#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 -3.47 1.57 0.00 -1.26 -5.03 117.12 108.94 1j6y n MET 2 Ca 0.00 0.01 -0.33 0.00 0.00 0.00 0.00 57.70 57.38 1j6y n MET 2 Cb 0.00 -0.30 0.03 0.00 0.00 0.00 0.00 33.22 32.95 1j6y n MET 2 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1j6y n ALA 3 N -2.01 -2.45 -1.15 3.04 0.00 -1.26 -4.57 120.51 112.12 1j6y n ALA 3 Ca 0.00 0.34 0.13 0.00 0.00 0.00 0.00 53.44 53.91 1j6y n ALA 3 Cb 0.00 -2.19 -0.05 0.00 0.00 0.00 0.00 19.45 17.21 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 -0.57 -5.87 -2.24 0.00 7.64 -1.26 -4.90 113.62 106.41 1j6y n SER 4 Ca -0.10 0.70 0.00 0.00 1.01 0.00 0.00 58.87 60.49 1j6y n SER 4 Cb 0.66 -3.68 0.00 0.00 -1.01 0.00 0.00 64.21 60.18 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 -3.56 2.76 0.00 1.43 0.00 -1.26 -5.09 116.66 110.93 1j6y n ARG 5 Ca -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.82 1j6y n ARG 5 Cb 0.62 0.00 0.00 0.00 -0.00 0.00 0.00 32.46 33.08 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 -0.42 2.89 2.03 -1.26 -5.12 116.55 114.67 1j6y n ASP 6 Ca 0.00 0.00 0.04 0.00 0.52 0.00 0.00 54.79 55.35 1j6y n ASP 6 Cb 0.00 0.00 -0.01 0.00 -0.72 0.00 0.00 41.12 40.39 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 -2.22 -0.55 -3.62 -0.67 7.27 -1.26 -4.66 117.38 111.67 1j6y n GLN 7 Ca 0.00 0.36 -0.29 0.00 0.07 0.00 0.00 57.00 57.14 1j6y n GLN 7 Cb 0.00 -0.67 -0.13 0.00 2.41 0.00 0.00 30.24 31.85 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 -0.80 0.86 0.78 1.69 0.11 0.19 -4.91 120.40 118.32 1j6y s VAL 8 Ca 0.00 -2.12 -0.11 0.00 -2.93 0.00 0.00 61.98 56.82 1j6y s VAL 8 Cb 0.00 -1.62 0.06 0.00 -1.53 0.00 0.00 36.38 33.29 1j6y s VAL 8 CO 0.00 -0.91 1.08 -0.54 -3.33 0.00 0.00 175.10 171.40 1j6y s LYS 9 N 0.75 2.26 0.00 1.54 1.02 -1.25 -2.91 119.74 121.14 1j6y s LYS 9 Ca 0.17 0.91 0.00 0.00 0.02 0.00 0.00 55.97 57.07 1j6y s LYS 9 Cb -0.23 -1.92 0.00 0.00 -0.52 0.00 0.00 37.83 35.16 1j6y s LYS 9 CO -0.02 -1.57 0.00 0.00 -0.92 0.00 0.00 175.35 172.85 1j6y n ALA 10 N -3.44 0.00 -2.73 5.17 0.00 -1.11 -4.93 120.51 113.47 1j6y n ALA 10 Ca 0.08 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.19 1j6y n ALA 10 Cb 0.54 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.93 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 4.23 -0.18 0.00 1.04 -0.78 -0.47 113.70 117.54 1j6y s SER 11 Ca 0.00 -1.64 -0.30 0.00 0.48 0.00 0.00 55.95 54.49 1j6y s SER 11 Cb 0.00 0.63 0.14 0.00 0.10 0.00 0.00 66.02 66.89 1j6y s SER 11 CO 0.00 -0.94 1.05 -1.38 0.98 0.00 0.00 173.24 172.94 1j6y s HIS 12 N -2.89 -0.33 0.11 5.02 -3.43 -1.20 -2.96 115.29 109.61 1j6y s HIS 12 Ca 0.06 0.56 0.04 0.00 -0.80 0.00 0.00 55.06 54.92 1j6y s HIS 12 Cb 0.00 0.45 -0.04 0.00 -1.43 0.00 0.00 32.58 31.57 1j6y s HIS 12 CO 0.04 -0.30 -0.11 0.42 -2.00 0.00 0.00 174.74 172.79 1j6y s ILE 13 N -1.08 1.06 -0.05 -5.38 1.01 0.35 -4.77 121.20 112.35 1j6y s ILE 13 Ca -0.00 -1.68 0.04 0.00 0.00 0.00 0.00 60.65 59.01 1j6y s ILE 13 Cb -0.01 -1.43 -0.00 0.00 0.01 0.00 0.00 42.46 41.03 1j6y s ILE 13 CO 0.00 -0.53 -0.18 -0.22 0.00 0.00 0.00 174.94 174.01 1j6y s LEU 14 N -2.49 1.92 0.01 2.97 2.96 0.83 0.18 118.68 125.06 1j6y s LEU 14 Ca 0.07 -0.37 0.01 0.00 -0.22 0.00 0.00 54.13 53.62 1j6y s LEU 14 Cb -0.03 -1.01 -0.04 0.00 0.50 0.00 0.00 46.19 45.61 1j6y s LEU 14 CO 0.01 0.15 0.05 -0.63 -1.32 0.00 0.00 176.35 174.61 1j6y s ILE 15 N 0.06 4.48 0.15 6.68 1.01 -0.44 -2.79 121.20 130.35 1j6y s ILE 15 Ca -0.05 -0.54 -0.30 0.00 0.00 0.00 0.00 60.65 59.76 1j6y s ILE 15 Cb -0.12 -3.05 -0.07 0.00 0.01 0.00 0.00 42.46 39.23 1j6y s ILE 15 CO 0.03 0.32 1.17 -1.59 0.00 0.00 0.00 174.94 174.87 1j6y s LYS 16 N -1.78 4.51 0.00 2.79 -2.85 -1.26 -4.29 119.74 116.86 1j6y s LYS 16 Ca 0.23 1.80 0.00 0.00 -1.00 0.00 0.00 55.97 56.99 1j6y s LYS 16 Cb -0.12 -3.28 0.00 0.00 -2.06 0.00 0.00 37.83 32.37 1j6y s LYS 16 CO 0.14 -0.09 0.00 -2.39 0.10 0.00 0.00 175.35 173.11 1j6y n HIS 17 N 2.87 -0.43 0.00 1.78 1.44 -1.26 -4.41 115.22 115.20 1j6y n HIS 17 Ca 0.05 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.76 1j6y n HIS 17 Cb 0.46 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.57 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 -0.11 -4.73 117.38 112.27 1j6y n GLN 18 Ca 0.00 0.10 0.00 0.00 -1.94 0.00 0.00 57.00 55.16 1j6y n GLN 18 Cb 0.00 -0.81 0.00 0.00 0.11 0.00 0.00 30.24 29.54 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 2.84 3.22 1.08 0.00 -1.26 -4.69 105.19 105.97 1j6y n GLY 19 Ca 0.00 -0.01 -0.13 0.00 0.00 0.00 0.00 46.02 45.88 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 0.89 0.79 1.61 0.15 -1.26 -5.08 113.70 106.80 1j6y s SER 20 Ca 0.00 -1.22 0.00 0.00 0.70 0.00 0.00 55.95 55.43 1j6y s SER 20 Cb 0.00 0.19 0.00 0.00 -1.71 0.00 0.00 66.02 64.50 1j6y s SER 20 CO 0.00 -0.65 0.00 0.54 1.20 0.00 0.00 173.24 174.33 1j6y n ARG 21 N -0.22 0.00 -3.69 5.44 5.12 -1.26 -4.65 116.66 117.40 1j6y n ARG 21 Ca -0.05 0.00 -0.14 0.00 -1.93 0.00 0.00 57.85 55.73 1j6y n ARG 21 Cb 0.64 0.00 -0.14 0.00 -1.16 0.00 0.00 32.46 31.80 1j6y n ARG 21 CO 0.00 0.00 0.00 0.50 -1.93 0.00 0.00 177.63 176.20 1j6y s ARG 22 N 0.00 0.14 0.00 5.56 6.06 -1.26 -5.00 118.95 124.45 1j6y s ARG 22 Ca 0.00 0.63 0.00 0.00 -2.50 0.00 0.00 55.73 53.86 1j6y s ARG 22 Cb 0.00 -0.11 0.00 0.00 0.06 0.00 0.00 34.95 34.90 1j6y s ARG 22 CO 0.00 -0.25 0.00 1.17 -2.50 0.00 0.00 175.30 173.72 1j6y n LYS 23 N 4.98 0.00 0.00 5.12 0.00 -1.26 -3.86 118.16 123.14 1j6y n LYS 23 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.19 1j6y n LYS 23 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.54 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 0.84 0.00 -3.32 3.14 0.00 -1.26 -4.80 120.51 115.11 1j6y n ALA 24 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.33 1j6y n ALA 24 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1j6y n ALA 24 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1j6y n SER 25 N 0.00 -6.69 -4.07 0.00 7.64 -1.25 -4.61 113.62 104.64 1j6y n SER 25 Ca 0.00 -0.35 -0.20 0.00 1.01 0.00 0.00 58.87 59.33 1j6y n SER 25 Cb 0.00 -3.90 -0.14 0.00 -1.01 0.00 0.00 64.21 59.16 1j6y n SER 25 CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 1j6y s TRP 26 N -2.91 1.02 -0.40 1.43 0.23 -1.26 -5.06 118.94 111.99 1j6y s TRP 26 Ca 0.03 -0.22 0.11 0.00 -2.03 0.00 0.00 56.10 53.99 1j6y s TRP 26 Cb -0.01 -0.65 0.41 0.00 0.03 0.00 0.00 33.47 33.25 1j6y s TRP 26 CO 0.81 -0.01 0.94 0.36 0.96 0.00 0.00 176.95 180.01 1j6y n LYS 27 N 2.61 2.01 0.02 4.98 2.85 -1.26 -4.90 118.16 124.47 1j6y n LYS 27 Ca -0.15 -3.85 0.00 0.00 -1.05 0.00 0.00 58.31 53.26 1j6y n LYS 27 Cb 0.56 -1.76 0.00 0.00 -0.65 0.00 0.00 35.03 33.18 1j6y n LYS 27 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1j6y n ASP 28 N -0.12 0.04 -4.72 -5.58 9.92 -1.26 -5.06 116.55 109.77 1j6y n ASP 28 Ca 0.24 0.06 -0.42 0.00 -0.53 0.00 0.00 54.79 54.13 1j6y n ASP 28 Cb 0.68 0.02 -0.03 0.00 -0.64 0.00 0.00 41.12 41.15 1j6y n ASP 28 CO 0.00 0.00 0.00 -2.16 0.13 0.00 0.00 177.20 175.17 1j6y s PRO 29 N -1.15 4.36 -0.69 -0.24 0.04 -1.26 -4.97 135.00 131.08 1j6y s PRO 29 Ca 0.00 2.00 0.05 0.00 0.04 0.00 0.00 61.00 63.09 1j6y s PRO 29 Cb 0.00 -3.26 0.22 0.00 0.04 0.00 0.00 34.50 31.50 1j6y s PRO 29 CO 0.00 -0.36 0.68 0.39 0.04 0.00 0.00 177.00 177.75 1j6y n GLU 30 N 3.70 2.34 0.25 4.56 -0.58 -1.26 -4.88 120.64 124.77 1j6y n GLU 30 Ca 0.10 -4.60 0.09 0.00 -0.42 0.00 0.00 57.16 52.33 1j6y n GLU 30 Cb 0.43 -2.29 0.65 0.00 -0.57 0.00 0.00 31.44 29.67 1j6y n GLU 30 CO 0.00 0.00 0.00 0.78 -0.48 0.00 0.00 177.13 177.43 1j6y h GLY 31 N 4.75 0.00 -4.79 0.62 0.00 -1.98 -3.48 103.07 98.19 1j6y h GLY 31 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.51 1j6y h GLY 31 CO 0.81 0.00 -0.89 0.28 0.00 0.00 0.00 176.54 176.74 1j6y n LYS 32 N -4.27 -3.87 0.00 4.80 5.02 -1.26 -4.72 118.16 113.87 1j6y n LYS 32 Ca -0.03 2.85 0.00 0.00 -2.02 0.00 0.00 58.31 59.12 1j6y n LYS 32 Cb 0.15 -3.77 0.00 0.00 -0.02 0.00 0.00 35.03 31.39 1j6y n LYS 32 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 1j6y n ILE 33 N 1.91 0.00 -2.93 -0.18 5.41 -1.26 -4.94 119.36 117.37 1j6y n ILE 33 Ca -0.10 0.00 -0.09 0.00 1.00 0.00 0.00 62.75 63.55 1j6y n ILE 33 Cb 0.16 0.00 0.01 0.00 -0.71 0.00 0.00 39.64 39.10 1j6y n ILE 33 CO 0.00 0.00 0.00 -0.38 0.00 0.00 0.00 176.55 176.17 1j6y n ILE 34 N 0.00 -9.63 -0.80 1.39 5.41 -1.26 -4.94 119.36 109.53 1j6y n ILE 34 Ca 0.00 1.04 -0.29 0.00 1.00 0.00 0.00 62.75 64.50 1j6y n ILE 34 Cb 0.00 -6.31 0.21 0.00 -0.71 0.00 0.00 39.64 32.83 1j6y n ILE 34 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 1j6y s LEU 35 N -2.16 1.46 0.00 1.39 1.02 -1.26 -5.02 118.68 114.11 1j6y s LEU 35 Ca 0.17 1.53 0.00 0.00 0.02 0.00 0.00 54.13 55.85 1j6y s LEU 35 Cb -0.04 -3.63 0.00 0.00 0.02 0.00 0.00 46.19 42.54 1j6y s LEU 35 CO 0.72 -3.61 0.00 0.35 0.02 0.00 0.00 176.35 173.83 1j6y n THR 36 N -4.52 0.00 -3.99 5.49 -2.24 -1.26 -5.11 114.28 102.65 1j6y n THR 36 Ca 0.05 0.00 -0.33 0.00 -2.27 0.00 0.00 64.05 61.50 1j6y n THR 36 Cb 0.55 -0.08 -0.06 0.00 -2.10 0.00 0.00 70.33 68.64 1j6y n THR 36 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1j6y s THR 37 N 0.00 5.12 0.00 4.28 2.01 -1.26 -5.05 115.64 120.74 1j6y s THR 37 Ca 0.00 -0.28 0.00 0.00 0.31 0.00 0.00 61.69 61.72 1j6y s THR 37 Cb 0.00 -3.37 0.00 0.00 0.01 0.00 0.00 72.50 69.14 1j6y s THR 37 CO 0.00 0.33 0.00 0.35 -0.69 0.00 0.00 174.62 174.61 1j6y n THR 38 N 1.04 0.00 0.00 -0.82 -2.24 -1.26 -0.94 114.28 110.07 1j6y n THR 38 Ca -0.12 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.66 1j6y n THR 38 Cb 0.53 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.76 1j6y n THR 38 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1j6y n ARG 39 N 0.00 0.00 -0.14 -0.78 5.12 -1.26 0.04 116.66 119.64 1j6y n ARG 39 Ca 0.00 0.24 -0.10 0.00 -1.93 0.00 0.00 57.85 56.05 1j6y n ARG 39 Cb 0.00 -1.12 -0.05 0.00 -1.16 0.00 0.00 32.46 30.13 1j6y n ARG 39 CO 0.00 0.00 0.00 1.49 -1.93 0.00 0.00 177.63 177.19 1j6y h GLU 40 N 0.00 -0.31 -0.58 5.56 4.57 -2.00 -0.34 114.58 121.47 1j6y h GLU 40 Ca 0.00 0.02 0.12 0.00 -1.18 0.00 0.00 59.36 58.32 1j6y h GLU 40 Cb 0.00 0.07 -0.11 0.00 -0.16 0.00 0.00 28.75 28.55 1j6y h GLU 40 CO 0.00 -0.21 -0.17 0.00 -1.18 0.00 0.00 179.01 177.45 1j6y h ALA 41 N 0.37 0.33 -0.26 2.92 0.00 -1.96 -1.10 119.26 119.57 1j6y h ALA 41 Ca 0.13 0.22 0.03 0.00 0.00 0.00 0.00 54.91 55.29 1j6y h ALA 41 Cb 0.58 0.48 -0.04 0.00 0.00 0.00 0.00 17.79 18.82 1j6y h ALA 41 CO -0.60 -0.46 -0.25 0.00 0.00 0.00 0.00 179.25 177.95 1j6y h ALA 42 N 1.51 -0.42 -0.80 0.00 0.00 0.14 0.81 119.26 120.50 1j6y h ALA 42 Ca 0.27 0.02 0.18 0.00 0.00 0.00 0.00 54.91 55.38 1j6y h ALA 42 Cb 0.45 0.98 -0.05 0.00 0.00 0.00 0.00 17.79 19.16 1j6y h ALA 42 CO -0.61 -0.56 0.54 0.28 0.00 0.00 0.00 179.25 178.90 1j6y h VAL 43 N -0.12 0.73 0.01 0.00 2.07 -1.22 0.17 116.25 117.89 1j6y h VAL 43 Ca 0.04 -0.12 -0.00 0.00 0.82 0.00 0.00 66.70 67.45 1j6y h VAL 43 Cb 0.23 0.36 0.00 0.00 -1.52 0.00 0.00 31.29 30.36 1j6y h VAL 43 CO -0.31 0.06 -0.01 -0.08 0.02 0.00 0.00 177.57 177.26 1j6y h GLU 44 N 0.34 -0.02 -0.80 1.57 4.81 0.16 0.64 114.58 121.29 1j6y h GLU 44 Ca 0.40 0.00 0.10 0.00 -0.13 0.00 0.00 59.36 59.73 1j6y h GLU 44 Cb 1.05 0.00 -0.08 0.00 0.63 0.00 0.00 28.75 30.35 1j6y h GLU 44 CO -0.12 0.15 0.43 0.37 -0.73 0.00 0.00 179.01 179.11 1j6y h GLN 45 N -0.18 0.69 0.00 1.92 5.75 0.22 0.24 115.11 123.75 1j6y h GLN 45 Ca -0.00 -0.04 -0.09 0.00 -0.15 0.00 0.00 58.65 58.36 1j6y h GLN 45 Cb 0.17 -0.16 -0.01 0.00 1.07 0.00 0.00 27.48 28.55 1j6y h GLN 45 CO 0.00 0.46 -0.45 -0.07 -2.65 0.00 0.00 178.83 176.13 1j6y h LEU 46 N 0.71 0.00 -1.06 -2.39 4.07 -0.72 -2.55 115.31 113.38 1j6y h LEU 46 Ca 0.39 0.00 0.11 0.00 0.08 0.00 0.00 57.88 58.46 1j6y h LEU 46 Cb 0.41 0.00 -0.08 0.00 1.08 0.00 0.00 40.66 42.07 1j6y h LEU 46 CO -0.27 0.45 0.62 0.50 -1.08 0.00 0.00 178.44 178.66 1j6y h LYS 47 N 0.00 0.97 0.00 1.13 3.64 0.38 0.25 116.57 122.94 1j6y h LYS 47 Ca -0.00 -0.06 -0.21 0.00 -1.27 0.00 0.00 60.65 59.11 1j6y h LYS 47 Cb 0.82 -0.22 -0.03 0.00 -0.41 0.00 0.00 32.23 32.39 1j6y h LYS 47 CO 0.06 0.64 -1.05 0.66 -2.27 0.00 0.00 179.45 177.49 1j6y h SER 48 N 1.00 0.00 0.53 4.20 4.64 -1.25 -2.96 113.55 119.70 1j6y h SER 48 Ca 0.47 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.76 1j6y h SER 48 Cb 0.43 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.52 1j6y h SER 48 CO -0.23 0.93 -0.26 -0.29 -0.87 0.00 0.00 176.83 176.12 1j6y h ILE 49 N 0.00 0.42 -0.79 0.95 -0.00 -0.68 1.63 117.51 119.04 1j6y h ILE 49 Ca -0.05 -0.25 0.10 0.00 -0.00 0.00 0.00 64.86 64.65 1j6y h ILE 49 Cb 1.75 0.52 -0.07 0.00 -0.00 0.00 0.00 36.82 39.02 1j6y h ILE 49 CO 0.11 0.04 0.43 -0.09 -0.00 0.00 0.00 178.15 178.65 1j6y h ARG 50 N -0.88 0.70 0.65 2.19 1.12 -1.15 1.33 114.38 118.34 1j6y h ARG 50 Ca -0.07 -0.04 -0.03 0.00 -1.11 0.00 0.00 59.98 58.72 1j6y h ARG 50 Cb 0.61 -0.16 0.01 0.00 -0.01 0.00 0.00 29.97 30.42 1j6y h ARG 50 CO 0.12 0.46 -0.31 1.49 -3.11 0.00 0.00 179.97 178.62 1j6y h GLU 51 N 0.72 -0.84 -0.14 0.20 4.57 -1.31 1.69 114.58 119.47 1j6y h GLU 51 Ca 0.39 0.06 0.05 0.00 -1.18 0.00 0.00 59.36 58.67 1j6y h GLU 51 Cb 0.38 0.19 -0.05 0.00 -0.16 0.00 0.00 28.75 29.11 1j6y h GLU 51 CO -0.26 -0.52 -0.20 0.22 -1.18 0.00 0.00 179.01 177.07 1j6y h ASP 52 N -1.02 -0.61 0.32 1.04 1.82 0.31 0.60 116.42 118.89 1j6y h ASP 52 Ca -0.09 0.11 -0.02 0.00 -0.39 0.00 0.00 57.03 56.64 1j6y h ASP 52 Cb 0.71 0.28 -0.00 0.00 0.68 0.00 0.00 39.33 40.99 1j6y h ASP 52 CO 0.15 -0.25 -0.08 0.40 -1.61 0.00 0.00 179.24 177.85 1j6y h ILE 53 N -0.24 0.45 0.11 2.25 2.04 0.18 -2.70 117.51 119.60 1j6y h ILE 53 Ca 0.10 -0.39 -0.01 0.00 1.00 0.00 0.00 64.86 65.57 1j6y h ILE 53 Cb 0.39 1.27 0.00 0.00 -0.74 0.00 0.00 36.82 37.74 1j6y h ILE 53 CO -0.28 0.08 -0.06 0.58 0.00 0.00 0.00 178.15 178.47 1j6y h VAL 54 N 0.00 1.06 -2.96 1.67 2.07 0.72 -3.44 116.25 115.37 1j6y h VAL 54 Ca -0.00 -1.19 -0.62 0.00 0.82 0.00 0.00 66.70 65.71 1j6y h VAL 54 Cb 0.26 1.75 -0.07 0.00 -1.52 0.00 0.00 31.29 31.71 1j6y h VAL 54 CO 0.01 0.26 -0.32 -0.44 0.02 0.00 0.00 177.57 177.11 1j6y s SER 55 N -5.56 6.59 0.02 0.57 0.01 0.16 -4.81 113.70 110.68 1j6y s SER 55 Ca -0.14 0.71 0.00 0.00 1.31 0.00 0.00 55.95 57.82 1j6y s SER 55 Cb 0.01 -2.18 0.00 0.00 0.21 0.00 0.00 66.02 64.06 1j6y s SER 55 CO 0.55 0.30 0.00 0.61 0.41 0.00 0.00 173.24 175.11 1j6y n GLY 56 N 2.23 -3.69 2.63 3.44 0.00 -1.26 -4.57 105.19 103.97 1j6y n GLY 56 Ca -0.15 -0.50 -0.06 0.00 0.00 0.00 0.00 46.02 45.30 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 0.43 0.69 -0.15 1.61 3.00 -1.26 -4.71 118.16 117.77 1j6y n LYS 57 Ca 0.00 -0.60 -0.10 0.00 -0.00 0.00 0.00 58.31 57.61 1j6y n LYS 57 Cb 0.00 -1.93 0.09 0.00 0.00 0.00 0.00 35.03 33.19 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 3.86 -1.69 -1.40 3.14 0.00 -1.26 -5.02 120.51 118.14 1j6y n ALA 58 Ca 0.15 -0.49 0.00 0.00 0.00 0.00 0.00 53.44 53.10 1j6y n ALA 58 Cb 0.13 -0.04 0.00 0.00 0.00 0.00 0.00 19.45 19.53 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 -2.79 0.00 0.00 0.00 5.03 -1.26 -5.05 115.26 111.19 1j6y n ASN 59 Ca 0.04 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.49 1j6y n ASN 59 Cb 0.19 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 38.95 1j6y n ASN 59 CO 0.00 0.00 0.00 0.33 -1.83 0.00 0.00 177.26 175.76 1j6y n PHE 60 N 0.00 0.00 0.00 3.10 -0.00 -1.26 -4.97 117.46 114.33 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 -0.48 0.00 -0.38 -4.13 -0.58 -1.26 -1.47 120.64 112.34 1j6y n GLU 61 Ca 0.00 0.07 0.33 0.00 -0.42 0.00 0.00 57.16 57.14 1j6y n GLU 61 Cb 0.00 -0.98 0.60 0.00 -0.57 0.00 0.00 31.44 30.49 1j6y n GLU 61 CO 0.00 0.00 0.00 1.49 -0.48 0.00 0.00 177.13 178.14 1j6y h GLU 62 N 0.00 0.08 -0.35 3.49 4.81 -1.96 1.14 114.58 121.79 1j6y h GLU 62 Ca 0.00 -0.00 0.03 0.00 -0.13 0.00 0.00 59.36 59.26 1j6y h GLU 62 Cb 0.00 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.33 1j6y h GLU 62 CO 0.00 0.05 0.16 0.28 -0.73 0.00 0.00 179.01 178.77 1j6y h VAL 63 N 0.08 0.95 0.61 0.32 2.07 -1.92 -2.62 116.25 115.75 1j6y h VAL 63 Ca 0.83 -0.11 -0.03 0.00 0.82 0.00 0.00 66.70 68.21 1j6y h VAL 63 Cb 2.33 0.60 0.01 0.00 -1.52 0.00 0.00 31.29 32.71 1j6y h VAL 63 CO -0.60 0.06 -0.29 0.00 0.02 0.00 0.00 177.57 176.75 1j6y h ALA 64 N 1.20 -0.82 -0.96 1.67 0.00 0.25 0.84 119.26 121.44 1j6y h ALA 64 Ca 0.15 -0.19 0.37 0.00 0.00 0.00 0.00 54.91 55.24 1j6y h ALA 64 Cb 0.08 0.32 -0.17 0.00 0.00 0.00 0.00 17.79 18.02 1j6y h ALA 64 CO -0.12 -0.94 0.40 0.25 0.00 0.00 0.00 179.25 178.84 1j6y n THR 65 N -5.43 -0.40 -0.06 0.00 -2.24 -0.78 -0.35 114.28 105.02 1j6y n THR 65 Ca -0.13 1.98 -0.04 0.00 -2.27 0.00 0.00 64.05 63.59 1j6y n THR 65 Cb 0.34 -3.13 -0.03 0.00 -2.10 0.00 0.00 70.33 65.41 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 -2.73 -0.78 2.43 -1.10 -3.38 114.38 108.82 1j6y h ARG 66 Ca 0.76 0.00 -0.76 0.00 -0.81 0.00 0.00 59.98 59.17 1j6y h ARG 66 Cb 1.93 0.00 -0.16 0.00 -0.42 0.00 0.00 29.97 31.32 1j6y h ARG 66 CO -0.77 0.22 2.01 1.55 -1.51 0.00 0.00 179.97 181.47 1j6y n VAL 67 N -4.71 5.25 -4.46 0.20 3.14 0.26 -4.95 118.33 113.05 1j6y n VAL 67 Ca -0.04 -4.73 -0.23 0.00 -2.96 0.00 0.00 64.34 56.39 1j6y n VAL 67 Cb 0.15 -2.03 -0.10 0.00 -1.06 0.00 0.00 33.84 30.79 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 0.02 3.06 -0.99 6.55 1.04 0.53 -0.12 113.70 123.78 1j6y s SER 68 Ca 0.47 -1.18 -0.18 0.00 0.48 0.00 0.00 55.95 55.53 1j6y s SER 68 Cb 0.16 -0.22 -0.09 0.00 0.10 0.00 0.00 66.02 65.96 1j6y s SER 68 CO -0.07 -0.29 2.05 -0.67 0.98 0.00 0.00 173.24 175.24 1j6y n ASP 69 N -0.64 3.19 0.00 7.02 -0.08 -1.26 -4.48 116.55 120.29 1j6y n ASP 69 Ca -0.05 -2.70 0.00 0.00 -1.51 0.00 0.00 54.79 50.53 1j6y n ASP 69 Cb 0.63 -1.27 0.00 0.00 2.34 0.00 0.00 41.12 42.82 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 -0.19 -0.81 0.00 0.87 -1.90 2.10 113.55 113.62 1j6y h SER 71 Ca 0.00 0.23 0.08 0.00 -1.23 0.00 0.00 61.79 60.87 1j6y h SER 71 Cb 0.00 0.35 -0.05 0.00 -0.44 0.00 0.00 62.40 62.25 1j6y h SER 71 CO 0.00 -0.24 0.53 0.28 -0.53 0.00 0.00 176.83 176.87 1j6y h SER 72 N 0.12 0.73 -1.10 6.23 0.02 -1.60 0.67 113.55 118.62 1j6y h SER 72 Ca 0.56 0.01 0.31 0.00 -0.84 0.00 0.00 61.79 61.83 1j6y h SER 72 Cb 1.14 -0.14 -0.06 0.00 0.14 0.00 0.00 62.40 63.49 1j6y h SER 72 CO -0.75 0.45 0.77 0.00 -1.14 0.00 0.00 176.83 176.16 1j6y h ALA 73 N 1.58 2.86 0.05 3.77 0.00 0.33 2.95 119.26 130.80 1j6y h ALA 73 Ca 0.36 -0.01 -0.28 0.00 0.00 0.00 0.00 54.91 54.98 1j6y h ALA 73 Cb 0.35 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 1j6y h ALA 73 CO -0.14 -1.20 -1.50 -0.22 0.00 0.00 0.00 179.25 176.18 1j6y h LYS 74 N 0.09 0.11 -2.25 0.00 3.11 0.34 -3.38 116.57 114.60 1j6y h LYS 74 Ca 0.55 -0.19 -0.59 0.00 -2.81 0.00 0.00 60.65 57.61 1j6y h LYS 74 Cb 1.98 0.07 -0.42 0.00 -1.00 0.00 0.00 32.23 32.87 1j6y h LYS 74 CO -0.08 0.89 -0.65 -2.13 -2.81 0.00 0.00 179.45 174.67 1j6y n ARG 75 N -3.29 2.95 0.10 1.90 0.00 0.72 -4.85 116.66 114.18 1j6y n ARG 75 Ca -0.14 -4.75 0.12 0.00 -0.00 0.00 0.00 57.85 53.08 1j6y n ARG 75 Cb 1.02 -2.22 0.46 0.00 0.00 0.00 0.00 32.46 31.72 1j6y n ARG 75 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1j6y n GLY 76 N 0.09 -1.37 0.00 5.14 0.00 0.82 -4.38 105.19 105.49 1j6y n GLY 76 Ca 0.30 0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.36 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 0.43 -0.77 3.14 -0.02 0.00 -1.26 -4.57 105.19 102.15 1j6y n GLY 77 Ca 0.03 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.87 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 -0.79 -0.04 1.61 5.75 -1.26 -3.28 116.55 118.55 1j6y n ASP 78 Ca 0.00 -3.08 -0.01 0.00 -0.01 0.00 0.00 54.79 51.69 1j6y n ASP 78 Cb 0.00 1.76 -0.00 0.00 -1.03 0.00 0.00 41.12 41.85 1j6y n ASP 78 CO 0.00 0.00 0.00 -0.07 -0.11 0.00 0.00 177.20 177.02 1j6y h LEU 79 N 0.00 0.00 0.00 -2.12 4.07 -1.07 -3.47 115.31 112.72 1j6y h LEU 79 Ca -0.23 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.73 1j6y h LEU 79 Cb 1.16 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.90 1j6y h LEU 79 CO 0.34 0.36 0.00 0.61 -1.08 0.00 0.00 178.44 178.66 1j6y n GLY 80 N 1.81 1.27 3.30 0.83 0.00 -1.15 -4.98 105.19 106.27 1j6y n GLY 80 Ca -0.01 -0.36 -0.09 0.00 0.00 0.00 0.00 46.02 45.55 1j6y n GLY 80 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1j6y s SER 81 N -4.00 -0.48 0.00 1.61 1.04 -1.26 -2.76 113.70 107.85 1j6y s SER 81 Ca 0.00 0.98 0.00 0.00 0.48 0.00 0.00 55.95 57.41 1j6y s SER 81 Cb 0.00 1.01 0.00 0.00 0.10 0.00 0.00 66.02 67.13 1j6y s SER 81 CO 0.00 -0.21 0.00 2.22 0.98 0.00 0.00 173.24 176.23 1j6y n PHE 82 N 4.61 0.00 0.00 5.02 -1.74 -1.15 -4.88 117.46 119.33 1j6y n PHE 82 Ca -0.19 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.70 1j6y n PHE 82 Cb 0.54 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.54 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 2.05 3.17 4.97 0.00 -1.26 -0.63 105.19 113.49 1j6y n GLY 83 Ca 0.00 -0.55 -0.39 0.00 0.00 0.00 0.00 46.02 45.08 1j6y n GLY 83 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1j6y s ARG 84 N 0.00 2.60 0.00 1.61 3.03 -1.26 -4.40 118.95 120.53 1j6y s ARG 84 Ca 0.00 -2.17 0.00 0.00 2.03 0.00 0.00 55.73 55.59 1j6y s ARG 84 Cb 0.00 -3.87 0.00 0.00 -1.03 0.00 0.00 34.95 30.05 1j6y s ARG 84 CO 0.00 -1.18 0.00 0.41 -1.13 0.00 0.00 175.30 173.40 1j6y n GLY 85 N 4.18 1.29 2.15 3.88 0.00 -1.26 -5.12 105.19 110.30 1j6y n GLY 85 Ca 0.02 -0.03 -0.19 0.00 0.00 0.00 0.00 46.02 45.82 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 1.27 0.00 1.61 6.02 -1.26 -5.05 117.38 119.96 1j6y n GLN 86 Ca 0.00 -2.18 0.00 0.00 -0.01 0.00 0.00 57.00 54.81 1j6y n GLN 86 Cb 0.00 0.57 0.00 0.00 1.02 0.00 0.00 30.24 31.83 1j6y n GLN 86 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 177.06 174.72 1j6y n MET 87 N -0.77 0.00 0.00 -1.09 2.81 -1.26 -4.73 117.12 112.08 1j6y n MET 87 Ca -0.12 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.77 1j6y n MET 87 Cb 0.38 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.89 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 0.09 0.03 1.13 -1.26 -4.99 117.38 112.38 1j6y n GLN 88 Ca 0.00 0.00 -0.06 0.00 -1.94 0.00 0.00 57.00 55.00 1j6y n GLN 88 Cb 0.00 0.00 0.08 0.00 0.11 0.00 0.00 30.24 30.43 1j6y n GLN 88 CO 0.00 0.00 0.00 -0.22 -1.44 0.00 0.00 177.06 175.40 1j6y h LYS 89 N 0.00 0.19 0.14 -1.09 3.11 -1.96 -2.80 116.57 114.15 1j6y h LYS 89 Ca 0.00 -0.16 -0.01 0.00 -2.81 0.00 0.00 60.65 57.68 1j6y h LYS 89 Cb 0.00 0.03 0.00 0.00 -1.00 0.00 0.00 32.23 31.26 1j6y h LYS 89 CO 0.00 0.82 -0.06 -1.00 -2.81 0.00 0.00 179.45 176.39 1j6y h PRO 90 N 0.13 -0.17 0.59 1.90 0.13 -1.96 -2.94 132.00 129.66 1j6y h PRO 90 Ca -0.02 0.01 -0.03 0.00 -0.87 0.00 0.00 66.00 65.09 1j6y h PRO 90 Cb 1.26 0.04 0.01 0.00 0.13 0.00 0.00 31.00 32.44 1j6y h PRO 90 CO 0.11 0.25 -0.28 0.35 -0.23 0.00 0.00 178.00 178.20 1j6y h PHE 91 N -0.91 -0.73 -0.20 1.56 3.04 -1.88 -1.94 116.94 115.88 1j6y h PHE 91 Ca -0.02 -0.02 0.02 0.00 3.98 0.00 0.00 57.97 61.93 1j6y h PHE 91 Cb 0.51 0.24 -0.03 0.00 2.56 0.00 0.00 35.95 39.23 1j6y h PHE 91 CO 0.09 -0.42 -0.17 0.93 -2.02 0.00 0.00 178.31 176.73 1j6y h GLU 92 N -0.89 -0.06 -1.24 1.11 5.08 -1.65 2.03 114.58 118.97 1j6y h GLU 92 Ca -0.08 0.00 0.36 0.00 -1.00 0.00 0.00 59.36 58.64 1j6y h GLU 92 Cb 0.64 0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.85 1j6y h GLU 92 CO 0.13 -0.04 0.97 1.49 -1.00 0.00 0.00 179.01 180.56 1j6y h GLU 93 N -0.06 0.00 0.12 2.33 4.57 -1.54 1.08 114.58 121.07 1j6y h GLU 93 Ca 0.03 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.21 1j6y h GLU 93 Cb 0.15 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.74 1j6y h GLU 93 CO -0.22 0.00 -0.06 0.00 -1.18 0.00 0.00 179.01 177.56 1j6y h ALA 94 N 1.24 -0.15 -0.27 2.92 0.00 0.38 0.10 119.26 123.48 1j6y h ALA 94 Ca 0.59 -0.24 -0.10 0.00 0.00 0.00 0.00 54.91 55.16 1j6y h ALA 94 Cb 2.51 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 20.35 1j6y h ALA 94 CO -0.01 -0.31 -0.25 1.79 0.00 0.00 0.00 179.25 180.48 1j6y h THR 95 N -0.71 1.27 0.00 0.00 1.35 0.48 -1.91 112.91 113.39 1j6y h THR 95 Ca -0.02 -1.27 -0.08 0.00 -0.55 0.00 0.00 66.41 64.50 1j6y h THR 95 Cb 0.53 1.33 -0.01 0.00 -1.73 0.00 0.00 68.15 68.27 1j6y h THR 95 CO 0.03 0.41 -0.36 1.88 -0.25 0.00 0.00 175.52 177.22 1j6y h TYR 96 N 0.45 0.00 0.15 4.73 0.05 0.91 -3.20 116.97 120.05 1j6y h TYR 96 Ca 0.07 0.00 -0.29 0.00 0.05 0.00 0.00 58.73 58.55 1j6y h TYR 96 Cb 0.67 0.00 0.02 0.00 1.01 0.00 0.00 36.73 38.43 1j6y h TYR 96 CO 0.02 0.36 -1.27 0.00 -1.05 0.00 0.00 178.16 176.22 1j6y h ALA 97 N 1.64 0.03 -2.50 3.88 0.00 -0.25 -3.46 119.26 118.60 1j6y h ALA 97 Ca -0.00 -0.83 -0.47 0.00 0.00 0.00 0.00 54.91 53.61 1j6y h ALA 97 Cb 1.02 0.08 0.11 0.00 0.00 0.00 0.00 17.79 19.00 1j6y h ALA 97 CO 0.05 0.81 0.39 -1.17 0.00 0.00 0.00 179.25 179.33 1j6y s LEU 98 N -7.52 2.56 -0.39 0.00 2.96 -0.77 -5.04 118.68 110.49 1j6y s LEU 98 Ca -0.07 0.67 0.04 0.00 -0.22 0.00 0.00 54.13 54.56 1j6y s LEU 98 Cb 0.06 -3.12 0.31 0.00 0.50 0.00 0.00 46.19 43.94 1j6y s LEU 98 CO 0.91 -1.99 1.24 2.29 -1.32 0.00 0.00 176.35 177.48 1j6y n LYS 99 N -3.33 0.52 -1.96 1.98 2.85 -1.26 -4.94 118.16 112.01 1j6y n LYS 99 Ca 0.09 -1.24 -0.15 0.00 -1.05 0.00 0.00 58.31 55.96 1j6y n LYS 99 Cb 0.61 -0.60 -0.03 0.00 -0.65 0.00 0.00 35.03 34.35 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 0.67 -0.38 0.00 0.58 0.31 -1.26 -4.72 118.33 113.52 1j6y n VAL 100 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.34 1j6y n VAL 100 Cb 0.72 -1.81 0.00 0.00 -0.91 0.00 0.00 33.84 31.84 1j6y n VAL 100 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1j6y n GLY 101 N -0.60 0.00 0.00 2.92 0.00 -1.26 -4.53 105.19 101.73 1j6y n GLY 101 Ca -0.17 0.00 0.00 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 -1.60 1.23 -2.31 1.61 8.00 -1.26 -5.08 116.55 117.14 1j6y n ASP 102 Ca 0.00 -0.81 -0.14 0.00 0.71 0.00 0.00 54.79 54.55 1j6y n ASP 102 Cb 0.29 0.00 0.04 0.00 -0.02 0.00 0.00 41.12 41.43 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 1.99 -3.05 0.53 5.41 -1.26 -4.80 119.36 118.18 1j6y n ILE 103 Ca 0.00 -3.65 -0.01 0.00 1.00 0.00 0.00 62.75 60.10 1j6y n ILE 103 Cb 0.00 -0.13 -0.00 0.00 -0.71 0.00 0.00 39.64 38.80 1j6y n ILE 103 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 1j6y n SER 104 N -0.66 -6.65 -0.04 4.38 3.41 -1.26 -4.56 113.62 108.24 1j6y n SER 104 Ca 0.28 0.83 -0.08 0.00 -0.26 0.00 0.00 58.87 59.64 1j6y n SER 104 Cb 0.90 -2.12 -0.06 0.00 -0.26 0.00 0.00 64.21 62.68 1j6y n SER 104 CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 1j6y h ASP 105 N 4.35 -1.01 -5.06 4.04 3.04 -1.96 -3.41 116.42 116.41 1j6y h ASP 105 Ca -0.05 0.13 -0.18 0.00 -3.24 0.00 0.00 57.03 53.69 1j6y h ASP 105 Cb 0.47 0.40 -0.15 0.00 -1.04 0.00 0.00 39.33 39.01 1j6y h ASP 105 CO 0.01 -0.25 -0.67 0.27 -2.04 0.00 0.00 179.24 176.55 1j6y s ILE 106 N -4.50 0.35 -0.33 4.15 -0.00 -1.26 -4.65 121.20 114.96 1j6y s ILE 106 Ca -0.08 -1.88 0.16 0.00 -0.00 0.00 0.00 60.65 58.85 1j6y s ILE 106 Cb 0.04 -1.75 0.46 0.00 -0.00 0.00 0.00 42.46 41.22 1j6y s ILE 106 CO 0.34 -0.79 1.01 0.52 -0.00 0.00 0.00 174.94 176.03 1j6y n VAL 107 N -0.01 1.33 -1.65 8.37 0.31 -0.61 -4.92 118.33 121.15 1j6y n VAL 107 Ca -0.11 -3.39 -0.37 0.00 -0.01 0.00 0.00 64.34 60.47 1j6y n VAL 107 Cb 0.62 0.38 -0.03 0.00 -0.91 0.00 0.00 33.84 33.90 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 -3.32 4.66 0.00 4.52 -4.77 -1.26 -1.61 116.67 114.89 1j6y s ASP 108 Ca 0.31 0.99 0.00 0.00 -3.30 0.00 0.00 52.55 50.56 1j6y s ASP 108 Cb 0.42 -2.51 0.00 0.00 -1.09 0.00 0.00 42.92 39.75 1j6y s ASP 108 CO -0.01 -2.73 0.00 0.35 0.70 0.00 0.00 175.17 173.48 1j6y n THR 109 N 7.83 0.00 -0.94 2.11 -2.24 0.70 -4.83 114.28 116.91 1j6y n THR 109 Ca 0.33 0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.76 1j6y n THR 109 Cb 0.54 0.00 0.07 0.00 -2.10 0.00 0.00 70.33 68.84 1j6y n THR 109 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1j6y n ASP 110 N 0.00 -4.46 0.00 3.42 5.75 -1.26 -1.72 116.55 118.28 1j6y n ASP 110 Ca 0.00 0.26 0.00 0.00 -0.01 0.00 0.00 54.79 55.04 1j6y n ASP 110 Cb 0.00 -0.93 0.00 0.00 -1.03 0.00 0.00 41.12 39.16 1j6y n ASP 110 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 1j6y n SER 111 N 1.66 0.00 0.00 -1.12 7.64 -1.26 -4.70 113.62 115.84 1j6y n SER 111 Ca 0.02 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.90 1j6y n SER 111 Cb 0.55 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.75 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 -0.63 3.66 0.23 0.00 -0.70 -4.67 105.19 103.08 1j6y n GLY 112 Ca 0.00 -0.40 -0.37 0.00 0.00 0.00 0.00 46.02 45.25 1j6y n GLY 112 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1j6y s VAL 113 N -4.00 5.27 0.35 1.61 -7.23 -1.26 -0.21 120.40 114.92 1j6y s VAL 113 Ca 0.00 0.46 0.03 0.00 -1.81 0.00 0.00 61.98 60.66 1j6y s VAL 113 Cb 0.00 -3.62 0.03 0.00 0.56 0.00 0.00 36.38 33.34 1j6y s VAL 113 CO 0.00 0.29 0.21 1.41 -0.31 0.00 0.00 175.10 176.70 1j6y n HIS 114 N 4.43 -0.62 -3.72 2.82 -0.00 -0.63 -1.32 115.22 116.17 1j6y n HIS 114 Ca -0.11 -1.51 -0.21 0.00 -0.00 0.00 0.00 57.72 55.89 1j6y n HIS 114 Cb 0.51 -0.27 -0.18 0.00 -0.00 0.00 0.00 29.99 30.05 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 -1.82 0.09 0.38 1.59 2.07 0.47 -1.57 121.20 122.43 1j6y s ILE 115 Ca 0.16 0.29 -0.04 0.00 -1.41 0.00 0.00 60.65 59.66 1j6y s ILE 115 Cb -0.01 -0.30 -0.04 0.00 0.13 0.00 0.00 42.46 42.23 1j6y s ILE 115 CO 0.10 0.21 0.65 -0.63 -1.91 0.00 0.00 174.94 173.36 1j6y s ILE 116 N 2.02 4.99 -0.25 2.00 -1.09 -1.26 0.13 121.20 127.74 1j6y s ILE 116 Ca 0.04 -0.01 -0.06 0.00 -2.23 0.00 0.00 60.65 58.39 1j6y s ILE 116 Cb -0.12 -3.82 0.12 0.00 -1.58 0.00 0.00 42.46 37.06 1j6y s ILE 116 CO -0.04 -0.59 0.50 -0.75 -1.23 0.00 0.00 174.94 172.83 1j6y s LYS 117 N -4.22 0.43 0.00 2.79 2.47 -1.15 -4.31 119.74 115.75 1j6y s LYS 117 Ca 0.45 1.06 0.00 0.00 -1.56 0.00 0.00 55.97 55.91 1j6y s LYS 117 Cb -0.10 0.37 0.00 0.00 -1.46 0.00 0.00 37.83 36.64 1j6y s LYS 117 CO 0.37 -0.36 0.00 -2.13 0.16 0.00 0.00 175.35 173.39 1j6y n ARG 118 N 5.41 3.53 -0.54 4.03 3.00 -1.26 -1.86 116.66 128.96 1j6y n ARG 118 Ca -0.07 0.00 -0.10 0.00 -0.00 0.00 0.00 57.85 57.67 1j6y n ARG 118 Cb 0.50 0.00 0.07 0.00 0.00 0.00 0.00 32.46 33.03 1j6y n ARG 118 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.63 180.04 1j6y n THR 119 N 0.00 1.99 1.47 5.15 -1.04 -1.26 -4.93 114.28 115.67 1j6y n THR 119 Ca 0.00 -0.87 0.14 0.00 -2.04 0.00 0.00 64.05 61.28 1j6y n THR 119 Cb 0.00 -0.85 0.50 0.00 -1.82 0.00 0.00 70.33 68.16 1j6y n THR 119 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43