#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2e7k n SER 2 N 0.00 2.25 -4.31 1.61 3.41 -1.26 -4.97 113.62 110.35 2e7k n SER 2 Ca 0.00 1.16 -0.36 0.00 -0.26 0.00 0.00 58.87 59.41 2e7k n SER 2 Cb 0.00 -1.43 -0.13 0.00 -0.26 0.00 0.00 64.21 62.39 2e7k n SER 2 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2e7k s SER 3 N -0.45 4.83 -0.13 4.04 1.04 -1.26 -4.88 113.70 116.88 2e7k s SER 3 Ca 0.58 -0.69 0.00 0.00 0.48 0.00 0.00 55.95 56.32 2e7k s SER 3 Cb -0.58 -1.81 -0.01 0.00 0.10 0.00 0.00 66.02 63.72 2e7k s SER 3 CO 0.60 -0.15 -0.14 -0.83 0.98 0.00 0.00 173.24 173.70 2e7k s GLY 4 N 1.46 1.51 0.22 7.32 0.00 -1.26 -5.01 107.32 111.55 2e7k s GLY 4 Ca 0.02 -0.93 -0.09 0.00 0.00 0.00 0.00 44.72 43.72 2e7k s GLY 4 CO 0.00 -0.14 1.85 1.48 0.00 0.00 0.00 173.10 176.29 2e7k h SER 5 N 6.86 0.76 -3.76 1.64 4.64 -2.04 -3.43 113.55 118.22 2e7k h SER 5 Ca -0.27 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.51 2e7k h SER 5 Cb 1.21 -0.16 -0.19 0.00 -0.31 0.00 0.00 62.40 62.95 2e7k h SER 5 CO 0.55 0.52 -0.80 -0.44 -0.87 0.00 0.00 176.83 175.79 2e7k s SER 6 N -5.76 2.68 0.24 4.97 0.01 -1.26 -5.08 113.70 109.51 2e7k s SER 6 Ca -0.13 -0.80 0.00 0.00 1.31 0.00 0.00 55.95 56.33 2e7k s SER 6 Cb 0.16 -0.16 0.00 0.00 0.21 0.00 0.00 66.02 66.23 2e7k s SER 6 CO 0.78 0.01 0.00 0.61 0.41 0.00 0.00 173.24 175.05 2e7k n GLY 7 N 0.58 -2.38 3.55 3.44 0.00 -1.26 -4.86 105.19 104.27 2e7k n GLY 7 Ca -0.15 -1.30 -0.35 0.00 0.00 0.00 0.00 46.02 44.21 2e7k n GLY 7 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2e7k s ARG 8 N -2.74 3.83 -0.25 1.61 1.70 -1.07 -4.82 118.95 117.21 2e7k s ARG 8 Ca 0.00 -0.41 -0.18 0.00 -0.47 0.00 0.00 55.73 54.67 2e7k s ARG 8 Cb 0.00 -3.21 -0.03 0.00 -0.57 0.00 0.00 34.95 31.14 2e7k s ARG 8 CO 0.00 0.11 0.51 -1.64 -1.08 0.00 0.00 175.30 173.21 2e7k s MET 9 N 0.79 4.09 -0.15 3.89 -1.94 -1.26 -2.41 119.30 122.29 2e7k s MET 9 Ca 0.03 0.33 0.00 0.00 -1.71 0.00 0.00 55.69 54.34 2e7k s MET 9 Cb -0.14 -3.64 -0.00 0.00 2.01 0.00 0.00 34.83 33.07 2e7k s MET 9 CO 0.02 -0.32 -0.16 0.08 -0.01 0.00 0.00 175.02 174.64 2e7k s VAL 10 N 2.19 2.63 -0.35 -6.03 1.01 -1.16 -4.95 120.40 113.74 2e7k s VAL 10 Ca 0.21 -0.78 -0.13 0.00 0.00 0.00 0.00 61.98 61.28 2e7k s VAL 10 Cb -0.16 -2.11 -0.01 0.00 0.00 0.00 0.00 36.38 34.11 2e7k s VAL 10 CO 0.09 0.52 0.25 -0.83 0.00 0.00 0.00 175.10 175.13 2e7k s GLY 11 N 0.83 1.97 -0.12 4.51 0.00 -1.26 -2.40 107.32 110.85 2e7k s GLY 11 Ca -0.05 -1.44 -0.06 0.00 0.00 0.00 0.00 44.72 43.16 2e7k s GLY 11 CO -0.00 0.80 0.12 -0.42 0.00 0.00 0.00 173.10 173.59 2e7k s ILE 12 N 1.71 5.30 -0.59 0.90 1.09 0.80 -4.90 121.20 125.51 2e7k s ILE 12 Ca 0.06 0.13 0.00 0.00 -1.10 0.00 0.00 60.65 59.74 2e7k s ILE 12 Cb -0.18 -3.31 0.50 0.00 -1.06 0.00 0.00 42.46 38.41 2e7k s ILE 12 CO 0.10 0.60 1.95 -1.14 -0.10 0.00 0.00 174.94 176.35 2e7k n ARG 13 N 2.19 2.63 -1.67 2.79 0.63 -1.26 -0.88 116.66 121.09 2e7k n ARG 13 Ca -0.19 -3.28 -0.32 0.00 -0.92 0.00 0.00 57.85 53.14 2e7k n ARG 13 Cb 0.54 -2.25 0.05 0.00 0.45 0.00 0.00 32.46 31.25 2e7k n ARG 13 CO 0.00 0.00 0.00 -1.59 -2.51 0.00 0.00 177.63 173.53 2e7k s LYS 14 N -3.69 2.93 0.12 -0.14 -2.85 -1.26 -4.85 119.74 110.00 2e7k s LYS 14 Ca 0.62 1.09 0.10 0.00 -1.00 0.00 0.00 55.97 56.78 2e7k s LYS 14 Cb 0.49 -1.98 -0.04 0.00 -2.06 0.00 0.00 37.83 34.24 2e7k s LYS 14 CO 0.02 -1.11 -0.23 -0.08 0.10 0.00 0.00 175.35 174.05 2e7k s THR 15 N -2.81 2.55 0.07 3.79 -1.32 -1.26 -1.85 115.64 114.80 2e7k s THR 15 Ca 0.61 -1.63 -0.29 0.00 -1.21 0.00 0.00 61.69 59.17 2e7k s THR 15 Cb -0.15 -2.15 -0.16 0.00 -1.51 0.00 0.00 72.50 68.53 2e7k s THR 15 CO 0.49 0.10 0.70 0.00 -2.21 0.00 0.00 174.62 173.70 2e7k n ALA 16 N 0.87 -2.91 0.00 11.08 0.00 -1.26 -1.50 120.51 126.79 2e7k n ALA 16 Ca -0.17 0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.72 2e7k n ALA 16 Cb 0.53 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.55 2e7k n ALA 16 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2e7k n GLY 17 N 1.44 2.13 2.85 0.00 0.00 0.82 -4.96 105.19 107.47 2e7k n GLY 17 Ca 0.16 -0.37 -0.35 0.00 0.00 0.00 0.00 46.02 45.46 2e7k n GLY 17 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2e7k n GLU 18 N 0.00 0.00 -1.11 1.61 -0.58 -0.56 -4.85 120.64 115.16 2e7k n GLU 18 Ca 0.00 0.00 -0.29 0.00 -0.42 0.00 0.00 57.16 56.45 2e7k n GLU 18 Cb 0.00 -1.23 0.18 0.00 -0.57 0.00 0.00 31.44 29.82 2e7k n GLU 18 CO 0.00 0.00 0.00 -1.01 -0.48 0.00 0.00 177.13 175.64 2e7k s HIS 19 N 7.14 2.06 -0.06 -0.32 3.76 -1.26 -4.74 115.29 121.86 2e7k s HIS 19 Ca 1.10 1.07 -0.10 0.00 -0.15 0.00 0.00 55.06 56.98 2e7k s HIS 19 Cb -1.05 -3.23 -0.04 0.00 1.11 0.00 0.00 32.58 29.37 2e7k s HIS 19 CO 0.42 -2.91 -0.19 1.28 -0.85 0.00 0.00 174.74 172.49 2e7k n LEU 20 N -4.20 1.51 0.00 0.89 4.32 -1.26 -4.53 117.00 113.73 2e7k n LEU 20 Ca 0.05 0.24 0.00 0.00 -0.02 0.00 0.00 56.01 56.28 2e7k n LEU 20 Cb 0.56 -0.55 0.00 0.00 -1.62 0.00 0.00 43.42 41.82 2e7k n LEU 20 CO 0.57 -0.41 0.00 0.61 -1.22 0.00 0.00 177.39 176.94 2e7k n GLY 21 N 2.36 0.76 3.55 -0.72 0.00 -1.26 -2.59 105.19 107.29 2e7k n GLY 21 Ca -0.10 -0.67 -0.16 0.00 0.00 0.00 0.00 46.02 45.09 2e7k n GLY 21 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2e7k s VAL 22 N -0.67 0.00 -0.17 1.61 -7.23 -1.26 -1.80 120.40 110.87 2e7k s VAL 22 Ca 0.00 0.00 0.00 0.00 -1.81 0.00 0.00 61.98 60.17 2e7k s VAL 22 Cb 0.00 -1.00 0.01 0.00 0.56 0.00 0.00 36.38 35.95 2e7k s VAL 22 CO 0.00 0.00 -0.16 0.42 -0.31 0.00 0.00 175.10 175.05 2e7k s THR 23 N -0.92 2.45 0.10 5.32 -4.23 0.59 -4.93 115.64 114.02 2e7k s THR 23 Ca -0.08 -0.82 0.02 0.00 -1.18 0.00 0.00 61.69 59.63 2e7k s THR 23 Cb -0.01 -2.04 -0.04 0.00 1.34 0.00 0.00 72.50 71.75 2e7k s THR 23 CO 0.07 0.51 0.19 -0.36 -0.54 0.00 0.00 174.62 174.50 2e7k s PHE 24 N 1.10 3.39 0.05 3.99 0.40 -1.26 0.91 117.98 126.56 2e7k s PHE 24 Ca 0.00 0.14 0.03 0.00 -0.60 0.00 0.00 56.93 56.50 2e7k s PHE 24 Cb -0.14 -1.67 -0.02 0.00 0.51 0.00 0.00 43.02 41.70 2e7k s PHE 24 CO -0.06 0.54 -0.10 -0.98 0.70 0.00 0.00 175.22 175.32 2e7k s ARG 25 N -2.77 0.67 -0.51 0.44 1.70 0.11 -4.68 118.95 113.90 2e7k s ARG 25 Ca 0.33 -0.78 -0.24 0.00 -0.47 0.00 0.00 55.73 54.58 2e7k s ARG 25 Cb -0.12 -0.56 0.04 0.00 -0.57 0.00 0.00 34.95 33.74 2e7k s ARG 25 CO 0.26 0.12 0.89 0.08 -1.08 0.00 0.00 175.30 175.57 2e7k s VAL 26 N -1.18 4.49 -0.48 4.99 1.01 -1.26 -1.05 120.40 126.93 2e7k s VAL 26 Ca -0.05 0.37 0.03 0.00 0.00 0.00 0.00 61.98 62.33 2e7k s VAL 26 Cb -0.09 -4.46 0.13 0.00 0.00 0.00 0.00 36.38 31.96 2e7k s VAL 26 CO 0.01 -0.96 0.23 -0.70 0.00 0.00 0.00 175.10 173.68 2e7k s GLU 27 N 3.70 1.74 0.00 2.72 -6.30 -0.10 -4.73 118.70 115.73 2e7k s GLU 27 Ca 0.31 -2.36 0.00 0.00 -2.50 0.00 0.00 54.97 50.41 2e7k s GLU 27 Cb -0.12 -3.05 0.00 0.00 0.00 0.00 0.00 34.13 30.95 2e7k s GLU 27 CO 0.21 -1.10 0.00 0.41 0.02 0.00 0.00 175.26 174.80 2e7k n GLY 28 N 3.38 0.96 3.26 -1.50 0.00 -1.26 -3.95 105.19 106.07 2e7k n GLY 28 Ca 0.05 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.58 2e7k n GLY 28 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2e7k n GLY 29 N -0.54 2.61 3.94 -0.02 0.00 -1.26 -4.98 105.19 104.95 2e7k n GLY 29 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 2e7k n GLY 29 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2e7k s GLU 30 N -0.01 3.44 0.28 1.61 1.03 -1.25 -4.76 118.70 119.03 2e7k s GLU 30 Ca 0.00 -0.33 -0.03 0.00 0.03 0.00 0.00 54.97 54.64 2e7k s GLU 30 Cb 0.00 -2.64 -0.05 0.00 -0.80 0.00 0.00 34.13 30.65 2e7k s GLU 30 CO 0.00 0.08 0.51 -0.51 -1.33 0.00 0.00 175.26 174.02 2e7k s LEU 31 N -4.36 4.09 -0.20 1.83 1.43 -1.26 -0.92 118.68 119.29 2e7k s LEU 31 Ca 0.41 0.60 -0.17 0.00 -1.03 0.00 0.00 54.13 53.94 2e7k s LEU 31 Cb -0.10 -3.41 0.05 0.00 0.03 0.00 0.00 46.19 42.76 2e7k s LEU 31 CO 0.37 -0.17 0.51 0.54 0.23 0.00 0.00 176.35 177.83 2e7k s VAL 32 N -2.06 -0.00 -0.53 -1.59 0.11 -0.21 -3.54 120.40 112.56 2e7k s VAL 32 Ca 0.42 0.01 -0.27 0.00 -2.93 0.00 0.00 61.98 59.21 2e7k s VAL 32 Cb -0.11 -0.72 -0.04 0.00 -1.53 0.00 0.00 36.38 33.98 2e7k s VAL 32 CO 0.31 0.00 2.03 -0.63 -3.33 0.00 0.00 175.10 173.48 2e7k s ILE 33 N 0.47 3.25 -0.03 7.04 1.01 -0.99 0.06 121.20 132.01 2e7k s ILE 33 Ca -0.02 0.17 -0.25 0.00 0.00 0.00 0.00 60.65 60.55 2e7k s ILE 33 Cb -0.04 -3.60 -0.19 0.00 0.01 0.00 0.00 42.46 38.64 2e7k s ILE 33 CO -0.02 -0.55 1.17 0.00 0.00 0.00 0.00 174.94 175.54 2e7k h ALA 34 N 16.18 -0.10 -2.53 9.38 0.00 0.23 -2.58 119.26 139.84 2e7k h ALA 34 Ca -0.27 -0.24 -0.12 0.00 0.00 0.00 0.00 54.91 54.29 2e7k h ALA 34 Cb 1.20 0.04 -0.14 0.00 0.00 0.00 0.00 17.79 18.89 2e7k h ALA 34 CO 1.17 -0.30 -0.43 0.50 0.00 0.00 0.00 179.25 180.19 2e7k s ARG 35 N -4.09 0.99 -0.24 0.00 3.52 -0.89 -4.80 118.95 113.44 2e7k s ARG 35 Ca -0.15 -1.18 -0.01 0.00 -0.13 0.00 0.00 55.73 54.26 2e7k s ARG 35 Cb 0.01 0.33 0.07 0.00 -1.56 0.00 0.00 34.95 33.80 2e7k s ARG 35 CO 0.62 -0.33 0.03 0.42 -0.81 0.00 0.00 175.30 175.24 2e7k s ILE 36 N -3.95 0.90 -0.02 4.11 1.01 -1.26 -0.30 121.20 121.69 2e7k s ILE 36 Ca 0.15 -1.01 -0.35 0.00 0.00 0.00 0.00 60.65 59.44 2e7k s ILE 36 Cb 0.05 -1.44 -0.13 0.00 0.01 0.00 0.00 42.46 40.95 2e7k s ILE 36 CO -0.03 -0.34 1.73 0.18 0.00 0.00 0.00 174.94 176.48 2e7k n LEU 37 N 4.88 3.07 -4.77 2.97 7.99 -0.75 -4.89 117.00 125.52 2e7k n LEU 37 Ca -0.07 1.03 -0.41 0.00 -0.01 0.00 0.00 56.01 56.55 2e7k n LEU 37 Cb 0.45 -1.35 -0.00 0.00 -0.11 0.00 0.00 43.42 42.41 2e7k n LEU 37 CO 0.14 -0.25 1.14 0.00 -1.51 0.00 0.00 177.39 176.91 2e7k n HIS 38 N 5.15 2.94 -1.31 -1.77 1.44 -1.26 -3.92 115.22 116.48 2e7k n HIS 38 Ca 0.21 0.42 0.00 0.00 -2.01 0.00 0.00 57.72 56.34 2e7k n HIS 38 Cb 0.27 -2.54 0.00 0.00 0.12 0.00 0.00 29.99 27.84 2e7k n HIS 38 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2e7k n GLY 39 N 0.71 0.84 3.62 -1.39 0.00 -1.26 -5.10 105.19 102.61 2e7k n GLY 39 Ca 0.02 -0.38 -0.09 0.00 0.00 0.00 0.00 46.02 45.58 2e7k n GLY 39 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2e7k s GLY 40 N -2.80 0.35 0.00 -0.02 0.00 -1.25 -4.97 107.32 98.63 2e7k s GLY 40 Ca 0.00 -0.71 0.00 0.00 0.00 0.00 0.00 44.72 44.01 2e7k s GLY 40 CO 0.00 -0.50 0.76 -0.13 0.00 0.00 0.00 173.10 173.23 2e7k n MET 41 N -0.38 0.00 -0.31 2.90 0.00 -1.07 -0.52 117.12 117.74 2e7k n MET 41 Ca -0.03 0.76 -0.08 0.00 -0.00 0.00 0.00 57.70 58.34 2e7k n MET 41 Cb 0.61 -1.23 -0.07 0.00 0.00 0.00 0.00 33.22 32.53 2e7k n MET 41 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 175.97 176.25 2e7k n VAL 42 N -2.13 -0.50 -0.26 1.12 0.31 -1.26 -0.40 118.33 115.21 2e7k n VAL 42 Ca 0.00 2.04 -0.04 0.00 -0.01 0.00 0.00 64.34 66.33 2e7k n VAL 42 Cb 0.00 -2.55 0.01 0.00 -0.91 0.00 0.00 33.84 30.39 2e7k n VAL 42 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2e7k h ALA 43 N 0.18 -0.02 0.51 3.52 0.00 -1.66 0.11 119.26 121.90 2e7k h ALA 43 Ca 0.12 0.19 -0.02 0.00 0.00 0.00 0.00 54.91 55.20 2e7k h ALA 43 Cb 0.30 0.88 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 2e7k h ALA 43 CO -0.68 -0.68 -0.50 1.96 0.00 0.00 0.00 179.25 179.35 2e7k h GLN 44 N -0.12 -0.96 -0.03 0.00 4.20 0.19 -3.21 115.11 115.18 2e7k h GLN 44 Ca 0.26 0.07 0.01 0.00 0.06 0.00 0.00 58.65 59.04 2e7k h GLN 44 Cb 0.56 0.22 -0.01 0.00 0.30 0.00 0.00 27.48 28.55 2e7k h GLN 44 CO -0.78 -0.64 -0.12 1.96 -0.67 0.00 0.00 178.83 178.58 2e7k h GLN 45 N -1.00 -0.12 -0.19 1.46 1.08 -0.12 -3.47 115.11 112.75 2e7k h GLN 45 Ca -0.06 0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.14 2e7k h GLN 45 Cb 0.86 0.03 0.00 0.00 -0.05 0.00 0.00 27.48 28.32 2e7k h GLN 45 CO -0.05 -0.08 0.00 0.41 -0.95 0.00 0.00 178.83 178.16 2e7k n GLY 46 N -1.09 1.18 0.07 3.46 0.00 0.32 -5.01 105.19 104.11 2e7k n GLY 46 Ca -0.01 -0.23 -0.10 0.00 0.00 0.00 0.00 46.02 45.68 2e7k n GLY 46 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2e7k n LEU 47 N -0.10 2.31 -5.01 0.99 4.77 -1.26 -5.03 117.00 113.67 2e7k n LEU 47 Ca 0.00 -0.06 -0.17 0.00 -0.03 0.00 0.00 56.01 55.74 2e7k n LEU 47 Cb 0.15 -0.35 0.01 0.00 -2.33 0.00 0.00 43.42 40.90 2e7k n LEU 47 CO 0.00 0.65 0.14 -0.76 -1.33 0.00 0.00 177.39 176.10 2e7k s LEU 48 N -5.67 3.67 -0.07 2.23 1.43 -1.26 -5.13 118.68 113.88 2e7k s LEU 48 Ca -0.17 -0.41 -0.31 0.00 -1.03 0.00 0.00 54.13 52.20 2e7k s LEU 48 Cb 0.05 -2.65 0.12 0.00 0.03 0.00 0.00 46.19 43.73 2e7k s LEU 48 CO 0.39 -0.74 1.09 -1.00 0.23 0.00 0.00 176.35 176.32 2e7k s HIS 49 N -2.34 -0.18 -0.41 0.29 3.76 -1.26 -4.94 115.29 110.21 2e7k s HIS 49 Ca 0.54 0.07 -0.36 0.00 -0.15 0.00 0.00 55.06 55.16 2e7k s HIS 49 Cb -0.10 0.54 -0.13 0.00 1.11 0.00 0.00 32.58 34.00 2e7k s HIS 49 CO 0.33 -0.39 2.22 0.28 -0.85 0.00 0.00 174.74 176.33 2e7k n VAL 50 N -0.24 0.14 0.00 -0.90 0.31 -1.26 -2.72 118.33 113.65 2e7k n VAL 50 Ca -0.04 -0.23 0.00 0.00 -0.01 0.00 0.00 64.34 64.06 2e7k n VAL 50 Cb 0.60 -1.45 0.00 0.00 -0.91 0.00 0.00 33.84 32.08 2e7k n VAL 50 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2e7k n GLY 51 N 6.68 1.64 3.17 2.92 0.00 -0.97 -5.01 105.19 113.62 2e7k n GLY 51 Ca 0.45 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.13 2e7k n GLY 51 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2e7k s ASP 52 N -1.64 3.44 -0.02 1.61 1.11 -1.10 -4.84 116.67 115.23 2e7k s ASP 52 Ca 0.00 -0.58 -0.18 0.00 0.18 0.00 0.00 52.55 51.96 2e7k s ASP 52 Cb 0.00 -1.55 -0.05 0.00 1.07 0.00 0.00 42.92 42.39 2e7k s ASP 52 CO 0.00 -0.01 0.51 -0.63 1.18 0.00 0.00 175.17 176.23 2e7k s ILE 53 N 1.34 4.98 -0.37 0.77 1.01 -0.82 -2.35 121.20 125.75 2e7k s ILE 53 Ca 0.05 1.06 -0.09 0.00 0.00 0.00 0.00 60.65 61.68 2e7k s ILE 53 Cb -0.13 -3.84 0.05 0.00 0.01 0.00 0.00 42.46 38.54 2e7k s ILE 53 CO -0.10 0.46 0.18 -0.63 0.00 0.00 0.00 174.94 174.85 2e7k s ILE 54 N -0.38 4.15 0.00 2.92 1.01 -1.23 0.64 121.20 128.30 2e7k s ILE 54 Ca 0.27 -1.13 0.00 0.00 0.00 0.00 0.00 60.65 59.79 2e7k s ILE 54 Cb -0.17 -3.40 0.00 0.00 0.01 0.00 0.00 42.46 38.90 2e7k s ILE 54 CO 0.15 -0.29 0.22 0.29 0.00 0.00 0.00 174.94 175.30 2e7k n LYS 55 N 4.90 0.00 -4.31 2.79 4.76 -0.18 -4.64 118.16 121.48 2e7k n LYS 55 Ca -0.11 0.47 -0.17 0.00 -2.87 0.00 0.00 58.31 55.63 2e7k n LYS 55 Cb 0.45 -1.09 -0.10 0.00 -1.84 0.00 0.00 35.03 32.45 2e7k n LYS 55 CO 0.00 0.00 0.00 -2.00 -1.37 0.00 0.00 177.40 174.03 2e7k s GLU 56 N -1.38 1.23 -0.21 1.97 2.56 -1.25 -4.22 118.70 117.39 2e7k s GLU 56 Ca 0.00 -1.52 -0.00 0.00 0.00 0.00 0.00 54.97 53.45 2e7k s GLU 56 Cb 0.00 -0.97 0.06 0.00 2.00 0.00 0.00 34.13 35.22 2e7k s GLU 56 CO 0.00 0.16 -0.03 0.54 -0.56 0.00 0.00 175.26 175.36 2e7k s VAL 57 N -2.98 1.22 -0.70 3.70 0.11 -0.40 -0.56 120.40 120.79 2e7k s VAL 57 Ca 0.20 -0.97 0.00 0.00 -2.93 0.00 0.00 61.98 58.27 2e7k s VAL 57 Cb -0.00 -1.53 0.00 0.00 -1.53 0.00 0.00 36.38 33.31 2e7k s VAL 57 CO 0.05 -0.09 0.00 -0.46 -3.33 0.00 0.00 175.10 171.26 2e7k n ASN 58 N 4.79 -2.86 -0.51 3.54 0.23 -0.53 -0.63 115.26 119.29 2e7k n ASN 58 Ca -0.11 0.30 0.00 0.00 -0.53 0.00 0.00 54.58 54.23 2e7k n ASN 58 Cb 0.45 -2.50 0.00 0.00 -2.08 0.00 0.00 39.78 35.65 2e7k n ASN 58 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2e7k n GLY 59 N -0.68 0.82 3.16 4.83 0.00 -1.26 -5.00 105.19 107.06 2e7k n GLY 59 Ca -0.10 -0.49 -0.13 0.00 0.00 0.00 0.00 46.02 45.31 2e7k n GLY 59 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2e7k s GLN 60 N -3.67 0.35 -0.17 1.61 -0.21 0.20 -5.13 119.66 112.65 2e7k s GLN 60 Ca 0.00 0.31 -0.29 0.00 0.02 0.00 0.00 55.36 55.39 2e7k s GLN 60 Cb 0.00 0.17 -0.03 0.00 1.00 0.00 0.00 33.01 34.15 2e7k s GLN 60 CO 0.00 -0.05 1.57 -1.25 -2.12 0.00 0.00 175.29 173.44 2e7k s PRO 61 N -0.03 3.96 0.46 2.91 0.04 -1.26 -1.27 135.00 139.82 2e7k s PRO 61 Ca -0.02 1.80 0.12 0.00 0.04 0.00 0.00 61.00 62.94 2e7k s PRO 61 Cb -0.02 -3.98 1.06 0.00 0.04 0.00 0.00 34.50 31.60 2e7k s PRO 61 CO 0.01 -1.09 2.09 -0.39 0.04 0.00 0.00 177.00 177.66 2e7k h VAL 62 N 5.90 1.03 -1.27 -0.36 -1.51 -1.89 -3.49 116.25 114.67 2e7k h VAL 62 Ca -0.34 -0.10 0.00 0.00 -1.23 0.00 0.00 66.70 65.03 2e7k h VAL 62 Cb 1.15 0.72 0.00 0.00 -2.13 0.00 0.00 31.29 31.03 2e7k h VAL 62 CO 0.98 0.05 0.00 0.61 -1.23 0.00 0.00 177.57 177.99 2e7k n GLY 63 N -1.51 -3.07 0.25 5.19 0.00 -1.26 -4.47 105.19 100.32 2e7k n GLY 63 Ca 0.01 -0.74 0.15 0.00 0.00 0.00 0.00 46.02 45.44 2e7k n GLY 63 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2e7k n SER 64 N 0.00 0.01 -4.49 1.61 3.41 -1.26 -4.18 113.62 108.72 2e7k n SER 64 Ca 0.00 1.25 -0.46 0.00 -0.26 0.00 0.00 58.87 59.39 2e7k n SER 64 Cb 0.00 -0.50 -0.06 0.00 -0.26 0.00 0.00 64.21 63.39 2e7k n SER 64 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2e7k n ASP 65 N -4.92 2.20 -0.02 4.04 9.92 -1.26 -4.76 116.55 121.75 2e7k n ASP 65 Ca 0.20 0.22 -0.13 0.00 -0.53 0.00 0.00 54.79 54.55 2e7k n ASP 65 Cb 0.68 -1.33 -0.09 0.00 -0.64 0.00 0.00 41.12 39.73 2e7k n ASP 65 CO 0.00 0.00 0.00 1.55 0.13 0.00 0.00 177.20 178.88 2e7k h PRO 66 N 13.91 0.07 -0.39 -0.24 0.13 -1.85 -2.11 132.00 141.51 2e7k h PRO 66 Ca -0.27 -0.04 0.06 0.00 -0.87 0.00 0.00 66.00 64.88 2e7k h PRO 66 Cb 1.30 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.41 2e7k h PRO 66 CO 1.06 0.54 0.26 0.00 -0.23 0.00 0.00 178.00 179.63 2e7k h ARG 67 N -0.39 0.26 0.00 0.86 3.08 -1.88 -0.56 114.38 115.74 2e7k h ARG 67 Ca 0.00 -0.02 -0.17 0.00 0.07 0.00 0.00 59.98 59.86 2e7k h ARG 67 Cb 0.52 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.49 2e7k h ARG 67 CO 0.01 0.17 -0.83 0.00 -1.07 0.00 0.00 179.97 178.25 2e7k h ALA 68 N 1.79 0.53 0.09 0.04 0.00 -1.92 -3.32 119.26 116.47 2e7k h ALA 68 Ca 0.17 -0.76 -0.00 0.00 0.00 0.00 0.00 54.91 54.32 2e7k h ALA 68 Cb 0.33 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2e7k h ALA 68 CO -0.03 1.04 -0.04 1.25 0.00 0.00 0.00 179.25 181.46 2e7k h LEU 69 N 0.00 -0.10 -2.01 0.00 5.85 -0.39 -2.18 115.31 116.47 2e7k h LEU 69 Ca -0.01 -0.14 0.08 0.00 0.84 0.00 0.00 57.88 58.65 2e7k h LEU 69 Cb 1.57 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 42.61 2e7k h LEU 69 CO 0.11 0.08 0.38 1.56 -0.34 0.00 0.00 178.44 180.23 2e7k h GLN 70 N -0.28 0.00 0.09 1.25 4.20 -1.58 0.22 115.11 119.00 2e7k h GLN 70 Ca -0.01 0.00 -0.28 0.00 0.06 0.00 0.00 58.65 58.42 2e7k h GLN 70 Cb 0.24 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.01 2e7k h GLN 70 CO 0.02 0.00 -1.35 1.49 -0.67 0.00 0.00 178.83 178.32 2e7k h GLU 71 N 0.00 0.19 -0.92 1.46 4.81 -1.53 -3.28 114.58 115.31 2e7k h GLU 71 Ca 0.13 -0.32 0.05 0.00 -0.13 0.00 0.00 59.36 59.09 2e7k h GLU 71 Cb 0.90 0.12 -0.06 0.00 0.63 0.00 0.00 28.75 30.33 2e7k h GLU 71 CO -0.00 1.07 0.59 1.37 -0.73 0.00 0.00 179.01 181.31 2e7k h LEU 72 N 0.05 0.95 -0.20 1.64 8.10 0.02 -2.51 115.31 123.36 2e7k h LEU 72 Ca -0.17 0.00 -0.02 0.00 0.11 0.00 0.00 57.88 57.81 2e7k h LEU 72 Cb 1.95 -0.20 -0.01 0.00 -0.44 0.00 0.00 40.66 41.96 2e7k h LEU 72 CO 0.16 0.63 0.06 -0.07 -4.11 0.00 0.00 178.44 175.11 2e7k h LEU 73 N 1.10 0.29 -0.97 0.17 3.38 -1.62 -2.10 115.31 115.56 2e7k h LEU 73 Ca 0.38 -0.20 0.19 0.00 0.09 0.00 0.00 57.88 58.34 2e7k h LEU 73 Cb 0.09 -0.08 -0.18 0.00 0.09 0.00 0.00 40.66 40.58 2e7k h LEU 73 CO -0.15 0.42 -0.25 -0.09 0.09 0.00 0.00 178.44 178.46 2e7k h ARG 74 N 0.15 -0.00 -0.21 1.13 2.43 -1.51 0.29 114.38 116.66 2e7k h ARG 74 Ca 0.06 0.00 -0.15 0.00 -0.81 0.00 0.00 59.98 59.08 2e7k h ARG 74 Cb 0.23 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.78 2e7k h ARG 74 CO -0.00 -0.00 -0.46 -0.91 -1.51 0.00 0.00 179.97 177.08 2e7k h ASN 75 N -0.00 0.78 -0.92 -3.80 -0.26 -1.50 0.23 115.58 110.10 2e7k h ASN 75 Ca 0.46 -0.56 -0.64 0.00 -0.56 0.00 0.00 56.30 55.00 2e7k h ASN 75 Cb 0.70 -0.22 -0.02 0.00 -1.06 0.00 0.00 38.32 37.71 2e7k h ASN 75 CO -0.99 1.19 1.47 0.00 -1.06 0.00 0.00 177.43 178.04 2e7k n ALA 76 N -2.54 0.89 -2.60 -0.83 0.00 0.10 -4.50 120.51 111.04 2e7k n ALA 76 Ca -0.06 -0.15 -0.30 0.00 0.00 0.00 0.00 53.44 52.93 2e7k n ALA 76 Cb 0.58 -2.54 -0.10 0.00 0.00 0.00 0.00 19.45 17.39 2e7k n ALA 76 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2e7k s SER 77 N 7.89 4.52 0.00 0.00 0.15 -1.26 -4.27 113.70 120.72 2e7k s SER 77 Ca 1.12 -0.34 0.00 0.00 0.70 0.00 0.00 55.95 57.44 2e7k s SER 77 Cb -0.89 -0.91 0.00 0.00 -1.71 0.00 0.00 66.02 62.51 2e7k s SER 77 CO 0.48 0.18 0.00 0.61 1.20 0.00 0.00 173.24 175.71 2e7k n GLY 78 N 0.73 -1.82 3.57 9.45 0.00 -0.77 -4.79 105.19 111.56 2e7k n GLY 78 Ca -0.13 -1.66 -0.39 0.00 0.00 0.00 0.00 46.02 43.84 2e7k n GLY 78 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2e7k s SER 79 N -4.00 5.06 -0.10 1.61 1.04 -1.26 -4.06 113.70 111.99 2e7k s SER 79 Ca 0.00 1.23 -0.03 0.00 0.48 0.00 0.00 55.95 57.63 2e7k s SER 79 Cb 0.00 -2.51 -0.03 0.00 0.10 0.00 0.00 66.02 63.57 2e7k s SER 79 CO 0.00 -2.37 0.02 -0.69 0.98 0.00 0.00 173.24 171.18 2e7k s VAL 80 N 9.85 4.48 0.07 5.02 1.01 -0.06 -4.91 120.40 135.86 2e7k s VAL 80 Ca 0.91 -0.18 0.06 0.00 0.00 0.00 0.00 61.98 62.77 2e7k s VAL 80 Cb -0.22 -2.91 -0.04 0.00 0.00 0.00 0.00 36.38 33.22 2e7k s VAL 80 CO 0.29 0.59 -0.10 -0.63 0.00 0.00 0.00 175.10 175.24 2e7k s ILE 81 N -0.73 3.35 -0.07 2.22 1.09 -1.26 -0.14 121.20 125.66 2e7k s ILE 81 Ca 0.12 -1.13 -0.02 0.00 -1.10 0.00 0.00 60.65 58.52 2e7k s ILE 81 Cb -0.12 -2.52 0.03 0.00 -1.06 0.00 0.00 42.46 38.80 2e7k s ILE 81 CO 0.02 0.22 0.02 -0.76 -0.10 0.00 0.00 174.94 174.34 2e7k s LEU 82 N -1.89 0.45 -0.61 2.97 1.43 -1.01 -1.45 118.68 118.57 2e7k s LEU 82 Ca 0.19 -0.06 -0.23 0.00 -1.03 0.00 0.00 54.13 53.01 2e7k s LEU 82 Cb -0.11 -0.34 0.06 0.00 0.03 0.00 0.00 46.19 45.83 2e7k s LEU 82 CO 0.11 -0.22 0.92 -0.75 0.23 0.00 0.00 176.35 176.64 2e7k s LYS 83 N 2.04 3.19 0.38 1.70 2.20 0.27 -2.98 119.74 126.54 2e7k s LYS 83 Ca 0.05 -0.64 -0.09 0.00 -0.36 0.00 0.00 55.97 54.92 2e7k s LYS 83 Cb -0.12 -4.15 -0.06 0.00 -1.51 0.00 0.00 37.83 31.98 2e7k s LYS 83 CO -0.05 -1.64 0.72 0.42 -0.36 0.00 0.00 175.35 174.44 2e7k s ILE 84 N 3.87 4.85 0.09 5.43 -1.09 -1.01 -1.01 121.20 132.33 2e7k s ILE 84 Ca 0.24 0.47 -0.11 0.00 -2.23 0.00 0.00 60.65 59.02 2e7k s ILE 84 Cb -0.16 -3.74 0.01 0.00 -1.58 0.00 0.00 42.46 36.99 2e7k s ILE 84 CO 0.13 -0.49 0.24 -0.76 -1.23 0.00 0.00 174.94 172.84 2e7k s LEU 85 N -3.82 1.17 0.27 2.97 1.02 0.21 -2.59 118.68 117.91 2e7k s LEU 85 Ca 0.49 -0.55 -0.02 0.00 0.02 0.00 0.00 54.13 54.08 2e7k s LEU 85 Cb -0.10 1.23 -0.04 0.00 0.02 0.00 0.00 46.19 47.29 2e7k s LEU 85 CO 0.32 -0.75 0.48 -0.44 0.02 0.00 0.00 176.35 175.98 2e7k s SER 86 N -2.79 6.38 0.62 2.29 0.01 -1.26 -1.95 113.70 117.00 2e7k s SER 86 Ca 0.04 0.51 0.00 0.00 1.31 0.00 0.00 55.95 57.81 2e7k s SER 86 Cb 0.04 -2.06 0.00 0.00 0.21 0.00 0.00 66.02 64.21 2e7k s SER 86 CO -0.11 -0.16 0.00 0.61 0.41 0.00 0.00 173.24 173.99 2e7k n GLY 87 N -1.06 -0.10 3.77 3.44 0.00 -1.26 -4.96 105.19 105.02 2e7k n GLY 87 Ca -0.04 -1.82 -0.32 0.00 0.00 0.00 0.00 46.02 43.84 2e7k n GLY 87 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2e7k s PRO 88 N -2.38 2.61 -1.36 1.61 0.04 -1.26 -3.73 135.00 130.53 2e7k s PRO 88 Ca 0.00 1.31 -0.08 0.00 0.04 0.00 0.00 61.00 62.27 2e7k s PRO 88 Cb 0.00 -1.93 0.02 0.00 0.04 0.00 0.00 34.50 32.63 2e7k s PRO 88 CO 0.00 -1.39 1.12 0.45 0.04 0.00 0.00 177.00 177.22 2e7k n SER 89 N -2.81 -5.44 -3.68 6.66 2.88 -1.26 -4.99 113.62 104.98 2e7k n SER 89 Ca 0.10 -0.59 -0.10 0.00 -1.33 0.00 0.00 58.87 56.95 2e7k n SER 89 Cb 0.52 -4.87 -0.11 0.00 -0.75 0.00 0.00 64.21 59.01 2e7k n SER 89 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2e7k s SER 90 N -3.49 -0.43 0.00 -3.46 0.15 -1.24 -5.26 113.70 99.97 2e7k s SER 90 Ca 0.50 0.91 0.32 0.00 0.70 0.00 0.00 55.95 58.38 2e7k s SER 90 Cb -0.23 0.92 1.86 0.00 -1.71 0.00 0.00 66.02 66.87 2e7k s SER 90 CO 0.75 -0.20 2.20 0.61 1.20 0.00 0.00 173.24 177.79