#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 2.01 -3.77 1.61 7.64 -1.26 -4.77 113.62 115.08 2e7k n SER 2 Ca 0.00 1.11 -0.39 0.00 1.01 0.00 0.00 58.87 60.60 2e7k n SER 2 Cb 0.00 -1.07 -0.01 0.00 -1.01 0.00 0.00 64.21 62.12 2e7k n SER 2 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2e7k n SER 3 N 4.88 -1.87 -4.89 6.43 3.41 -1.26 -4.92 113.62 115.40 2e7k n SER 3 Ca 0.27 0.83 -0.32 0.00 -0.26 0.00 0.00 58.87 59.39 2e7k n SER 3 Cb 0.08 -0.79 -0.05 0.00 -0.26 0.00 0.00 64.21 63.19 2e7k n SER 3 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2e7k s GLY 4 N -0.87 2.25 -0.28 5.00 0.00 -1.26 -5.00 107.32 107.16 2e7k s GLY 4 Ca 0.53 -0.54 -0.31 0.00 0.00 0.00 0.00 44.72 44.39 2e7k s GLY 4 CO 0.52 -0.43 2.21 1.44 0.00 0.00 0.00 173.10 176.84 2e7k n SER 5 N 0.39 2.70 -3.75 1.64 7.64 -1.26 -4.92 113.62 116.07 2e7k n SER 5 Ca -0.05 0.29 -0.30 0.00 1.01 0.00 0.00 58.87 59.83 2e7k n SER 5 Cb 0.52 -1.42 -0.15 0.00 -1.01 0.00 0.00 64.21 62.15 2e7k n SER 5 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2e7k s SER 6 N 7.89 3.99 0.32 6.43 0.01 -1.26 -5.08 113.70 125.99 2e7k s SER 6 Ca 1.05 -1.59 0.00 0.00 1.31 0.00 0.00 55.95 56.72 2e7k s SER 6 Cb -0.59 -0.89 0.00 0.00 0.21 0.00 0.00 66.02 64.76 2e7k s SER 6 CO 0.42 -0.40 0.00 0.61 0.41 0.00 0.00 173.24 174.28 2e7k n GLY 7 N 4.83 0.60 2.68 3.44 0.00 -1.26 -4.52 105.19 110.96 2e7k n GLY 7 Ca -0.02 -0.86 -0.29 0.00 0.00 0.00 0.00 46.02 44.84 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 0.00 1.17 -0.43 1.61 3.52 -0.37 -4.89 118.95 119.56 2e7k s ARG 8 Ca 0.00 -1.87 -0.28 0.00 -0.13 0.00 0.00 55.73 53.45 2e7k s ARG 8 Cb 0.00 -2.20 -0.01 0.00 -1.56 0.00 0.00 34.95 31.18 2e7k s ARG 8 CO 0.00 -1.16 1.74 -1.64 -0.81 0.00 0.00 175.30 173.44 2e7k s MET 9 N 0.51 3.17 -0.20 5.12 -1.94 -1.24 -3.31 119.30 121.41 2e7k s MET 9 Ca 0.17 1.10 -0.10 0.00 -1.71 0.00 0.00 55.69 55.15 2e7k s MET 9 Cb -0.24 -4.22 -0.05 0.00 2.01 0.00 0.00 34.83 32.33 2e7k s MET 9 CO -0.01 -2.06 0.13 0.08 -0.01 0.00 0.00 175.02 173.16 2e7k s VAL 10 N 7.25 5.39 -0.13 -6.03 1.01 -0.94 -4.82 120.40 122.13 2e7k s VAL 10 Ca 0.73 0.18 -0.07 0.00 0.00 0.00 0.00 61.98 62.82 2e7k s VAL 10 Cb -0.18 -3.46 -0.04 0.00 0.00 0.00 0.00 36.38 32.70 2e7k s VAL 10 CO 0.30 0.43 0.13 -0.83 0.00 0.00 0.00 175.10 175.13 2e7k s GLY 11 N 0.41 2.12 -0.01 4.51 0.00 -1.26 -2.17 107.32 110.92 2e7k s GLY 11 Ca 0.08 -0.66 0.00 0.00 0.00 0.00 0.00 44.72 44.14 2e7k s GLY 11 CO -0.01 -0.32 0.01 -0.42 0.00 0.00 0.00 173.10 172.36 2e7k s ILE 12 N -0.80 -0.02 -0.91 0.90 1.01 -1.05 -4.98 121.20 115.34 2e7k s ILE 12 Ca 0.14 0.10 -0.02 0.00 0.00 0.00 0.00 60.65 60.87 2e7k s ILE 12 Cb -0.12 -0.05 0.28 0.00 0.01 0.00 0.00 42.46 42.58 2e7k s ILE 12 CO 0.03 0.05 2.09 -2.11 0.00 0.00 0.00 174.94 175.00 2e7k n ARG 13 N 3.62 3.82 -1.78 2.79 1.85 -1.26 -3.01 116.66 122.69 2e7k n ARG 13 Ca -0.20 -3.76 -0.29 0.00 -1.00 0.00 0.00 57.85 52.60 2e7k n ARG 13 Cb 0.55 -2.36 0.09 0.00 -1.05 0.00 0.00 32.46 29.70 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 -3.59 1.91 0.02 2.89 -2.85 -1.25 -4.88 119.74 111.99 2e7k s LYS 14 Ca 0.49 0.26 0.03 0.00 -1.00 0.00 0.00 55.97 55.74 2e7k s LYS 14 Cb 0.32 -1.93 -0.04 0.00 -2.06 0.00 0.00 37.83 34.13 2e7k s LYS 14 CO -0.26 -1.66 -0.02 0.99 0.10 0.00 0.00 175.35 174.50 2e7k s THR 15 N -3.43 3.99 0.45 3.79 2.01 -1.26 -2.69 115.64 118.49 2e7k s THR 15 Ca 0.62 -0.74 -0.22 0.00 0.31 0.00 0.00 61.69 61.66 2e7k s THR 15 Cb -0.12 -2.80 -0.11 0.00 0.01 0.00 0.00 72.50 69.48 2e7k s THR 15 CO 0.51 0.32 0.73 0.00 -0.69 0.00 0.00 174.62 175.49 2e7k n ALA 16 N 1.25 -0.79 -1.63 7.40 0.00 -1.26 -2.36 120.51 123.11 2e7k n ALA 16 Ca -0.14 0.15 -0.05 0.00 0.00 0.00 0.00 53.44 53.40 2e7k n ALA 16 Cb 0.52 -1.90 -0.01 0.00 0.00 0.00 0.00 19.45 18.06 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 1.55 0.46 3.97 0.00 0.00 0.38 -5.04 105.19 106.52 2e7k n GLY 17 Ca 0.11 -0.75 -0.22 0.00 0.00 0.00 0.00 46.02 45.16 2e7k n GLY 17 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2e7k s GLU 18 N -3.36 2.41 -0.03 1.61 0.41 -1.00 -5.05 118.70 113.70 2e7k s GLU 18 Ca 0.00 -0.79 -0.01 0.00 -0.41 0.00 0.00 54.97 53.76 2e7k s GLU 18 Cb 0.00 -2.45 0.03 0.00 -1.78 0.00 0.00 34.13 29.93 2e7k s GLU 18 CO 0.00 -0.84 0.04 -1.01 -0.49 0.00 0.00 175.26 172.96 2e7k s HIS 19 N -2.84 0.11 0.08 1.61 3.76 -1.26 -4.17 115.29 112.58 2e7k s HIS 19 Ca 0.59 0.15 -0.14 0.00 -0.15 0.00 0.00 55.06 55.50 2e7k s HIS 19 Cb -0.10 -0.39 -0.15 0.00 1.11 0.00 0.00 32.58 33.05 2e7k s HIS 19 CO 0.40 -0.15 1.30 -0.07 -0.85 0.00 0.00 174.74 175.36 2e7k h LEU 20 N 7.83 0.83 -2.97 0.89 -0.00 -1.93 -3.45 115.31 116.51 2e7k h LEU 20 Ca -0.30 -0.62 -0.01 0.00 -0.00 0.00 0.00 57.88 56.95 2e7k h LEU 20 Cb 1.12 -0.25 0.01 0.00 -0.00 0.00 0.00 40.66 41.55 2e7k h LEU 20 CO 0.33 1.31 -0.04 0.61 -0.00 0.00 0.00 178.44 180.65 2e7k n GLY 21 N 0.64 0.78 3.25 0.83 0.00 -1.26 -4.38 105.19 105.06 2e7k n GLY 21 Ca -0.07 -0.24 -0.10 0.00 0.00 0.00 0.00 46.02 45.61 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 -3.02 0.05 -0.11 1.61 -7.23 -1.26 0.15 120.40 110.59 2e7k s VAL 22 Ca 0.02 -1.77 -0.01 0.00 -1.81 0.00 0.00 61.98 58.41 2e7k s VAL 22 Cb -0.00 -2.16 0.03 0.00 0.56 0.00 0.00 36.38 34.81 2e7k s VAL 22 CO 0.04 -0.23 -0.06 0.42 -0.31 0.00 0.00 175.10 174.95 2e7k s THR 23 N -4.06 0.93 -0.05 5.32 -4.23 0.95 -4.81 115.64 109.69 2e7k s THR 23 Ca 0.27 -0.27 -0.04 0.00 -1.18 0.00 0.00 61.69 60.48 2e7k s THR 23 Cb 0.06 -0.99 -0.04 0.00 1.34 0.00 0.00 72.50 72.86 2e7k s THR 23 CO 0.05 0.32 0.15 -0.36 -0.54 0.00 0.00 174.62 174.24 2e7k s PHE 24 N 1.74 3.52 -0.04 3.99 0.40 -1.26 0.23 117.98 126.55 2e7k s PHE 24 Ca 0.04 0.39 0.06 0.00 -0.60 0.00 0.00 56.93 56.82 2e7k s PHE 24 Cb -0.13 -1.85 -0.02 0.00 0.51 0.00 0.00 43.02 41.53 2e7k s PHE 24 CO -0.08 0.66 -0.21 -0.98 0.70 0.00 0.00 175.22 175.31 2e7k s ARG 25 N -1.57 2.42 -0.71 0.44 1.70 0.73 -4.77 118.95 117.18 2e7k s ARG 25 Ca 0.22 -0.83 -0.21 0.00 -0.47 0.00 0.00 55.73 54.44 2e7k s ARG 25 Cb -0.12 -2.22 0.09 0.00 -0.57 0.00 0.00 34.95 32.14 2e7k s ARG 25 CO 0.13 0.52 0.95 0.08 -1.08 0.00 0.00 175.30 175.89 2e7k s VAL 26 N -0.49 4.55 -0.44 4.99 1.01 -1.26 -2.52 120.40 126.24 2e7k s VAL 26 Ca 0.06 -0.83 -0.04 0.00 0.00 0.00 0.00 61.98 61.17 2e7k s VAL 26 Cb -0.11 -4.66 0.12 0.00 0.00 0.00 0.00 36.38 31.72 2e7k s VAL 26 CO 0.01 -1.39 0.24 -1.61 0.00 0.00 0.00 175.10 172.35 2e7k s GLU 27 N 3.37 2.11 0.00 2.72 8.01 -1.22 -4.84 118.70 128.84 2e7k s GLU 27 Ca 0.22 -1.89 0.00 0.00 0.01 0.00 0.00 54.97 53.31 2e7k s GLU 27 Cb -0.15 -3.63 0.00 0.00 -4.31 0.00 0.00 34.13 26.03 2e7k s GLU 27 CO 0.04 -1.10 0.00 0.41 0.01 0.00 0.00 175.26 174.62 2e7k n GLY 28 N 4.51 2.04 0.80 -1.39 0.00 -1.26 -3.97 105.19 105.91 2e7k n GLY 28 Ca -0.02 -0.36 -0.02 0.00 0.00 0.00 0.00 46.02 45.63 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 0.00 -0.24 3.18 -0.02 0.00 -1.26 -5.15 105.19 101.70 2e7k n GLY 29 Ca 0.00 -0.01 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 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 0.00 0.44 -0.29 1.61 4.04 -1.26 -4.96 118.70 118.29 2e7k s GLU 30 Ca 0.00 0.14 -0.25 0.00 0.04 0.00 0.00 54.97 54.91 2e7k s GLU 30 Cb 0.02 0.20 0.00 0.00 0.02 0.00 0.00 34.13 34.37 2e7k s GLU 30 CO -0.00 -0.09 0.86 -0.51 -1.84 0.00 0.00 175.26 173.68 2e7k s LEU 31 N -0.43 4.06 -0.03 1.83 1.43 -1.26 -3.40 118.68 120.88 2e7k s LEU 31 Ca -0.05 0.84 0.06 0.00 -1.03 0.00 0.00 54.13 53.95 2e7k s LEU 31 Cb -0.04 -3.21 -0.01 0.00 0.03 0.00 0.00 46.19 42.96 2e7k s LEU 31 CO 0.02 -0.65 -0.23 0.54 0.23 0.00 0.00 176.35 176.26 2e7k s VAL 32 N 3.08 1.80 -0.41 -1.59 0.11 -1.05 -1.58 120.40 120.77 2e7k s VAL 32 Ca 0.36 -0.96 -0.28 0.00 -2.93 0.00 0.00 61.98 58.17 2e7k s VAL 32 Cb -0.14 -1.51 -0.01 0.00 -1.53 0.00 0.00 36.38 33.19 2e7k s VAL 32 CO 0.12 0.51 1.71 -0.63 -3.33 0.00 0.00 175.10 173.48 2e7k s ILE 33 N -0.39 3.56 0.03 7.04 1.01 -1.07 -0.20 121.20 131.17 2e7k s ILE 33 Ca 0.05 0.53 -0.16 0.00 0.00 0.00 0.00 60.65 61.07 2e7k s ILE 33 Cb -0.10 -3.85 -0.36 0.00 0.01 0.00 0.00 42.46 38.16 2e7k s ILE 33 CO 0.00 -0.61 0.99 0.00 0.00 0.00 0.00 174.94 175.33 2e7k h ALA 34 N 12.74 -0.15 -2.41 9.38 0.00 -0.55 0.82 119.26 139.08 2e7k h ALA 34 Ca -0.31 -0.87 -0.08 0.00 0.00 0.00 0.00 54.91 53.65 2e7k h ALA 34 Cb 1.15 0.19 -0.18 0.00 0.00 0.00 0.00 17.79 18.95 2e7k h ALA 34 CO 1.08 0.71 -0.09 0.50 0.00 0.00 0.00 179.25 181.46 2e7k s ARG 35 N -2.60 0.88 -0.43 0.00 3.52 -1.05 -4.87 118.95 114.40 2e7k s ARG 35 Ca -0.09 -0.17 -0.02 0.00 -0.13 0.00 0.00 55.73 55.31 2e7k s ARG 35 Cb 0.04 0.40 0.12 0.00 -1.56 0.00 0.00 34.95 33.94 2e7k s ARG 35 CO 0.95 -0.28 0.22 0.42 -0.81 0.00 0.00 175.30 175.79 2e7k s ILE 36 N -1.85 3.25 0.73 4.11 1.01 -1.26 -0.03 121.20 127.15 2e7k s ILE 36 Ca -0.09 -2.20 -0.16 0.00 0.00 0.00 0.00 60.65 58.21 2e7k s ILE 36 Cb -0.02 -3.22 -0.01 0.00 0.01 0.00 0.00 42.46 39.22 2e7k s ILE 36 CO 0.02 -0.71 0.79 0.18 0.00 0.00 0.00 174.94 175.22 2e7k n LEU 37 N 4.43 2.39 -4.18 2.97 4.32 0.40 -4.72 117.00 122.60 2e7k n LEU 37 Ca -0.01 0.63 -0.27 0.00 -0.02 0.00 0.00 56.01 56.34 2e7k n LEU 37 Cb 0.41 -1.33 -0.11 0.00 -1.62 0.00 0.00 43.42 40.77 2e7k n LEU 37 CO 0.32 -2.49 1.31 0.00 -1.22 0.00 0.00 177.39 175.31 2e7k n HIS 38 N -2.50 0.89 -0.00 -1.77 1.44 -1.26 -4.55 115.22 107.47 2e7k n HIS 38 Ca 0.12 -0.52 -0.00 0.00 -2.01 0.00 0.00 57.72 55.31 2e7k n HIS 38 Cb 0.50 -1.98 -0.00 0.00 0.12 0.00 0.00 29.99 28.62 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 5.64 -0.50 0.00 -1.39 0.00 -1.26 -5.03 105.19 102.65 2e7k n GLY 39 Ca 0.44 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.45 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 1.57 3.98 0.10 -0.02 0.00 -1.26 -4.98 105.19 104.58 2e7k n GLY 40 Ca -0.00 -0.71 -0.04 0.00 0.00 0.00 0.00 46.02 45.26 2e7k n GLY 40 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 2e7k h MET 41 N 0.00 -0.22 0.00 1.61 -1.53 -1.87 0.35 114.93 113.27 2e7k h MET 41 Ca 0.00 0.01 -0.08 0.00 -3.44 0.00 0.00 59.70 56.20 2e7k h MET 41 Cb 0.00 0.05 -0.01 0.00 -0.55 0.00 0.00 31.60 31.09 2e7k h MET 41 CO 0.00 -0.15 -0.37 -0.24 0.14 0.00 0.00 176.91 176.29 2e7k h VAL 42 N -0.23 0.72 -0.18 -5.77 3.04 -1.88 -1.54 116.25 110.42 2e7k h VAL 42 Ca -0.02 -1.73 -0.14 0.00 -1.01 0.00 0.00 66.70 63.80 2e7k h VAL 42 Cb 0.19 2.14 -0.01 0.00 -2.01 0.00 0.00 31.29 31.60 2e7k h VAL 42 CO 0.01 0.37 -0.49 0.00 -1.01 0.00 0.00 177.57 176.44 2e7k h ALA 43 N 1.63 0.82 0.00 3.17 0.00 -1.85 -3.20 119.26 119.83 2e7k h ALA 43 Ca -0.00 -0.48 -0.27 0.00 0.00 0.00 0.00 54.91 54.16 2e7k h ALA 43 Cb 1.11 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.76 2e7k h ALA 43 CO 0.05 0.67 -1.61 1.96 0.00 0.00 0.00 179.25 180.32 2e7k h GLN 44 N 0.38 0.00 -6.16 0.00 1.08 -0.27 -3.45 115.11 106.68 2e7k h GLN 44 Ca 0.02 0.00 -0.58 0.00 -1.45 0.00 0.00 58.65 56.64 2e7k h GLN 44 Cb 1.00 0.00 -0.06 0.00 -0.05 0.00 0.00 27.48 28.37 2e7k h GLN 44 CO 0.09 0.51 0.83 -0.65 -0.95 0.00 0.00 178.83 178.66 2e7k s GLN 45 N -2.64 4.19 -0.09 1.46 -0.21 -0.59 -4.91 119.66 116.86 2e7k s GLN 45 Ca -0.04 1.30 -0.00 0.00 0.02 0.00 0.00 55.36 56.64 2e7k s GLN 45 Cb 0.08 -3.69 0.07 0.00 1.00 0.00 0.00 33.01 30.47 2e7k s GLN 45 CO 0.82 -0.73 1.92 0.41 -2.12 0.00 0.00 175.29 175.59 2e7k n GLY 46 N 3.54 2.93 0.34 3.09 0.00 -1.26 -3.89 105.19 109.94 2e7k n GLY 46 Ca 0.12 -0.32 -0.18 0.00 0.00 0.00 0.00 46.02 45.64 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 1.06 1.71 -4.82 0.99 4.77 -1.26 -5.00 117.00 114.44 2e7k n LEU 47 Ca 0.09 0.16 -0.36 0.00 -0.03 0.00 0.00 56.01 55.87 2e7k n LEU 47 Cb 0.54 -0.57 -0.07 0.00 -2.33 0.00 0.00 43.42 40.99 2e7k n LEU 47 CO 0.11 0.49 -0.21 -0.76 -1.33 0.00 0.00 177.39 175.69 2e7k s LEU 48 N -6.80 4.15 -0.03 2.23 1.43 -1.25 -5.10 118.68 113.30 2e7k s LEU 48 Ca -0.26 0.36 -0.18 0.00 -1.03 0.00 0.00 54.13 53.03 2e7k s LEU 48 Cb 0.09 -2.03 0.03 0.00 0.03 0.00 0.00 46.19 44.31 2e7k s LEU 48 CO 0.35 0.39 0.38 -1.00 0.23 0.00 0.00 176.35 176.70 2e7k s HIS 49 N -1.01 -0.28 0.05 0.29 3.76 -1.26 -4.91 115.29 111.92 2e7k s HIS 49 Ca 0.15 0.48 -0.26 0.00 -0.15 0.00 0.00 55.06 55.28 2e7k s HIS 49 Cb -0.12 0.16 -0.13 0.00 1.11 0.00 0.00 32.58 33.59 2e7k s HIS 49 CO 0.05 -0.42 0.63 0.28 -0.85 0.00 0.00 174.74 174.43 2e7k n VAL 50 N 1.32 0.46 0.00 -0.90 0.31 -1.26 -1.44 118.33 116.81 2e7k n VAL 50 Ca -0.21 -0.11 0.00 0.00 -0.01 0.00 0.00 64.34 64.01 2e7k n VAL 50 Cb 0.56 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.49 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 1.17 2.45 3.62 2.92 0.00 0.28 -4.95 105.19 110.68 2e7k n GLY 51 Ca 0.14 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.66 2e7k n GLY 51 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2e7k n ASP 52 N 0.00 2.10 -4.66 1.61 9.92 -0.52 -4.57 116.55 120.42 2e7k n ASP 52 Ca 0.00 1.11 -0.37 0.00 -0.53 0.00 0.00 54.79 55.01 2e7k n ASP 52 Cb 0.00 -1.28 -0.09 0.00 -0.64 0.00 0.00 41.12 39.11 2e7k n ASP 52 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 2e7k s ILE 53 N 0.48 5.35 -0.19 0.53 1.09 -1.09 -2.61 121.20 124.76 2e7k s ILE 53 Ca 0.80 0.22 -0.11 0.00 -1.10 0.00 0.00 60.65 60.46 2e7k s ILE 53 Cb -0.84 -3.52 -0.05 0.00 -1.06 0.00 0.00 42.46 36.99 2e7k s ILE 53 CO 0.45 0.34 0.19 -0.63 -0.10 0.00 0.00 174.94 175.19 2e7k s ILE 54 N 1.04 5.37 -0.13 2.92 1.09 -0.61 -0.64 121.20 130.23 2e7k s ILE 54 Ca 0.08 0.31 -0.11 0.00 -1.10 0.00 0.00 60.65 59.84 2e7k s ILE 54 Cb -0.13 -3.53 -0.06 0.00 -1.06 0.00 0.00 42.46 37.68 2e7k s ILE 54 CO 0.04 0.41 -0.23 0.29 -0.10 0.00 0.00 174.94 175.35 2e7k n LYS 55 N 3.65 0.37 -3.84 2.79 4.76 -0.66 -4.19 118.16 121.03 2e7k n LYS 55 Ca -0.14 0.15 -0.12 0.00 -2.87 0.00 0.00 58.31 55.33 2e7k n LYS 55 Cb 0.52 -1.13 -0.10 0.00 -1.84 0.00 0.00 35.03 32.48 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 -2.48 0.43 -0.13 1.97 2.12 -1.24 -4.07 118.70 115.29 2e7k s GLU 56 Ca -0.22 -0.19 -0.01 0.00 0.36 0.00 0.00 54.97 54.91 2e7k s GLU 56 Cb 0.06 0.18 0.04 0.00 0.26 0.00 0.00 34.13 34.67 2e7k s GLU 56 CO 0.30 -0.10 -0.02 0.08 -0.54 0.00 0.00 175.26 174.98 2e7k s VAL 57 N -0.95 0.74 -1.49 3.70 1.01 -0.98 -1.14 120.40 121.30 2e7k s VAL 57 Ca -0.10 -0.32 -0.02 0.00 0.00 0.00 0.00 61.98 61.53 2e7k s VAL 57 Cb -0.06 -0.96 0.00 0.00 0.00 0.00 0.00 36.38 35.37 2e7k s VAL 57 CO 0.01 0.14 0.28 0.59 0.00 0.00 0.00 175.10 176.12 2e7k n ASN 58 N 5.01 -5.53 -1.82 3.32 3.02 -1.05 -2.12 115.26 116.08 2e7k n ASN 58 Ca -0.10 -0.14 -0.13 0.00 -0.03 0.00 0.00 54.58 54.18 2e7k n ASN 58 Cb 0.49 -4.47 0.02 0.00 -0.61 0.00 0.00 39.78 35.21 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 -1.24 0.01 2.97 7.41 0.00 -1.26 -5.03 105.19 108.05 2e7k n GLY 59 Ca -0.16 -0.26 -0.18 0.00 0.00 0.00 0.00 46.02 45.42 2e7k n GLY 59 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2e7k s GLN 60 N -5.21 0.64 -0.07 1.61 0.74 -0.90 -5.12 119.66 111.35 2e7k s GLN 60 Ca 0.18 -0.22 -0.30 0.00 0.05 0.00 0.00 55.36 55.07 2e7k s GLN 60 Cb -0.08 -0.62 -0.04 0.00 1.10 0.00 0.00 33.01 33.36 2e7k s GLN 60 CO 0.22 0.10 1.50 -1.25 -0.55 0.00 0.00 175.29 175.31 2e7k s PRO 61 N 0.10 4.21 0.30 1.67 0.04 -1.26 -2.31 135.00 137.75 2e7k s PRO 61 Ca -0.01 2.01 0.25 0.00 0.04 0.00 0.00 61.00 63.29 2e7k s PRO 61 Cb -0.06 -3.83 0.66 0.00 0.04 0.00 0.00 34.50 31.30 2e7k s PRO 61 CO -0.00 -0.75 1.72 -0.39 0.04 0.00 0.00 177.00 177.61 2e7k h VAL 62 N 5.40 0.00 -1.42 -0.36 -1.51 -1.95 -3.49 116.25 112.92 2e7k h VAL 62 Ca -0.36 -0.66 0.00 0.00 -1.23 0.00 0.00 66.70 64.45 2e7k h VAL 62 Cb 1.16 1.65 0.00 0.00 -2.13 0.00 0.00 31.29 31.97 2e7k h VAL 62 CO 0.95 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 177.90 2e7k n GLY 63 N 1.16 -0.43 2.19 5.19 0.00 -1.26 -3.67 105.19 108.37 2e7k n GLY 63 Ca 0.05 -0.78 -0.27 0.00 0.00 0.00 0.00 46.02 45.01 2e7k n GLY 63 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2e7k n SER 64 N -3.22 5.73 -3.97 1.61 7.64 -1.26 -4.70 113.62 115.44 2e7k n SER 64 Ca 0.00 -3.57 -0.31 0.00 1.01 0.00 0.00 58.87 56.00 2e7k n SER 64 Cb 0.00 -0.91 -0.15 0.00 -1.01 0.00 0.00 64.21 62.14 2e7k n SER 64 CO 0.00 0.00 0.00 1.51 -3.01 0.00 0.00 175.04 173.54 2e7k s ASP 65 N -1.30 4.49 0.12 6.43 1.47 -1.24 -4.93 116.67 121.71 2e7k s ASP 65 Ca 0.56 -1.83 -0.13 0.00 1.18 0.00 0.00 52.55 52.33 2e7k s ASP 65 Cb 0.45 -1.44 -0.06 0.00 -0.34 0.00 0.00 42.92 41.53 2e7k s ASP 65 CO 0.04 -0.34 1.45 1.55 0.68 0.00 0.00 175.17 178.56 2e7k h PRO 66 N 7.75 0.83 -0.63 2.11 0.13 -1.86 -2.45 132.00 137.88 2e7k h PRO 66 Ca -0.10 -0.44 -0.01 0.00 -0.87 0.00 0.00 66.00 64.59 2e7k h PRO 66 Cb 1.03 0.01 -0.03 0.00 0.13 0.00 0.00 31.00 32.14 2e7k h PRO 66 CO 0.49 1.07 0.35 0.00 -0.23 0.00 0.00 178.00 179.68 2e7k h ARG 67 N 0.62 0.86 0.00 0.86 3.08 -1.94 -1.40 114.38 116.46 2e7k h ARG 67 Ca 0.06 -0.08 -0.14 0.00 0.07 0.00 0.00 59.98 59.88 2e7k h ARG 67 Cb 0.92 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 30.77 2e7k h ARG 67 CO 0.08 0.63 -0.69 0.00 -1.07 0.00 0.00 179.97 178.92 2e7k h ALA 68 N 1.52 0.77 0.16 0.04 0.00 -1.93 -3.28 119.26 116.53 2e7k h ALA 68 Ca 0.22 -0.63 -0.01 0.00 0.00 0.00 0.00 54.91 54.50 2e7k h ALA 68 Cb 0.01 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.69 2e7k h ALA 68 CO -0.04 0.86 -0.07 1.25 0.00 0.00 0.00 179.25 181.25 2e7k h LEU 69 N 0.00 -0.18 -1.32 0.00 5.85 -0.85 -2.61 115.31 116.20 2e7k h LEU 69 Ca -0.01 -0.35 0.00 0.00 0.84 0.00 0.00 57.88 58.36 2e7k h LEU 69 Cb 1.29 0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.37 2e7k h LEU 69 CO 0.09 0.31 0.37 1.56 -0.34 0.00 0.00 178.44 180.43 2e7k h GLN 70 N -0.73 0.00 0.03 1.25 4.20 -1.37 0.50 115.11 118.99 2e7k h GLN 70 Ca -0.02 0.00 -0.32 0.00 0.06 0.00 0.00 58.65 58.37 2e7k h GLN 70 Cb 0.52 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.25 2e7k h GLN 70 CO 0.04 0.00 -1.85 -1.91 -0.67 0.00 0.00 178.83 174.44 2e7k n GLU 71 N -2.46 0.67 -0.22 1.46 2.13 -1.13 -3.89 120.64 117.21 2e7k n GLU 71 Ca -0.01 0.26 -0.06 0.00 0.66 0.00 0.00 57.16 58.01 2e7k n GLU 71 Cb 0.40 -1.75 0.04 0.00 0.27 0.00 0.00 31.44 30.40 2e7k n GLU 71 CO 0.00 0.00 0.00 1.37 -0.41 0.00 0.00 177.13 178.09 2e7k h LEU 72 N 0.02 0.74 -1.68 4.31 8.10 0.39 -1.77 115.31 125.42 2e7k h LEU 72 Ca -0.35 -0.06 -0.04 0.00 0.11 0.00 0.00 57.88 57.55 2e7k h LEU 72 Cb 2.03 -0.19 -0.01 0.00 -0.44 0.00 0.00 40.66 42.06 2e7k h LEU 72 CO 0.07 0.58 -0.17 -0.07 -4.11 0.00 0.00 178.44 174.75 2e7k h LEU 73 N 0.83 0.00 -1.57 0.17 3.38 -1.67 -2.26 115.31 114.19 2e7k h LEU 73 Ca 0.22 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.16 2e7k h LEU 73 Cb -0.02 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 2e7k h LEU 73 CO -0.04 0.17 0.00 -0.09 0.09 0.00 0.00 178.44 178.57 2e7k h ARG 74 N 0.00 0.27 0.12 1.13 2.43 -1.43 -2.93 114.38 113.97 2e7k h ARG 74 Ca -0.00 -0.04 -0.35 0.00 -0.81 0.00 0.00 59.98 58.78 2e7k h ARG 74 Cb 0.45 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.94 2e7k h ARG 74 CO 0.02 0.29 -1.90 -0.91 -1.51 0.00 0.00 179.97 175.96 2e7k h ASN 75 N 0.27 0.39 -0.64 -3.80 2.35 -1.42 0.11 115.58 112.84 2e7k h ASN 75 Ca 0.06 -0.82 -0.77 0.00 -0.55 0.00 0.00 56.30 54.23 2e7k h ASN 75 Cb 0.18 -0.13 -0.02 0.00 0.05 0.00 0.00 38.32 38.41 2e7k h ASN 75 CO 0.00 1.72 1.16 0.00 -1.65 0.00 0.00 177.43 178.67 2e7k n ALA 76 N -2.91 0.04 -2.53 -0.83 0.00 -0.90 -4.59 120.51 108.80 2e7k n ALA 76 Ca -0.28 0.23 -0.24 0.00 0.00 0.00 0.00 53.44 53.15 2e7k n ALA 76 Cb 1.05 -2.17 -0.14 0.00 0.00 0.00 0.00 19.45 18.20 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 5.35 2.19 0.56 0.00 0.15 -1.26 -4.46 113.70 116.22 2e7k s SER 77 Ca 1.12 -0.47 0.00 0.00 0.70 0.00 0.00 55.95 57.30 2e7k s SER 77 Cb -1.31 -0.18 0.00 0.00 -1.71 0.00 0.00 66.02 62.82 2e7k s SER 77 CO 0.66 0.13 0.00 0.61 1.20 0.00 0.00 173.24 175.84 2e7k n GLY 78 N 1.98 0.47 3.55 9.45 0.00 -1.10 -4.70 105.19 114.85 2e7k n GLY 78 Ca -0.17 -0.93 -0.41 0.00 0.00 0.00 0.00 46.02 44.51 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 6.11 -0.12 1.61 1.04 -1.26 -3.96 113.70 113.12 2e7k s SER 79 Ca 0.00 -0.51 -0.04 0.00 0.48 0.00 0.00 55.95 55.89 2e7k s SER 79 Cb 0.00 -2.56 -0.03 0.00 0.10 0.00 0.00 66.02 63.53 2e7k s SER 79 CO 0.00 -1.86 0.01 -0.69 0.98 0.00 0.00 173.24 171.69 2e7k s VAL 80 N 5.99 4.40 0.02 5.02 1.01 -1.16 -4.97 120.40 130.71 2e7k s VAL 80 Ca 0.40 -0.20 0.04 0.00 0.00 0.00 0.00 61.98 62.22 2e7k s VAL 80 Cb -0.07 -2.90 -0.03 0.00 0.00 0.00 0.00 36.38 33.37 2e7k s VAL 80 CO 0.12 0.56 -0.09 -0.63 0.00 0.00 0.00 175.10 175.05 2e7k s ILE 81 N -0.39 3.43 -0.19 2.22 -1.09 -1.26 -2.52 121.20 121.40 2e7k s ILE 81 Ca 0.08 -0.89 -0.01 0.00 -2.23 0.00 0.00 60.65 57.59 2e7k s ILE 81 Cb -0.12 -2.49 0.05 0.00 -1.58 0.00 0.00 42.46 38.32 2e7k s ILE 81 CO 0.02 0.37 -0.01 -0.76 -1.23 0.00 0.00 174.94 173.33 2e7k s LEU 82 N -1.46 1.64 -0.64 2.97 1.43 -0.92 -2.54 118.68 119.17 2e7k s LEU 82 Ca 0.17 -0.86 -0.24 0.00 -1.03 0.00 0.00 54.13 52.17 2e7k s LEU 82 Cb -0.11 -0.82 0.05 0.00 0.03 0.00 0.00 46.19 45.34 2e7k s LEU 82 CO 0.07 -0.26 1.02 -0.75 0.23 0.00 0.00 176.35 176.66 2e7k s LYS 83 N 1.68 3.19 0.22 1.70 2.20 -0.29 -2.22 119.74 126.23 2e7k s LYS 83 Ca -0.02 -0.55 0.06 0.00 -0.36 0.00 0.00 55.97 55.10 2e7k s LYS 83 Cb -0.17 -4.17 -0.04 0.00 -1.51 0.00 0.00 37.83 31.95 2e7k s LYS 83 CO -0.07 -1.78 0.17 0.42 -0.36 0.00 0.00 175.35 173.74 2e7k s ILE 84 N 4.33 4.46 0.03 5.43 -1.09 -1.21 -1.65 121.20 131.50 2e7k s ILE 84 Ca 0.27 -1.30 -0.07 0.00 -2.23 0.00 0.00 60.65 57.33 2e7k s ILE 84 Cb -0.14 -3.36 -0.01 0.00 -1.58 0.00 0.00 42.46 37.37 2e7k s ILE 84 CO 0.14 -0.27 0.12 -0.76 -1.23 0.00 0.00 174.94 172.95 2e7k s LEU 85 N -3.58 1.66 -0.06 2.97 1.02 0.19 -1.24 118.68 119.64 2e7k s LEU 85 Ca 0.32 -0.41 -0.21 0.00 0.02 0.00 0.00 54.13 53.85 2e7k s LEU 85 Cb -0.09 0.68 -0.31 0.00 0.02 0.00 0.00 46.19 46.50 2e7k s LEU 85 CO 0.24 -0.48 0.85 0.77 0.02 0.00 0.00 176.35 177.76 2e7k h SER 86 N 3.80 0.45 0.00 2.29 4.64 -1.95 -2.88 113.55 119.91 2e7k h SER 86 Ca -0.32 -0.94 0.00 0.00 -0.47 0.00 0.00 61.79 60.06 2e7k h SER 86 Cb 1.19 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 63.13 2e7k h SER 86 CO 0.47 1.42 0.00 0.61 -0.87 0.00 0.00 176.83 178.46 2e7k n GLY 87 N 1.68 -1.44 0.00 -0.77 0.00 -1.26 -4.17 105.19 99.22 2e7k n GLY 87 Ca -0.15 -1.75 0.08 0.00 0.00 0.00 0.00 46.02 44.20 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 0.35 -4.16 1.61 -0.04 -1.26 -4.86 135.00 126.64 2e7k n PRO 88 Ca 0.00 0.07 -0.33 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 -1.13 -0.04 0.00 0.00 175.50 174.33 2e7k n SER 89 N -1.14 -2.11 -4.81 3.54 3.41 -1.26 -4.91 113.62 106.35 2e7k n SER 89 Ca 0.09 -1.03 -0.33 0.00 -0.26 0.00 0.00 58.87 57.34 2e7k n SER 89 Cb 0.08 -2.74 0.01 0.00 -0.26 0.00 0.00 64.21 61.31 2e7k n SER 89 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2e7k s SER 90 N -3.68 5.81 0.00 4.04 1.04 -1.26 -5.26 113.70 114.39 2e7k s SER 90 Ca 0.48 1.80 0.00 0.00 0.48 0.00 0.00 55.95 58.71 2e7k s SER 90 Cb -0.26 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.33 2e7k s SER 90 CO 0.92 -1.15 0.00 0.61 0.98 0.00 0.00 173.24 174.61