#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 0.75 -4.54 1.61 2.88 -1.26 -4.97 113.62 108.09 2e7k n SER 2 Ca 0.00 0.00 -0.41 0.00 -1.33 0.00 0.00 58.87 57.13 2e7k n SER 2 Cb 0.00 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.43 2e7k n SER 2 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2e7k s SER 3 N -4.57 6.35 0.00 -3.46 0.01 -1.26 -4.84 113.70 105.93 2e7k s SER 3 Ca 0.00 -1.04 0.00 0.00 1.31 0.00 0.00 55.95 56.22 2e7k s SER 3 Cb 0.00 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.68 2e7k s SER 3 CO 0.00 -1.62 0.00 0.61 0.41 0.00 0.00 173.24 172.64 2e7k n GLY 4 N 6.11 4.36 3.58 3.44 0.00 -1.26 -5.06 105.19 116.36 2e7k n GLY 4 Ca 0.18 -1.08 -0.42 0.00 0.00 0.00 0.00 46.02 44.71 2e7k n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2e7k s SER 5 N 0.00 6.04 -0.04 1.61 1.04 -1.26 -4.88 113.70 116.21 2e7k s SER 5 Ca 0.00 0.46 -0.21 0.00 0.48 0.00 0.00 55.95 56.69 2e7k s SER 5 Cb 0.00 -2.54 -0.15 0.00 0.10 0.00 0.00 66.02 63.43 2e7k s SER 5 CO 0.00 -1.74 0.88 0.28 0.98 0.00 0.00 173.24 173.63 2e7k h SER 6 N 11.59 -0.25 0.00 7.02 0.02 -1.97 -3.47 113.55 126.50 2e7k h SER 6 Ca -0.27 -0.27 0.00 0.00 -0.84 0.00 0.00 61.79 60.41 2e7k h SER 6 Cb 1.11 0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.71 2e7k h SER 6 CO 1.16 0.26 0.00 0.61 -1.14 0.00 0.00 176.83 177.72 2e7k n GLY 7 N 0.46 2.49 2.83 -3.77 0.00 -1.26 -4.95 105.19 100.98 2e7k n GLY 7 Ca -0.08 -1.21 -0.14 0.00 0.00 0.00 0.00 46.02 44.59 2e7k n GLY 7 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2e7k s ARG 8 N 4.72 0.27 -0.54 1.61 3.52 -0.31 -4.87 118.95 123.34 2e7k s ARG 8 Ca 0.00 0.35 -0.27 0.00 -0.13 0.00 0.00 55.73 55.68 2e7k s ARG 8 Cb 0.00 -0.86 0.03 0.00 -1.56 0.00 0.00 34.95 32.56 2e7k s ARG 8 CO 0.00 -0.66 1.06 -1.64 -0.81 0.00 0.00 175.30 173.25 2e7k s MET 9 N 2.43 3.48 -0.23 5.12 -1.94 -1.26 -1.98 119.30 124.93 2e7k s MET 9 Ca 0.10 0.11 -0.10 0.00 -1.71 0.00 0.00 55.69 54.08 2e7k s MET 9 Cb -0.16 -4.00 -0.05 0.00 2.01 0.00 0.00 34.83 32.64 2e7k s MET 9 CO -0.14 -1.51 0.14 0.08 -0.01 0.00 0.00 175.02 173.58 2e7k s VAL 10 N 4.38 5.30 0.31 -6.03 1.01 -0.96 -4.86 120.40 119.55 2e7k s VAL 10 Ca 0.39 0.16 -0.22 0.00 0.00 0.00 0.00 61.98 62.30 2e7k s VAL 10 Cb -0.09 -3.45 -0.09 0.00 0.00 0.00 0.00 36.38 32.74 2e7k s VAL 10 CO 0.24 0.37 0.86 -0.83 0.00 0.00 0.00 175.10 175.74 2e7k s GLY 11 N 0.87 2.62 -0.06 4.51 0.00 -1.25 -2.54 107.32 111.46 2e7k s GLY 11 Ca 0.07 0.34 0.00 0.00 0.00 0.00 0.00 44.72 45.13 2e7k s GLY 11 CO 0.03 0.70 -0.04 -0.42 0.00 0.00 0.00 173.10 173.36 2e7k s ILE 12 N -1.73 0.59 -0.58 0.90 -1.09 -0.79 -4.92 121.20 113.57 2e7k s ILE 12 Ca 0.51 -0.10 0.00 0.00 -2.23 0.00 0.00 60.65 58.83 2e7k s ILE 12 Cb -0.15 -0.64 0.46 0.00 -1.58 0.00 0.00 42.46 40.54 2e7k s ILE 12 CO 0.20 0.26 1.85 -2.11 -1.23 0.00 0.00 174.94 173.91 2e7k n ARG 13 N 4.43 2.88 -1.56 2.79 1.85 -1.26 -2.45 116.66 123.34 2e7k n ARG 13 Ca -0.18 -3.48 -0.30 0.00 -1.00 0.00 0.00 57.85 52.89 2e7k n ARG 13 Cb 0.51 -2.28 0.20 0.00 -1.05 0.00 0.00 32.46 29.83 2e7k n ARG 13 CO 0.00 0.00 0.00 -1.59 -0.01 0.00 0.00 177.63 176.03 2e7k s LYS 14 N -3.77 0.06 0.09 2.89 -2.85 -1.26 -5.00 119.74 109.89 2e7k s LYS 14 Ca 0.62 -0.17 0.07 0.00 -1.00 0.00 0.00 55.97 55.48 2e7k s LYS 14 Cb 0.49 -1.76 -0.04 0.00 -2.06 0.00 0.00 37.83 34.46 2e7k s LYS 14 CO 0.00 -2.84 -0.11 0.99 0.10 0.00 0.00 175.35 173.49 2e7k s THR 15 N -3.47 3.28 -0.46 3.79 2.01 -1.26 -4.18 115.64 115.35 2e7k s THR 15 Ca 0.71 -1.23 -0.27 0.00 0.31 0.00 0.00 61.69 61.21 2e7k s THR 15 Cb -0.08 -2.51 -0.08 0.00 0.01 0.00 0.00 72.50 69.85 2e7k s THR 15 CO 0.54 0.16 2.39 0.00 -0.69 0.00 0.00 174.62 177.02 2e7k n ALA 16 N 0.89 0.98 0.00 7.40 0.00 -1.26 -2.73 120.51 125.79 2e7k n ALA 16 Ca -0.14 -0.72 0.00 0.00 0.00 0.00 0.00 53.44 52.58 2e7k n ALA 16 Cb 0.52 -3.07 0.00 0.00 0.00 0.00 0.00 19.45 16.91 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 6.02 2.92 3.51 0.00 0.00 -1.11 -5.06 105.19 111.46 2e7k n GLY 17 Ca 0.38 -0.49 -0.40 0.00 0.00 0.00 0.00 46.02 45.50 2e7k n GLY 17 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2e7k n GLU 18 N 0.00 0.78 -2.68 1.61 0.28 -1.10 -4.89 120.64 114.64 2e7k n GLU 18 Ca 0.00 0.29 -0.21 0.00 -0.16 0.00 0.00 57.16 57.07 2e7k n GLU 18 Cb 0.00 -1.76 0.10 0.00 1.43 0.00 0.00 31.44 31.21 2e7k n GLU 18 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 2e7k n HIS 19 N -1.09 -2.72 -0.03 -1.84 8.25 -1.26 -4.65 115.22 111.87 2e7k n HIS 19 Ca 0.11 -1.86 -0.16 0.00 -0.26 0.00 0.00 57.72 55.56 2e7k n HIS 19 Cb 0.42 -0.66 -0.14 0.00 1.12 0.00 0.00 29.99 30.74 2e7k n HIS 19 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2e7k n LEU 20 N 0.00 1.91 -0.38 2.41 7.99 -1.26 -4.46 117.00 123.20 2e7k n LEU 20 Ca 0.16 0.20 0.00 0.00 -0.01 0.00 0.00 56.01 56.36 2e7k n LEU 20 Cb 0.58 -0.55 0.00 0.00 -0.11 0.00 0.00 43.42 43.35 2e7k n LEU 20 CO 0.39 0.70 0.00 0.61 -1.51 0.00 0.00 177.39 177.57 2e7k n GLY 21 N 1.88 0.89 3.16 -0.72 0.00 -1.26 -1.13 105.19 108.01 2e7k n GLY 21 Ca -0.30 -0.66 -0.13 0.00 0.00 0.00 0.00 46.02 44.94 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 -2.77 0.81 -0.17 1.61 -7.23 -1.26 -0.84 120.40 110.54 2e7k s VAL 22 Ca 0.00 -1.63 0.01 0.00 -1.81 0.00 0.00 61.98 58.55 2e7k s VAL 22 Cb 0.00 -1.32 0.01 0.00 0.56 0.00 0.00 36.38 35.63 2e7k s VAL 22 CO 0.00 -0.62 -0.19 0.42 -0.31 0.00 0.00 175.10 174.41 2e7k s THR 23 N -2.59 2.22 -0.01 5.32 -4.23 -0.30 -4.97 115.64 111.08 2e7k s THR 23 Ca 0.05 -0.90 -0.05 0.00 -1.18 0.00 0.00 61.69 59.61 2e7k s THR 23 Cb -0.02 -1.93 -0.04 0.00 1.34 0.00 0.00 72.50 71.85 2e7k s THR 23 CO -0.01 0.53 0.23 -0.36 -0.54 0.00 0.00 174.62 174.47 2e7k s PHE 24 N 1.18 3.57 0.10 3.99 0.40 -1.26 0.10 117.98 126.06 2e7k s PHE 24 Ca 0.02 0.48 0.10 0.00 -0.60 0.00 0.00 56.93 56.93 2e7k s PHE 24 Cb -0.14 -1.92 -0.04 0.00 0.51 0.00 0.00 43.02 41.43 2e7k s PHE 24 CO -0.09 0.63 -0.26 -0.98 0.70 0.00 0.00 175.22 175.22 2e7k s ARG 25 N -1.80 1.44 -0.45 0.44 1.70 0.11 -4.72 118.95 115.67 2e7k s ARG 25 Ca 0.27 -1.25 -0.23 0.00 -0.47 0.00 0.00 55.73 54.05 2e7k s ARG 25 Cb -0.13 -1.82 0.03 0.00 -0.57 0.00 0.00 34.95 32.46 2e7k s ARG 25 CO 0.16 0.44 0.79 0.08 -1.08 0.00 0.00 175.30 175.70 2e7k s VAL 26 N -1.01 4.64 -0.07 4.99 1.01 -1.26 -2.38 120.40 126.33 2e7k s VAL 26 Ca 0.12 0.46 -0.03 0.00 0.00 0.00 0.00 61.98 62.53 2e7k s VAL 26 Cb -0.10 -4.33 0.04 0.00 0.00 0.00 0.00 36.38 32.00 2e7k s VAL 26 CO 0.05 -0.72 0.12 -1.83 0.00 0.00 0.00 175.10 172.72 2e7k s GLU 27 N 3.31 -0.00 -1.16 2.72 -1.05 -0.53 -4.90 118.70 117.09 2e7k s GLU 27 Ca 0.30 0.47 -0.02 0.00 -0.15 0.00 0.00 54.97 55.58 2e7k s GLU 27 Cb -0.12 -0.34 -0.02 0.00 -0.44 0.00 0.00 34.13 33.21 2e7k s GLU 27 CO 0.23 -0.30 0.97 0.41 0.95 0.00 0.00 175.26 177.52 2e7k n GLY 28 N 5.17 -0.59 1.79 -3.83 0.00 -1.26 -1.80 105.19 104.66 2e7k n GLY 28 Ca -0.07 0.24 -0.08 0.00 0.00 0.00 0.00 46.02 46.11 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 -1.17 0.72 3.22 -0.02 0.00 -1.26 -4.88 105.19 101.81 2e7k n GLY 29 Ca -0.23 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.61 2e7k n GLY 29 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2e7k s GLU 30 N -2.48 0.96 -0.23 1.61 2.02 -0.75 -4.88 118.70 114.96 2e7k s GLU 30 Ca 0.00 -1.14 -0.10 0.00 0.02 0.00 0.00 54.97 53.75 2e7k s GLU 30 Cb 0.00 -0.91 -0.05 0.00 0.10 0.00 0.00 34.13 33.28 2e7k s GLU 30 CO 0.00 0.18 0.14 -0.51 0.02 0.00 0.00 175.26 175.10 2e7k s LEU 31 N -2.19 4.10 -0.01 1.80 1.43 -1.26 -1.46 118.68 121.10 2e7k s LEU 31 Ca 0.05 0.13 0.04 0.00 -1.03 0.00 0.00 54.13 53.32 2e7k s LEU 31 Cb -0.07 -2.09 -0.01 0.00 0.03 0.00 0.00 46.19 44.05 2e7k s LEU 31 CO 0.03 0.10 -0.11 -0.69 0.23 0.00 0.00 176.35 175.90 2e7k s VAL 32 N 0.87 0.91 -0.53 -1.59 1.01 -1.00 -2.94 120.40 117.12 2e7k s VAL 32 Ca 0.07 -0.52 -0.26 0.00 0.00 0.00 0.00 61.98 61.27 2e7k s VAL 32 Cb -0.13 -0.76 -0.05 0.00 0.00 0.00 0.00 36.38 35.44 2e7k s VAL 32 CO 0.03 0.24 2.18 -0.63 0.00 0.00 0.00 175.10 176.92 2e7k s ILE 33 N -0.30 3.15 0.05 2.22 1.01 -1.15 -0.71 121.20 125.47 2e7k s ILE 33 Ca 0.04 0.09 -0.24 0.00 0.00 0.00 0.00 60.65 60.54 2e7k s ILE 33 Cb -0.05 -3.39 -0.17 0.00 0.01 0.00 0.00 42.46 38.87 2e7k s ILE 33 CO -0.00 -0.37 1.56 0.00 0.00 0.00 0.00 174.94 176.13 2e7k h ALA 34 N 17.62 -0.03 -2.53 9.38 0.00 0.35 -2.90 119.26 141.15 2e7k h ALA 34 Ca -0.25 -0.09 -0.10 0.00 0.00 0.00 0.00 54.91 54.46 2e7k h ALA 34 Cb 1.22 0.01 -0.14 0.00 0.00 0.00 0.00 17.79 18.89 2e7k h ALA 34 CO 1.18 -0.43 -0.40 0.50 0.00 0.00 0.00 179.25 180.10 2e7k s ARG 35 N -5.49 0.96 -0.29 0.00 3.52 -0.98 -4.87 118.95 111.79 2e7k s ARG 35 Ca -0.14 -1.10 -0.00 0.00 -0.13 0.00 0.00 55.73 54.35 2e7k s ARG 35 Cb 0.04 0.34 0.09 0.00 -1.56 0.00 0.00 34.95 33.86 2e7k s ARG 35 CO 0.66 -0.32 0.07 0.42 -0.81 0.00 0.00 175.30 175.33 2e7k s ILE 36 N -3.92 1.04 -0.48 4.11 1.01 -1.26 -1.15 121.20 120.54 2e7k s ILE 36 Ca 0.11 -1.39 -0.32 0.00 0.00 0.00 0.00 60.65 59.05 2e7k s ILE 36 Cb 0.05 -1.71 -0.12 0.00 0.01 0.00 0.00 42.46 40.68 2e7k s ILE 36 CO -0.06 -0.56 2.32 0.18 0.00 0.00 0.00 174.94 176.82 2e7k n LEU 37 N 4.79 1.90 -0.26 2.97 4.32 -0.02 -4.76 117.00 125.95 2e7k n LEU 37 Ca -0.03 0.17 0.24 0.00 -0.02 0.00 0.00 56.01 56.37 2e7k n LEU 37 Cb 0.43 -1.29 0.45 0.00 -1.62 0.00 0.00 43.42 41.39 2e7k n LEU 37 CO 0.13 -0.91 0.82 1.57 -1.22 0.00 0.00 177.39 177.78 2e7k n HIS 38 N 11.33 0.89 -2.57 -1.77 -0.00 -1.26 -1.95 115.22 119.89 2e7k n HIS 38 Ca 0.44 0.94 -0.43 0.00 -0.00 0.00 0.00 57.72 58.67 2e7k n HIS 38 Cb 0.27 -1.33 0.00 0.00 -0.00 0.00 0.00 29.99 28.93 2e7k n HIS 38 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2e7k n GLY 39 N -1.22 4.22 0.52 1.57 0.00 -1.26 -4.64 105.19 104.37 2e7k n GLY 39 Ca 0.29 -2.06 -0.01 0.00 0.00 0.00 0.00 46.02 44.24 2e7k n GLY 39 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2e7k n GLY 40 N 3.32 1.74 0.00 -0.02 0.00 -0.82 -4.90 105.19 104.50 2e7k n GLY 40 Ca 0.39 -1.03 0.00 0.00 0.00 0.00 0.00 46.02 45.38 2e7k n GLY 40 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2e7k n MET 41 N -0.08 0.00 -0.51 1.61 0.00 -0.28 -3.34 117.12 114.52 2e7k n MET 41 Ca -0.01 0.48 0.42 0.00 -0.00 0.00 0.00 57.70 58.59 2e7k n MET 41 Cb 0.08 -1.28 0.70 0.00 0.00 0.00 0.00 33.22 32.72 2e7k n MET 41 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 175.97 176.25 2e7k h VAL 42 N 0.00 0.06 -0.13 1.12 2.07 -1.84 0.41 116.25 117.95 2e7k h VAL 42 Ca 0.00 -0.01 0.04 0.00 0.82 0.00 0.00 66.70 67.55 2e7k h VAL 42 Cb 0.00 0.02 -0.05 0.00 -1.52 0.00 0.00 31.29 29.75 2e7k h VAL 42 CO 0.00 0.01 -0.17 0.00 0.02 0.00 0.00 177.57 177.42 2e7k h ALA 43 N 1.46 -0.11 -0.00 1.67 0.00 -1.81 -0.72 119.26 119.76 2e7k h ALA 43 Ca 0.86 0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.82 2e7k h ALA 43 Cb 2.94 0.34 0.00 0.00 0.00 0.00 0.00 17.79 21.07 2e7k h ALA 43 CO -0.33 -0.63 -0.06 1.04 0.00 0.00 0.00 179.25 179.27 2e7k n GLN 44 N -5.32 0.35 -3.67 0.00 1.13 0.13 -4.70 117.38 105.31 2e7k n GLN 44 Ca -0.03 -0.05 -0.38 0.00 -1.94 0.00 0.00 57.00 54.60 2e7k n GLN 44 Cb 0.23 -1.50 -0.12 0.00 0.11 0.00 0.00 30.24 28.97 2e7k n GLN 44 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 2e7k s GLN 45 N -2.69 3.42 -0.11 -1.09 -1.52 -0.28 -4.97 119.66 112.43 2e7k s GLN 45 Ca 0.24 -0.66 0.00 0.00 -1.95 0.00 0.00 55.36 52.99 2e7k s GLN 45 Cb 0.20 -3.53 0.10 0.00 -0.22 0.00 0.00 33.01 29.56 2e7k s GLN 45 CO 0.50 -0.37 1.60 0.41 -0.25 0.00 0.00 175.29 177.18 2e7k n GLY 46 N 4.97 2.81 0.10 3.09 0.00 -1.26 -4.06 105.19 110.85 2e7k n GLY 46 Ca -0.14 -0.32 -0.15 0.00 0.00 0.00 0.00 46.02 45.40 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 0.63 1.93 -4.96 0.99 4.77 -1.26 -5.01 117.00 114.09 2e7k n LEU 47 Ca 0.12 0.37 -0.23 0.00 -0.03 0.00 0.00 56.01 56.24 2e7k n LEU 47 Cb 0.62 -0.79 -0.02 0.00 -2.33 0.00 0.00 43.42 40.91 2e7k n LEU 47 CO 0.13 -0.01 0.03 -0.76 -1.33 0.00 0.00 177.39 175.45 2e7k s LEU 48 N -7.82 4.22 0.39 2.23 1.43 -1.26 -5.11 118.68 112.76 2e7k s LEU 48 Ca -0.31 0.23 -0.12 0.00 -1.03 0.00 0.00 54.13 52.90 2e7k s LEU 48 Cb 0.07 -3.03 0.05 0.00 0.03 0.00 0.00 46.19 43.31 2e7k s LEU 48 CO 0.44 -0.13 0.74 -1.38 0.23 0.00 0.00 176.35 176.24 2e7k s HIS 49 N -2.06 0.36 -0.18 0.29 -3.43 -1.26 -4.94 115.29 104.06 2e7k s HIS 49 Ca 0.36 -0.96 -0.29 0.00 -0.80 0.00 0.00 55.06 53.37 2e7k s HIS 49 Cb -0.09 0.67 -0.04 0.00 -1.43 0.00 0.00 32.58 31.68 2e7k s HIS 49 CO 0.31 -1.53 1.84 0.08 -2.00 0.00 0.00 174.74 173.44 2e7k s VAL 50 N -2.26 3.39 0.00 -5.38 1.01 -1.26 -3.19 120.40 112.71 2e7k s VAL 50 Ca 0.19 0.44 0.00 0.00 0.00 0.00 0.00 61.98 62.61 2e7k s VAL 50 Cb -0.04 -3.41 0.00 0.00 0.00 0.00 0.00 36.38 32.93 2e7k s VAL 50 CO 0.14 -0.18 0.00 0.61 0.00 0.00 0.00 175.10 175.67 2e7k n GLY 51 N 4.94 1.13 3.40 4.51 0.00 -1.10 -4.92 105.19 113.15 2e7k n GLY 51 Ca 0.22 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.90 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 -2.00 4.47 -0.24 1.61 1.01 -1.19 -4.73 116.67 115.61 2e7k s ASP 52 Ca 0.00 -0.28 -0.16 0.00 0.71 0.00 0.00 52.55 52.83 2e7k s ASP 52 Cb 0.00 -1.74 -0.04 0.00 1.01 0.00 0.00 42.92 42.15 2e7k s ASP 52 CO 0.00 0.08 0.40 -0.63 0.21 0.00 0.00 175.17 175.23 2e7k s ILE 53 N 0.89 5.17 -0.00 0.77 1.09 -1.21 -2.93 121.20 124.98 2e7k s ILE 53 Ca -0.01 0.68 -0.15 0.00 -1.10 0.00 0.00 60.65 60.07 2e7k s ILE 53 Cb -0.15 -3.73 -0.06 0.00 -1.06 0.00 0.00 42.46 37.47 2e7k s ILE 53 CO 0.01 0.19 0.41 -0.63 -0.10 0.00 0.00 174.94 174.82 2e7k s ILE 54 N 1.76 5.03 -0.01 2.92 1.01 -1.15 -1.18 121.20 129.58 2e7k s ILE 54 Ca 0.18 0.84 -0.06 0.00 0.00 0.00 0.00 60.65 61.61 2e7k s ILE 54 Cb -0.15 -3.72 -0.02 0.00 0.01 0.00 0.00 42.46 38.58 2e7k s ILE 54 CO 0.09 0.57 -0.11 1.17 0.00 0.00 0.00 174.94 176.66 2e7k n LYS 55 N 1.88 0.17 -4.06 2.79 3.00 -0.52 -4.67 118.16 116.74 2e7k n LYS 55 Ca -0.14 0.07 -0.12 0.00 -0.00 0.00 0.00 58.31 58.12 2e7k n LYS 55 Cb 0.52 -0.73 -0.11 0.00 0.00 0.00 0.00 35.03 34.71 2e7k n LYS 55 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.40 175.40 2e7k s GLU 56 N -2.10 0.51 -0.03 1.64 2.12 -1.26 -4.10 118.70 115.49 2e7k s GLU 56 Ca -0.09 -0.80 -0.00 0.00 0.36 0.00 0.00 54.97 54.43 2e7k s GLU 56 Cb 0.01 -0.17 0.03 0.00 0.26 0.00 0.00 34.13 34.27 2e7k s GLU 56 CO 0.13 0.01 0.02 0.08 -0.54 0.00 0.00 175.26 174.97 2e7k s VAL 57 N -1.75 0.04 -0.62 3.70 1.01 -0.70 -1.80 120.40 120.28 2e7k s VAL 57 Ca -0.08 0.18 0.00 0.00 0.00 0.00 0.00 61.98 62.08 2e7k s VAL 57 Cb -0.08 -0.17 0.00 0.00 0.00 0.00 0.00 36.38 36.14 2e7k s VAL 57 CO -0.01 0.12 0.00 0.59 0.00 0.00 0.00 175.10 175.80 2e7k n ASN 58 N 4.28 -2.65 -1.23 3.32 3.02 -0.86 0.65 115.26 121.79 2e7k n ASN 58 Ca -0.25 0.32 -0.07 0.00 -0.03 0.00 0.00 54.58 54.55 2e7k n ASN 58 Cb 0.50 -2.33 0.02 0.00 -0.61 0.00 0.00 39.78 37.36 2e7k n ASN 58 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2e7k n GLY 59 N -0.66 0.33 2.94 7.41 0.00 -1.26 -5.05 105.19 108.91 2e7k n GLY 59 Ca -0.08 -0.46 -0.11 0.00 0.00 0.00 0.00 46.02 45.37 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 -5.02 0.22 0.31 1.61 -1.52 0.21 -5.14 119.66 110.32 2e7k s GLN 60 Ca 0.12 -0.39 -0.29 0.00 -1.95 0.00 0.00 55.36 52.85 2e7k s GLN 60 Cb -0.05 0.03 -0.10 0.00 -0.22 0.00 0.00 33.01 32.67 2e7k s GLN 60 CO 0.15 -0.02 1.23 -1.25 -0.25 0.00 0.00 175.29 175.15 2e7k s PRO 61 N -0.90 4.46 -0.95 2.91 0.04 -1.26 -1.72 135.00 137.59 2e7k s PRO 61 Ca -0.09 2.06 -0.02 0.00 0.04 0.00 0.00 61.00 62.99 2e7k s PRO 61 Cb -0.06 -3.12 0.28 0.00 0.04 0.00 0.00 34.50 31.64 2e7k s PRO 61 CO -0.01 -0.04 1.17 1.33 0.04 0.00 0.00 177.00 179.50 2e7k n VAL 62 N 0.97 4.21 -1.01 -0.36 0.24 -1.26 -4.93 118.33 116.19 2e7k n VAL 62 Ca -0.00 -5.60 -0.35 0.00 -2.04 0.00 0.00 64.34 56.34 2e7k n VAL 62 Cb 0.43 -2.17 -0.02 0.00 -1.47 0.00 0.00 33.84 30.61 2e7k n VAL 62 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2e7k n GLY 63 N 1.44 -1.15 0.34 7.63 0.00 -1.26 -4.67 105.19 107.52 2e7k n GLY 63 Ca 0.26 0.27 0.32 0.00 0.00 0.00 0.00 46.02 46.88 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 1.39 0.30 -4.52 1.61 3.41 -1.26 -4.37 113.62 110.18 2e7k n SER 64 Ca 0.13 1.51 -0.54 0.00 -0.26 0.00 0.00 58.87 59.71 2e7k n SER 64 Cb 0.17 -0.74 -0.07 0.00 -0.26 0.00 0.00 64.21 63.30 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 -5.01 2.14 -0.07 4.04 9.92 -1.26 -4.76 116.55 121.55 2e7k n ASP 65 Ca 0.37 0.67 -0.13 0.00 -0.53 0.00 0.00 54.79 55.17 2e7k n ASP 65 Cb 1.29 -1.19 -0.06 0.00 -0.64 0.00 0.00 41.12 40.51 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 10.29 0.47 -0.03 -0.24 0.13 -1.85 -2.55 132.00 138.22 2e7k h PRO 66 Ca -0.32 -0.25 0.01 0.00 -0.87 0.00 0.00 66.00 64.57 2e7k h PRO 66 Cb 1.33 0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.47 2e7k h PRO 66 CO 1.01 0.82 0.02 0.00 -0.23 0.00 0.00 178.00 179.62 2e7k h ARG 67 N 0.13 0.00 0.07 0.86 3.08 -1.88 -1.11 114.38 115.53 2e7k h ARG 67 Ca 0.03 0.00 -0.25 0.00 0.07 0.00 0.00 59.98 59.83 2e7k h ARG 67 Cb 0.73 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.77 2e7k h ARG 67 CO 0.05 0.00 -1.16 0.00 -1.07 0.00 0.00 179.97 177.79 2e7k h ALA 68 N 1.98 0.24 0.42 0.04 0.00 -1.89 -3.29 119.26 116.75 2e7k h ALA 68 Ca 0.01 -0.92 -0.02 0.00 0.00 0.00 0.00 54.91 53.98 2e7k h ALA 68 Cb 0.06 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2e7k h ALA 68 CO -0.00 1.12 -0.20 1.25 0.00 0.00 0.00 179.25 181.42 2e7k h LEU 69 N 0.04 -0.47 -1.43 0.00 5.85 -0.82 -2.67 115.31 115.81 2e7k h LEU 69 Ca -0.09 -0.06 0.11 0.00 0.84 0.00 0.00 57.88 58.68 2e7k h LEU 69 Cb 1.88 0.12 -0.02 0.00 0.37 0.00 0.00 40.66 43.02 2e7k h LEU 69 CO 0.17 -0.04 0.70 1.56 -0.34 0.00 0.00 178.44 180.48 2e7k h GLN 70 N -1.08 0.00 0.06 1.25 4.20 -1.45 1.01 115.11 119.10 2e7k h GLN 70 Ca -0.06 0.00 -0.27 0.00 0.06 0.00 0.00 58.65 58.38 2e7k h GLN 70 Cb 0.51 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.26 2e7k h GLN 70 CO 0.09 0.00 -1.38 1.49 -0.67 0.00 0.00 178.83 178.36 2e7k h GLU 71 N 0.00 0.13 -0.69 1.46 4.81 -1.60 -3.27 114.58 115.42 2e7k h GLU 71 Ca 0.18 -0.21 0.02 0.00 -0.13 0.00 0.00 59.36 59.22 2e7k h GLU 71 Cb 1.58 0.08 -0.04 0.00 0.63 0.00 0.00 28.75 31.00 2e7k h GLU 71 CO -0.00 0.97 0.44 1.37 -0.73 0.00 0.00 179.01 181.06 2e7k h LEU 72 N 0.03 0.75 -0.80 1.64 8.10 0.14 -2.34 115.31 122.84 2e7k h LEU 72 Ca -0.17 -0.01 -0.08 0.00 0.11 0.00 0.00 57.88 57.73 2e7k h LEU 72 Cb 1.94 -0.18 -0.02 0.00 -0.44 0.00 0.00 40.66 41.96 2e7k h LEU 72 CO 0.14 0.53 0.04 -0.07 -4.11 0.00 0.00 178.44 174.97 2e7k h LEU 73 N 0.89 0.91 -0.80 0.17 3.38 -1.63 -3.01 115.31 115.22 2e7k h LEU 73 Ca 0.26 -0.22 0.19 0.00 0.09 0.00 0.00 57.88 58.20 2e7k h LEU 73 Cb -0.05 -0.24 -0.14 0.00 0.09 0.00 0.00 40.66 40.32 2e7k h LEU 73 CO -0.08 0.94 -0.01 -0.09 0.09 0.00 0.00 178.44 179.30 2e7k h ARG 74 N 0.88 0.08 -1.10 1.13 2.43 -1.46 0.61 114.38 116.95 2e7k h ARG 74 Ca 0.17 -0.00 -0.46 0.00 -0.81 0.00 0.00 59.98 58.87 2e7k h ARG 74 Cb 0.46 -0.02 -0.23 0.00 -0.42 0.00 0.00 29.97 29.76 2e7k h ARG 74 CO 0.02 0.05 0.59 0.09 -1.51 0.00 0.00 179.97 179.21 2e7k n ASN 75 N -5.38 5.27 -3.91 -3.80 3.02 -1.14 -2.75 115.26 106.56 2e7k n ASN 75 Ca 0.15 -3.36 -0.29 0.00 -0.03 0.00 0.00 54.58 51.05 2e7k n ASN 75 Cb 0.51 -0.88 -0.13 0.00 -0.61 0.00 0.00 39.78 38.67 2e7k n ASN 75 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2e7k s ALA 76 N -2.76 3.49 0.83 5.41 0.00 0.21 -5.06 121.76 123.89 2e7k s ALA 76 Ca 0.47 -3.52 -0.06 0.00 0.00 0.00 0.00 51.96 48.85 2e7k s ALA 76 Cb 0.38 -2.15 0.17 0.00 0.00 0.00 0.00 23.12 21.53 2e7k s ALA 76 CO 0.04 -2.06 1.14 0.45 0.00 0.00 0.00 175.76 175.33 2e7k s SER 77 N -0.83 3.74 0.42 0.00 0.15 -1.26 -4.79 113.70 111.12 2e7k s SER 77 Ca 0.21 -0.23 0.00 0.00 0.70 0.00 0.00 55.95 56.63 2e7k s SER 77 Cb -0.15 0.04 0.00 0.00 -1.71 0.00 0.00 66.02 64.20 2e7k s SER 77 CO -0.08 -2.29 0.00 0.61 1.20 0.00 0.00 173.24 172.68 2e7k n GLY 78 N -3.23 -0.11 3.51 9.45 0.00 -1.26 -4.46 105.19 109.10 2e7k n GLY 78 Ca 0.16 -0.99 -0.42 0.00 0.00 0.00 0.00 46.02 44.77 2e7k n GLY 78 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2e7k s SER 79 N -4.00 6.35 0.32 1.61 0.01 -1.26 -4.34 113.70 112.40 2e7k s SER 79 Ca 0.00 -1.16 -0.26 0.00 1.31 0.00 0.00 55.95 55.84 2e7k s SER 79 Cb 0.00 -2.50 -0.10 0.00 0.21 0.00 0.00 66.02 63.63 2e7k s SER 79 CO 0.00 -1.51 0.96 -0.69 0.41 0.00 0.00 173.24 172.40 2e7k s VAL 80 N 4.59 4.15 -0.19 3.43 1.01 -1.02 -4.80 120.40 127.56 2e7k s VAL 80 Ca 0.35 1.79 0.01 0.00 0.00 0.00 0.00 61.98 64.13 2e7k s VAL 80 Cb -0.07 -4.00 0.03 0.00 0.00 0.00 0.00 36.38 32.35 2e7k s VAL 80 CO 0.02 0.15 -0.16 -0.63 0.00 0.00 0.00 175.10 174.48 2e7k s ILE 81 N -1.59 1.89 -0.27 2.22 -1.09 -1.26 -1.89 121.20 119.22 2e7k s ILE 81 Ca 0.50 -0.99 -0.03 0.00 -2.23 0.00 0.00 60.65 57.91 2e7k s ILE 81 Cb -0.19 -1.81 0.03 0.00 -1.58 0.00 0.00 42.46 38.90 2e7k s ILE 81 CO 0.25 0.37 -0.02 -0.76 -1.23 0.00 0.00 174.94 173.55 2e7k s LEU 82 N 1.33 3.46 -0.57 2.97 1.43 -1.05 -2.03 118.68 124.21 2e7k s LEU 82 Ca 0.02 -0.91 -0.24 0.00 -1.03 0.00 0.00 54.13 51.97 2e7k s LEU 82 Cb -0.15 -1.72 0.04 0.00 0.03 0.00 0.00 46.19 44.40 2e7k s LEU 82 CO -0.10 -0.17 0.96 -0.75 0.23 0.00 0.00 176.35 176.52 2e7k s LYS 83 N 1.35 3.30 0.20 1.70 2.20 -0.75 -2.25 119.74 125.49 2e7k s LYS 83 Ca -0.00 -0.32 0.04 0.00 -0.36 0.00 0.00 55.97 55.33 2e7k s LYS 83 Cb -0.17 -4.08 -0.03 0.00 -1.51 0.00 0.00 37.83 32.04 2e7k s LYS 83 CO -0.02 -1.56 0.30 0.42 -0.36 0.00 0.00 175.35 174.13 2e7k s ILE 84 N 4.06 5.18 -0.04 5.43 -1.09 -0.84 -1.44 121.20 132.45 2e7k s ILE 84 Ca 0.30 -0.90 -0.03 0.00 -2.23 0.00 0.00 60.65 57.79 2e7k s ILE 84 Cb -0.13 -3.74 0.02 0.00 -1.58 0.00 0.00 42.46 37.03 2e7k s ILE 84 CO 0.18 -0.22 0.11 -0.76 -1.23 0.00 0.00 174.94 173.02 2e7k s LEU 85 N -3.60 1.39 0.00 2.97 1.02 -0.33 -1.16 118.68 118.97 2e7k s LEU 85 Ca 0.34 0.22 -0.10 0.00 0.02 0.00 0.00 54.13 54.61 2e7k s LEU 85 Cb -0.10 0.33 0.15 0.00 0.02 0.00 0.00 46.19 46.59 2e7k s LEU 85 CO 0.28 -0.07 0.34 -1.54 0.02 0.00 0.00 176.35 175.38 2e7k n SER 86 N 3.35 -2.61 0.00 2.29 3.41 -1.26 -3.31 113.62 115.48 2e7k n SER 86 Ca -0.16 -0.34 0.00 0.00 -0.26 0.00 0.00 58.87 58.11 2e7k n SER 86 Cb 0.57 -0.45 0.00 0.00 -0.26 0.00 0.00 64.21 64.07 2e7k n SER 86 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2e7k n GLY 87 N -1.87 -0.61 0.00 5.00 0.00 -1.26 -4.77 105.19 101.68 2e7k n GLY 87 Ca 0.05 -0.59 0.07 0.00 0.00 0.00 0.00 46.02 45.55 2e7k n GLY 87 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2e7k n PRO 88 N 0.00 0.17 -2.52 1.61 -0.04 -1.26 -4.73 135.00 128.23 2e7k n PRO 88 Ca 0.00 0.17 -0.42 0.00 -0.04 0.00 0.00 63.50 63.20 2e7k n PRO 88 Cb 0.00 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 31.93 2e7k n PRO 88 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2e7k s SER 89 N -2.65 7.11 0.53 3.54 1.04 -1.26 -5.04 113.70 116.97 2e7k s SER 89 Ca 0.13 1.74 0.07 0.00 0.48 0.00 0.00 55.95 58.37 2e7k s SER 89 Cb 0.10 -2.56 0.06 0.00 0.10 0.00 0.00 66.02 63.72 2e7k s SER 89 CO 0.23 -0.54 0.73 -0.94 0.98 0.00 0.00 173.24 173.71 2e7k s SER 90 N 1.35 5.24 0.00 7.02 1.04 -1.26 -5.07 113.70 122.02 2e7k s SER 90 Ca 0.54 -0.56 0.00 0.00 0.48 0.00 0.00 55.95 56.41 2e7k s SER 90 Cb -0.23 -0.20 0.00 0.00 0.10 0.00 0.00 66.02 65.69 2e7k s SER 90 CO 0.21 -1.17 0.00 0.61 0.98 0.00 0.00 173.24 173.88