 -2.65 0.00 0.00 178.83 174.84 1j6y h LEU 46 N 0.25 0.33 -1.18 -2.39 4.07 -0.40 -2.96 115.31 113.03 1j6y h LEU 46 Ca 0.36 -0.45 0.21 0.00 0.08 0.00 0.00 57.88 58.08 1j6y h LEU 46 Cb 1.04 -0.11 -0.10 0.00 1.08 0.00 0.00 40.66 42.57 1j6y h LEU 46 CO -0.08 1.37 0.62 0.11 -1.08 0.00 0.00 178.44 179.38 1j6y h LYS 47 N 0.06 0.59 0.15 1.13 1.79 0.47 0.17 116.57 120.93 1j6y h LYS 47 Ca -0.22 -0.04 -0.31 0.00 -2.18 0.00 0.00 60.65 57.91 1j6y h LYS 47 Cb 1.99 -0.13 0.01 0.00 -1.58 0.00 0.00 32.23 32.51 1j6y h LYS 47 CO 0.16 0.39 -1.48 1.03 -1.08 0.00 0.00 179.45 178.46 1j6y h SER 48 N 0.61 0.51 -0.00 0.86 0.87 -1.53 -2.87 113.55 112.00 1j6y h SER 48 Ca 0.56 -0.63 -0.00 0.00 -1.23 0.00 0.00 61.79 60.49 1j6y h SER 48 Cb 1.10 -0.16 -0.00 0.00 -0.44 0.00 0.00 62.40 62.89 1j6y h SER 48 CO -0.33 1.52 0.00 -0.29 -0.53 0.00 0.00 176.83 177.20 1j6y h ILE 49 N 0.09 1.02 -0.31 2.23 -0.00 -0.87 1.49 117.51 121.16 1j6y h ILE 49 Ca -0.23 -0.07 -0.00 0.00 -0.00 0.00 0.00 64.86 64.55 1j6y h ILE 49 Cb 2.04 1.07 -0.02 0.00 -0.00 0.00 0.00 36.82 39.92 1j6y h ILE 49 CO 0.19 0.02 0.18 0.08 -0.00 0.00 0.00 178.15 178.62 1j6y h ARG 50 N -0.03 0.42 0.37 2.19 -0.00 -0.87 0.45 114.38 116.91 1j6y h ARG 50 Ca 0.00 -0.03 -0.02 0.00 -0.00 0.00 0.00 59.98 59.93 1j6y h ARG 50 Cb 0.03 -0.09 0.00 0.00 -0.00 0.00 0.00 29.97 29.91 1j6y h ARG 50 CO -0.00 0.30 -0.18 1.49 -0.00 0.00 0.00 179.97 181.58 1j6y h GLU 51 N 0.43 -0.48 -0.75 0.08 4.57 -0.93 1.15 114.58 118.66 1j6y h GLU 51 Ca 0.11 0.03 0.16 0.00 -1.18 0.00 0.00 59.36 58.49 1j6y h GLU 51 Cb -0.00 0.11 -0.11 0.00 -0.16 0.00 0.00 28.75 28.58 1j6y h GLU 51 CO -0.02 -0.32 0.20 0.22 -1.18 0.00 0.00 179.01 177.91 1j6y h ASP 52 N -0.84 0.05 0.46 1.04 3.58 0.22 1.25 116.42 122.17 1j6y h ASP 52 Ca -0.05 0.14 -0.09 0.00 0.42 0.00 0.00 57.03 57.45 1j6y h ASP 52 Cb 0.38 0.19 -0.01 0.00 1.72 0.00 0.00 39.33 41.60 1j6y h ASP 52 CO 0.08 -0.03 -0.43 0.40 -2.88 0.00 0.00 179.24 176.39 1j6y h ILE 53 N 0.29 1.28 -0.17 2.25 2.04 -0.10 -2.81 117.51 120.29 1j6y h ILE 53 Ca 0.43 -1.49 -0.01 0.00 1.00 0.00 0.00 64.86 64.79 1j6y h ILE 53 Cb 0.73 1.81 -0.01 0.00 -0.74 0.00 0.00 36.82 38.61 1j6y h ILE 53 CO -0.51 0.42 0.08 0.58 0.00 0.00 0.00 178.15 178.73 1j6y h VAL 54 N 0.00 1.12 -3.04 1.67 2.07 1.06 -3.41 116.25 115.72 1j6y h VAL 54 Ca -0.00 -0.35 -0.62 0.00 0.82 0.00 0.00 66.70 66.55 1j6y h VAL 54 Cb 0.77 1.05 -0.08 0.00 -1.52 0.00 0.00 31.29 31.52 1j6y h VAL 54 CO 0.06 0.11 -0.33 -0.44 0.02 0.00 0.00 177.57 176.99 1j6y s SER 55 N -5.49 6.53 0.00 0.57 0.01 0.56 -4.77 113.70 111.11 1j6y s SER 55 Ca -0.13 0.63 -0.01 0.00 1.31 0.00 0.00 55.95 57.75 1j6y s SER 55 Cb 0.07 -2.17 0.00 0.00 0.21 0.00 0.00 66.02 64.13 1j6y s SER 55 CO 0.70 0.25 0.01 0.61 0.41 0.00 0.00 173.24 175.22 1j6y n GLY 56 N 2.55 -4.18 2.51 3.44 0.00 -1.26 -4.55 105.19 103.70 1j6y n GLY 56 Ca -0.15 -0.20 -0.06 0.00 0.00 0.00 0.00 46.02 45.61 1j6y n GLY 56 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1j6y n LYS 57 N 0.83 0.75 -0.75 1.61 3.00 -1.26 -4.65 118.16 117.68 1j6y n LYS 57 Ca -0.02 -0.54 -0.30 0.00 -0.00 0.00 0.00 58.31 57.45 1j6y n LYS 57 Cb 0.03 -1.85 0.11 0.00 0.00 0.00 0.00 35.03 33.32 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 3.47 -3.64 -1.00 3.14 0.00 -1.26 -4.96 120.51 116.26 1j6y n ALA 58 Ca 0.16 -1.22 0.00 0.00 0.00 0.00 0.00 53.44 52.38 1j6y n ALA 58 Cb 0.19 -1.09 0.00 0.00 0.00 0.00 0.00 19.45 18.55 1j6y n ALA 58 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1j6y n ASN 59 N 0.29 0.00 0.00 0.00 3.02 -1.26 -5.02 115.26 112.29 1j6y n ASN 59 Ca 0.01 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.56 1j6y n ASN 59 Cb 0.59 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.76 1j6y n ASN 59 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 1j6y n PHE 60 N -0.47 0.00 0.00 3.10 -0.00 -1.26 -4.99 117.46 113.84 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 -0.36 0.00 -0.35 -4.13 1.02 -1.26 -2.09 120.64 113.47 1j6y n GLU 61 Ca 0.00 0.20 0.13 0.00 -0.02 0.00 0.00 57.16 57.46 1j6y n GLU 61 Cb 0.00 -0.98 0.26 0.00 -0.02 0.00 0.00 31.44 30.69 1j6y n GLU 61 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1j6y n GLU 62 N -1.09 -0.08 -0.24 3.49 2.13 -1.26 0.17 120.64 123.75 1j6y n GLU 62 Ca 0.00 1.50 0.03 0.00 0.66 0.00 0.00 57.16 59.34 1j6y n GLU 62 Cb 0.00 -2.35 0.15 0.00 0.27 0.00 0.00 31.44 29.51 1j6y n GLU 62 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 1j6y h VAL 63 N 0.00 0.75 0.16 6.31 2.07 -1.95 -2.18 116.25 121.42 1j6y h VAL 63 Ca 0.57 -0.17 -0.01 0.00 0.82 0.00 0.00 66.70 67.92 1j6y h VAL 63 Cb 1.13 0.21 0.00 0.00 -1.52 0.00 0.00 31.29 31.11 1j6y h VAL 63 CO -0.95 0.09 -0.08 0.00 0.02 0.00 0.00 177.57 176.65 1j6y h ALA 64 N 1.48 -0.22 -1.60 1.67 0.00 0.22 -1.20 119.26 119.60 1j6y h ALA 64 Ca 0.37 -0.14 0.51 0.00 0.00 0.00 0.00 54.91 55.65 1j6y h ALA 64 Cb 0.48 0.08 -0.12 0.00 0.00 0.00 0.00 17.79 18.24 1j6y h ALA 64 CO -0.33 -0.50 1.09 0.25 0.00 0.00 0.00 179.25 179.75 1j6y n THR 65 N -5.08 -0.16 -0.09 0.00 -2.24 -0.48 -1.36 114.28 104.88 1j6y n THR 65 Ca -0.09 1.68 -0.11 0.00 -2.27 0.00 0.00 64.05 63.26 1j6y n THR 65 Cb 0.19 -2.77 -0.05 0.00 -2.10 0.00 0.00 70.33 65.61 1j6y n THR 65 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1j6y n ARG 66 N -4.41 0.50 -2.61 -0.78 0.63 -1.06 -4.41 116.66 104.51 1j6y n ARG 66 Ca 0.42 0.50 -0.42 0.00 -0.92 0.00 0.00 57.85 57.43 1j6y n ARG 66 Cb 1.74 -1.68 0.01 0.00 0.45 0.00 0.00 32.46 32.98 1j6y n ARG 66 CO 0.00 0.00 0.00 1.55 -2.51 0.00 0.00 177.63 176.67 1j6y n VAL 67 N -4.53 5.20 -4.48 5.15 3.14 -0.48 -4.96 118.33 117.38 1j6y n VAL 67 Ca -0.17 -5.31 -0.25 0.00 -2.96 0.00 0.00 64.34 55.65 1j6y n VAL 67 Cb 0.44 -2.06 -0.08 0.00 -1.06 0.00 0.00 33.84 31.08 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 -0.71 2.61 -1.10 6.55 1.04 -0.46 -1.46 113.70 120.18 1j6y s SER 68 Ca 0.38 -1.71 -0.18 0.00 0.48 0.00 0.00 55.95 54.92 1j6y s SER 68 Cb 0.11 0.55 -0.06 0.00 0.10 0.00 0.00 66.02 66.71 1j6y s SER 68 CO 0.01 -0.97 2.06 -0.67 0.98 0.00 0.00 173.24 174.65 1j6y n ASP 69 N -1.38 3.17 0.00 7.02 2.03 -1.26 -4.58 116.55 121.54 1j6y n ASP 69 Ca -0.04 -2.76 0.00 0.00 0.52 0.00 0.00 54.79 52.52 1j6y n ASP 69 Cb 0.64 -1.38 0.00 0.00 -0.72 0.00 0.00 41.12 39.67 1j6y n ASP 69 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1j6y h SER 71 N 0.00 -0.09 -0.65 0.00 0.87 -2.00 2.36 113.55 114.05 1j6y h SER 71 Ca 0.00 0.20 0.12 0.00 -1.23 0.00 0.00 61.79 60.89 1j6y h SER 71 Cb 0.00 0.29 -0.04 0.00 -0.44 0.00 0.00 62.40 62.21 1j6y h SER 71 CO 0.00 -0.17 0.44 0.28 -0.53 0.00 0.00 176.83 176.84 1j6y h SER 72 N 0.18 0.33 -0.94 6.23 0.02 -0.63 0.64 113.55 119.37 1j6y h SER 72 Ca 0.53 0.01 0.20 0.00 -0.84 0.00 0.00 61.79 61.69 1j6y h SER 72 Cb 1.06 -0.05 -0.08 0.00 0.14 0.00 0.00 62.40 63.46 1j6y h SER 72 CO -0.67 0.19 0.61 0.00 -1.14 0.00 0.00 176.83 175.81 1j6y h ALA 73 N 1.68 2.05 0.00 3.77 0.00 0.38 2.94 119.26 130.09 1j6y h ALA 73 Ca 0.31 0.03 -0.09 0.00 0.00 0.00 0.00 54.91 55.16 1j6y h ALA 73 Cb 0.72 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1j6y h ALA 73 CO -0.08 -0.36 -0.42 -0.22 0.00 0.00 0.00 179.25 178.16 1j6y h LYS 74 N 0.52 0.00 -1.41 0.00 3.64 0.36 -3.15 116.57 116.53 1j6y h LYS 74 Ca 0.50 0.00 -0.54 0.00 -1.27 0.00 0.00 60.65 59.34 1j6y h LYS 74 Cb 1.10 0.00 -0.42 0.00 -0.41 0.00 0.00 32.23 32.50 1j6y h LYS 74 CO -0.24 0.42 -0.82 0.54 -2.27 0.00 0.00 179.45 177.08 1j6y n ARG 75 N -3.80 2.99 0.24 1.90 3.00 0.79 -4.85 116.66 116.94 1j6y n ARG 75 Ca -0.01 -4.26 0.10 0.00 -0.01 0.00 0.00 57.85 53.67 1j6y n ARG 75 Cb 0.48 -2.05 0.62 0.00 0.00 0.00 0.00 32.46 31.51 1j6y n ARG 75 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.63 178.41 1j6y h GLY 76 N 2.66 0.00 0.00 -0.13 0.00 0.41 -3.37 103.07 102.64 1j6y h GLY 76 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.55 1j6y h GLY 76 CO 0.78 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.93 1j6y n GLY 77 N -0.52 -1.74 0.79 4.60 0.00 -1.26 -4.50 105.19 102.56 1j6y n GLY 77 Ca -0.01 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.96 1j6y n GLY 77 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1j6y n ASP 78 N 0.00 -0.24 -0.06 1.61 5.68 -1.26 -3.31 116.55 118.97 1j6y n ASP 78 Ca 0.00 -1.49 -0.04 0.00 -0.50 0.00 0.00 54.79 52.76 1j6y n ASP 78 Cb 0.00 0.50 -0.01 0.00 -1.14 0.00 0.00 41.12 40.47 1j6y n ASP 78 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1j6y n LEU 79 N 0.00 1.46 0.00 -2.12 4.32 0.51 -4.88 117.00 116.30 1j6y n LEU 79 Ca 0.01 0.53 0.00 0.00 -0.02 0.00 0.00 56.01 56.53 1j6y n LEU 79 Cb 0.14 -0.79 0.00 0.00 -1.62 0.00 0.00 43.42 41.15 1j6y n LEU 79 CO 0.07 -0.46 0.00 0.61 -1.22 0.00 0.00 177.39 176.39 1j6y n GLY 80 N 1.62 1.39 3.28 -0.72 0.00 -1.12 -4.97 105.19 104.68 1j6y n GLY 80 Ca -0.06 -0.42 -0.09 0.00 0.00 0.00 0.00 46.02 45.45 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 -0.34 0.00 1.61 1.04 -1.26 -2.78 113.70 107.97 1j6y s SER 81 Ca 0.00 1.00 0.00 0.00 0.48 0.00 0.00 55.95 57.43 1j6y s SER 81 Cb 0.00 1.25 0.00 0.00 0.10 0.00 0.00 66.02 67.37 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 5.13 0.00 0.00 5.02 -1.74 -1.18 -4.88 117.46 119.82 1j6y n PHE 82 Ca -0.12 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.77 1j6y n PHE 82 Cb 0.51 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.51 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 2.27 2.70 4.97 0.00 -1.26 0.13 105.19 114.00 1j6y n GLY 83 Ca 0.00 -0.53 -0.17 0.00 0.00 0.00 0.00 46.02 45.32 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 1.62 0.00 1.61 5.12 -1.26 -4.69 116.66 119.06 1j6y n ARG 84 Ca 0.00 -1.24 0.00 0.00 -1.93 0.00 0.00 57.85 54.68 1j6y n ARG 84 Cb 0.00 -2.35 0.00 0.00 -1.16 0.00 0.00 32.46 28.95 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 3.81 0.79 1.14 -0.13 0.00 -1.26 -5.15 105.19 104.40 1j6y n GLY 85 Ca 0.34 -2.17 0.15 0.00 0.00 0.00 0.00 46.02 44.34 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 -0.89 -2.47 -1.90 1.61 1.13 -1.26 -4.65 117.38 108.94 1j6y n GLN 86 Ca 0.00 1.85 0.00 0.00 -1.94 0.00 0.00 57.00 56.91 1j6y n GLN 86 Cb 0.00 -2.95 0.00 0.00 0.11 0.00 0.00 30.24 27.40 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 -3.93 -2.23 0.00 -1.09 2.81 -1.26 -4.61 117.12 106.82 1j6y n MET 87 Ca -0.03 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.86 1j6y n MET 87 Cb 0.53 -4.12 0.00 0.00 -0.71 0.00 0.00 33.22 28.92 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 -1.89 0.00 0.03 0.03 1.13 -1.26 -3.42 117.38 112.00 1j6y n GLN 88 Ca 0.00 0.00 0.11 0.00 -1.94 0.00 0.00 57.00 55.17 1j6y n GLN 88 Cb 0.31 0.00 -0.06 0.00 0.11 0.00 0.00 30.24 30.60 1j6y n GLN 88 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1j6y n LYS 89 N 0.00 0.46 0.00 -1.09 5.02 -1.26 -4.25 118.16 117.04 1j6y n LYS 89 Ca 0.00 -0.04 0.00 0.00 -2.02 0.00 0.00 58.31 56.25 1j6y n LYS 89 Cb 0.00 -1.61 0.00 0.00 -0.02 0.00 0.00 35.03 33.40 1j6y n LYS 89 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 1j6y n PRO 90 N -2.18 0.00 -0.22 1.97 -0.04 -1.25 -3.12 135.00 130.15 1j6y n PRO 90 Ca -0.00 0.50 -0.06 0.00 -0.04 0.00 0.00 63.50 63.90 1j6y n PRO 90 Cb 0.50 -1.13 -0.00 0.00 -0.04 0.00 0.00 33.50 32.83 1j6y n PRO 90 CO 0.00 0.00 0.00 0.35 -0.04 0.00 0.00 175.50 175.81 1j6y h PHE 91 N 0.00 -1.04 -0.49 0.54 3.04 -1.82 -1.95 116.94 115.22 1j6y h PHE 91 Ca 0.00 0.08 0.05 0.00 3.98 0.00 0.00 57.97 62.07 1j6y h PHE 91 Cb 0.00 0.55 -0.06 0.00 2.56 0.00 0.00 35.95 39.00 1j6y h PHE 91 CO 0.06 -0.40 -0.33 1.49 -2.02 0.00 0.00 178.31 177.12 1j6y h GLU 92 N -0.16 -0.05 -0.40 1.11 4.22 -1.71 2.06 114.58 119.66 1j6y h GLU 92 Ca 0.23 0.00 0.11 0.00 0.08 0.00 0.00 59.36 59.79 1j6y h GLU 92 Cb 0.56 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.80 1j6y h GLU 92 CO -0.71 -0.03 0.64 1.05 -2.18 0.00 0.00 179.01 177.77 1j6y h GLU 93 N -0.05 0.00 0.35 1.92 -0.00 -1.31 0.27 114.58 115.77 1j6y h GLU 93 Ca 0.08 0.00 -0.02 0.00 -0.00 0.00 0.00 59.36 59.42 1j6y h GLU 93 Cb 0.25 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.00 1j6y h GLU 93 CO -0.48 0.00 -0.17 0.00 -0.00 0.00 0.00 179.01 178.36 1j6y h ALA 94 N 1.10 -0.47 -0.02 1.06 0.00 0.37 0.51 119.26 121.81 1j6y h ALA 94 Ca 0.19 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 1j6y h ALA 94 Cb 1.46 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 19.42 1j6y h ALA 94 CO -0.00 -0.50 -0.38 1.15 0.00 0.00 0.00 179.25 179.51 1j6y h THR 95 N -1.00 1.28 0.00 0.00 2.02 -0.31 0.26 112.91 115.17 1j6y h THR 95 Ca -0.05 -1.34 -0.15 0.00 0.77 0.00 0.00 66.41 65.65 1j6y h THR 95 Cb 0.51 1.70 -0.02 0.00 -1.74 0.00 0.00 68.15 68.59 1j6y h THR 95 CO 0.08 0.38 -0.70 1.88 0.37 0.00 0.00 175.52 177.53 1j6y h TYR 96 N 0.03 0.00 0.09 3.16 0.05 -0.55 -3.25 116.97 116.49 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 0.69 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.41 1j6y h TYR 96 CO 0.00 0.70 -1.56 0.00 -1.05 0.00 0.00 178.16 176.26 1j6y h ALA 97 N 1.30 0.39 -2.78 3.88 0.00 0.61 -3.45 119.26 119.21 1j6y h ALA 97 Ca -0.01 -1.18 -0.57 0.00 0.00 0.00 0.00 54.91 53.15 1j6y h ALA 97 Cb 1.36 0.32 -0.06 0.00 0.00 0.00 0.00 17.79 19.41 1j6y h ALA 97 CO 0.09 1.25 -0.03 -1.17 0.00 0.00 0.00 179.25 179.39 1j6y s LEU 98 N -6.80 4.37 0.00 0.00 0.20 0.88 -5.02 118.68 112.31 1j6y s LEU 98 Ca -0.08 1.08 0.00 0.00 0.69 0.00 0.00 54.13 55.81 1j6y s LEU 98 Cb 0.07 -2.88 0.00 0.00 -0.43 0.00 0.00 46.19 42.95 1j6y s LEU 98 CO 0.84 0.05 0.00 0.29 -0.29 0.00 0.00 176.35 177.23 1j6y n LYS 99 N 3.10 0.00 -3.15 1.98 5.02 -1.26 -4.77 118.16 119.08 1j6y n LYS 99 Ca -0.06 0.00 0.05 0.00 -2.02 0.00 0.00 58.31 56.28 1j6y n LYS 99 Cb 0.51 -0.25 -0.01 0.00 -0.02 0.00 0.00 35.03 35.26 1j6y n LYS 99 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1j6y s VAL 100 N 0.00 -0.50 0.00 -0.18 1.01 -1.26 -4.70 120.40 114.77 1j6y s VAL 100 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61.98 61.98 1j6y s VAL 100 Cb 0.00 -0.87 0.00 0.00 0.00 0.00 0.00 36.38 35.51 1j6y s VAL 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 175.10 175.71 1j6y n GLY 101 N 5.40 0.38 0.12 4.51 0.00 -1.26 -4.96 105.19 109.38 1j6y n GLY 101 Ca -0.02 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.85 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 1.38 -0.58 1.61 9.92 -1.26 -4.97 116.55 122.65 1j6y n ASP 102 Ca 0.00 0.12 -0.08 0.00 -0.53 0.00 0.00 54.79 54.31 1j6y n ASP 102 Cb 0.00 -0.19 -0.03 0.00 -0.64 0.00 0.00 41.12 40.26 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 -3.18 0.00 -2.76 0.53 5.41 -1.26 -4.38 119.36 113.72 1j6y n ILE 103 Ca -0.32 0.00 -0.02 0.00 1.00 0.00 0.00 62.75 63.41 1j6y n ILE 103 Cb 1.06 -1.05 -0.02 0.00 -0.71 0.00 0.00 39.64 38.92 1j6y n ILE 103 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 1j6y n SER 104 N -0.04 -4.40 0.19 4.38 2.88 -1.26 -4.43 113.62 110.94 1j6y n SER 104 Ca -0.08 1.17 -0.15 0.00 -1.33 0.00 0.00 58.87 58.49 1j6y n SER 104 Cb 0.33 -3.16 -0.07 0.00 -0.75 0.00 0.00 64.21 60.56 1j6y n SER 104 CO 0.00 0.00 0.00 -2.24 -1.23 0.00 0.00 175.04 171.57 1j6y h ASP 105 N 4.59 -1.01 -3.96 -3.46 2.03 -1.95 -3.43 116.42 109.24 1j6y h ASP 105 Ca -0.21 0.10 -0.16 0.00 -0.73 0.00 0.00 57.03 56.03 1j6y h ASP 105 Cb 0.48 0.35 -0.25 0.00 -0.83 0.00 0.00 39.33 39.08 1j6y h ASP 105 CO 0.00 -0.49 -0.40 0.27 -1.03 0.00 0.00 179.24 177.59 1j6y s ILE 106 N -5.98 0.01 -0.53 4.15 -0.00 -1.26 -4.50 121.20 113.08 1j6y s ILE 106 Ca -0.17 -0.06 0.07 0.00 -0.00 0.00 0.00 60.65 60.49 1j6y s ILE 106 Cb 0.06 -0.39 0.27 0.00 -0.00 0.00 0.00 42.46 42.40 1j6y s ILE 106 CO 0.63 -0.04 0.70 0.52 -0.00 0.00 0.00 174.94 176.76 1j6y n VAL 107 N 2.76 1.25 -1.56 8.37 0.31 -1.06 -4.92 118.33 123.47 1j6y n VAL 107 Ca -0.14 -4.83 -0.44 0.00 -0.01 0.00 0.00 64.34 58.93 1j6y n VAL 107 Cb 0.58 -1.80 -0.04 0.00 -0.91 0.00 0.00 33.84 31.67 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 0.83 2.91 -0.06 4.52 5.68 -1.26 -1.44 116.55 127.73 1j6y n ASP 108 Ca 0.27 0.17 0.00 0.00 -0.50 0.00 0.00 54.79 54.72 1j6y n ASP 108 Cb 0.47 -1.50 0.00 0.00 -1.14 0.00 0.00 41.12 38.95 1j6y n ASP 108 CO 0.00 0.00 0.00 0.41 -1.33 0.00 0.00 177.20 176.28 1j6y n THR 109 N 7.68 0.00 -1.34 2.12 -1.04 0.38 -4.90 114.28 117.18 1j6y n THR 109 Ca 0.33 0.00 -0.39 0.00 -2.04 0.00 0.00 64.05 61.96 1j6y n THR 109 Cb 0.41 0.00 0.02 0.00 -1.82 0.00 0.00 70.33 68.94 1j6y n THR 109 CO 0.00 0.00 0.00 -0.90 -0.64 0.00 0.00 175.07 173.53 1j6y n ASP 110 N -0.15 -2.54 0.00 8.00 5.68 -1.26 -1.33 116.55 124.96 1j6y n ASP 110 Ca 0.00 0.68 0.00 0.00 -0.50 0.00 0.00 54.79 54.97 1j6y n ASP 110 Cb 0.00 -0.99 0.00 0.00 -1.14 0.00 0.00 41.12 38.99 1j6y n ASP 110 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1j6y n SER 111 N 1.61 0.00 0.00 -1.12 7.64 -1.26 -4.72 113.62 115.77 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 0.47 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.67 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 -0.57 3.72 0.23 0.00 -0.44 -4.63 105.19 103.50 1j6y n GLY 112 Ca 0.00 -0.74 -0.42 0.00 0.00 0.00 0.00 46.02 44.87 1j6y n GLY 112 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1j6y s VAL 113 N -3.55 4.53 0.00 1.61 -7.23 -1.26 -0.47 120.40 114.03 1j6y s VAL 113 Ca 0.00 1.95 0.00 0.00 -1.81 0.00 0.00 61.98 62.12 1j6y s VAL 113 Cb 0.00 -4.25 0.00 0.00 0.56 0.00 0.00 36.38 32.69 1j6y s VAL 113 CO 0.00 0.23 0.00 1.41 -0.31 0.00 0.00 175.10 176.43 1j6y n HIS 114 N 3.32 -0.51 -3.23 2.82 -0.00 -0.52 -3.01 115.22 114.10 1j6y n HIS 114 Ca 0.05 0.00 -0.02 0.00 -0.00 0.00 0.00 57.72 57.75 1j6y n HIS 114 Cb 0.49 0.00 -0.03 0.00 -0.00 0.00 0.00 29.99 30.45 1j6y n HIS 114 CO 0.00 0.00 0.00 -1.50 -0.00 0.00 0.00 176.34 174.84 1j6y s ILE 115 N 0.60 -0.83 0.58 1.59 2.07 -0.61 -2.58 121.20 122.03 1j6y s ILE 115 Ca 0.00 -0.10 -0.10 0.00 -1.41 0.00 0.00 60.65 59.04 1j6y s ILE 115 Cb 0.00 -0.97 -0.04 0.00 0.13 0.00 0.00 42.46 41.58 1j6y s ILE 115 CO 0.00 -0.11 0.98 -0.63 -1.91 0.00 0.00 174.94 173.27 1j6y s ILE 116 N 2.70 4.74 -0.14 2.00 1.09 -1.26 -1.56 121.20 128.77 1j6y s ILE 116 Ca 0.13 0.77 -0.06 0.00 -1.10 0.00 0.00 60.65 60.39 1j6y s ILE 116 Cb -0.13 -3.86 0.06 0.00 -1.06 0.00 0.00 42.46 37.48 1j6y s ILE 116 CO -0.25 -1.05 0.31 -0.75 -0.10 0.00 0.00 174.94 173.10 1j6y s LYS 117 N -5.00 0.22 0.00 2.79 2.36 -1.10 -4.20 119.74 114.80 1j6y s LYS 117 Ca 0.54 0.76 0.00 0.00 -2.55 0.00 0.00 55.97 54.72 1j6y s LYS 117 Cb -0.11 0.02 0.00 0.00 -1.05 0.00 0.00 37.83 36.69 1j6y s LYS 117 CO 0.50 -0.24 0.00 -2.13 1.55 0.00 0.00 175.35 175.04 1j6y n ARG 118 N 4.99 2.39 -1.28 4.03 0.63 -1.26 -0.57 116.66 125.58 1j6y n ARG 118 Ca -0.13 0.00 -0.38 0.00 -0.92 0.00 0.00 57.85 56.42 1j6y n ARG 118 Cb 0.51 0.00 0.02 0.00 0.45 0.00 0.00 32.46 33.44 1j6y n ARG 118 CO 0.00 0.00 0.00 2.41 -2.51 0.00 0.00 177.63 177.53 1j6y n THR 119 N -0.09 0.68 0.00 5.15 -1.04 -1.26 -4.93 114.28 112.79 1j6y n THR 119 Ca 0.00 -0.49 0.00 0.00 -2.04 0.00 0.00 64.05 61.52 1j6y n THR 119 Cb 0.00 -0.22 0.00 0.00 -1.82 0.00 0.00 70.33 68.29 1j6y n THR 119 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43