#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2e7k s SER 2 N 0.00 6.96 -0.07 1.61 0.01 -1.26 -4.98 113.70 115.97 2e7k s SER 2 Ca 0.00 -2.95 -0.28 0.00 1.31 0.00 0.00 55.95 54.03 2e7k s SER 2 Cb 0.00 -2.24 0.06 0.00 0.21 0.00 0.00 66.02 64.05 2e7k s SER 2 CO 0.00 -0.54 0.63 -0.44 0.41 0.00 0.00 173.24 173.31 2e7k s SER 3 N 2.07 -0.61 -1.29 2.44 0.01 -1.26 -5.08 113.70 109.98 2e7k s SER 3 Ca 0.25 0.73 -0.11 0.00 1.31 0.00 0.00 55.95 58.13 2e7k s SER 3 Cb -0.09 0.63 0.15 0.00 0.21 0.00 0.00 66.02 66.92 2e7k s SER 3 CO -0.08 -0.54 1.81 0.61 0.41 0.00 0.00 173.24 175.45 2e7k n GLY 4 N 1.22 4.27 3.82 3.44 0.00 -1.26 -4.98 105.19 111.69 2e7k n GLY 4 Ca -0.19 -1.97 -0.35 0.00 0.00 0.00 0.00 46.02 43.51 2e7k n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2e7k s SER 5 N 1.82 7.00 0.76 1.61 0.01 -1.26 -5.07 113.70 118.57 2e7k s SER 5 Ca 0.42 1.39 -0.12 0.00 1.31 0.00 0.00 55.95 58.96 2e7k s SER 5 Cb 0.07 -2.41 0.05 0.00 0.21 0.00 0.00 66.02 63.94 2e7k s SER 5 CO -0.00 -0.02 1.11 -0.94 0.41 0.00 0.00 173.24 173.80 2e7k s SER 6 N -1.78 4.87 0.00 2.44 1.04 -1.26 -5.02 113.70 113.99 2e7k s SER 6 Ca 0.45 1.12 0.00 0.00 0.48 0.00 0.00 55.95 58.00 2e7k s SER 6 Cb -0.15 -1.84 0.00 0.00 0.10 0.00 0.00 66.02 64.13 2e7k s SER 6 CO 0.20 -1.71 0.00 0.61 0.98 0.00 0.00 173.24 173.33 2e7k n GLY 7 N -2.72 2.62 2.90 7.32 0.00 -1.26 -4.99 105.19 109.07 2e7k n GLY 7 Ca 0.07 -1.85 -0.23 0.00 0.00 0.00 0.00 46.02 44.01 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 -1.77 1.09 -0.28 1.61 3.52 0.09 -4.92 118.95 118.29 2e7k s ARG 8 Ca 0.00 -0.16 -0.10 0.00 -0.13 0.00 0.00 55.73 55.34 2e7k s ARG 8 Cb 0.00 -1.10 -0.04 0.00 -1.56 0.00 0.00 34.95 32.25 2e7k s ARG 8 CO 0.00 -0.12 0.17 -1.64 -0.81 0.00 0.00 175.30 172.89 2e7k s MET 9 N 1.16 3.82 -0.31 5.12 -1.94 -1.25 -0.49 119.30 125.41 2e7k s MET 9 Ca -0.07 -0.40 -0.05 0.00 -1.71 0.00 0.00 55.69 53.47 2e7k s MET 9 Cb -0.14 -3.60 0.03 0.00 2.01 0.00 0.00 34.83 33.13 2e7k s MET 9 CO -0.01 -0.22 0.05 0.08 -0.01 0.00 0.00 175.02 174.91 2e7k s VAL 10 N 1.72 3.55 0.06 -6.03 1.01 -0.79 -4.90 120.40 115.03 2e7k s VAL 10 Ca 0.07 -1.05 -0.16 0.00 0.00 0.00 0.00 61.98 60.84 2e7k s VAL 10 Cb -0.16 -2.94 -0.06 0.00 0.00 0.00 0.00 36.38 33.22 2e7k s VAL 10 CO 0.09 -0.04 0.49 -0.83 0.00 0.00 0.00 175.10 174.81 2e7k s GLY 11 N 1.39 2.53 -0.05 4.51 0.00 -1.26 -2.19 107.32 112.25 2e7k s GLY 11 Ca -0.01 -0.13 -0.04 0.00 0.00 0.00 0.00 44.72 44.55 2e7k s GLY 11 CO 0.01 0.23 0.12 -0.42 0.00 0.00 0.00 173.10 173.03 2e7k s ILE 12 N -1.21 -0.01 -0.57 0.90 1.01 -0.06 -4.95 121.20 116.31 2e7k s ILE 12 Ca 0.29 0.05 0.01 0.00 0.00 0.00 0.00 60.65 61.00 2e7k s ILE 12 Cb -0.17 -0.18 0.53 0.00 0.01 0.00 0.00 42.46 42.65 2e7k s ILE 12 CO 0.17 0.02 1.96 -2.11 0.00 0.00 0.00 174.94 174.98 2e7k n ARG 13 N 3.33 2.53 -0.68 2.79 1.85 -1.26 -0.07 116.66 125.15 2e7k n ARG 13 Ca -0.16 -3.21 -0.31 0.00 -1.00 0.00 0.00 57.85 53.17 2e7k n ARG 13 Cb 0.57 -2.24 0.17 0.00 -1.05 0.00 0.00 32.46 29.91 2e7k n ARG 13 CO 0.00 0.00 0.00 0.36 -0.01 0.00 0.00 177.63 177.98 2e7k n LYS 14 N -1.00 -0.83 -4.09 2.89 2.85 -1.26 -4.85 118.16 111.87 2e7k n LYS 14 Ca 0.61 -0.19 -0.30 0.00 -1.05 0.00 0.00 58.31 57.37 2e7k n LYS 14 Cb 1.04 -2.09 -0.07 0.00 -0.65 0.00 0.00 35.03 33.26 2e7k n LYS 14 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 177.40 178.34 2e7k s THR 15 N -2.48 4.32 -0.15 0.58 2.01 -1.26 -3.41 115.64 115.25 2e7k s THR 15 Ca 0.63 -0.85 -0.33 0.00 0.31 0.00 0.00 61.69 61.45 2e7k s THR 15 Cb -0.22 -3.07 -0.10 0.00 0.01 0.00 0.00 72.50 69.13 2e7k s THR 15 CO 0.63 0.13 2.02 0.00 -0.69 0.00 0.00 174.62 176.72 2e7k n ALA 16 N 0.54 1.18 0.00 7.40 0.00 -1.26 -3.44 120.51 124.93 2e7k n ALA 16 Ca -0.10 0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.45 2e7k n ALA 16 Cb 0.52 -2.62 0.00 0.00 0.00 0.00 0.00 19.45 17.35 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 5.09 0.69 3.43 0.00 0.00 -1.13 -5.08 105.19 108.19 2e7k n GLY 17 Ca 0.27 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.07 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 0.61 1.76 -0.11 1.61 0.41 -1.22 -5.11 118.70 116.65 2e7k s GLU 18 Ca 0.00 -2.04 -0.09 0.00 -0.41 0.00 0.00 54.97 52.44 2e7k s GLU 18 Cb 0.00 -0.40 0.03 0.00 -1.78 0.00 0.00 34.13 31.98 2e7k s GLU 18 CO 0.00 -0.44 0.28 -1.01 -0.49 0.00 0.00 175.26 173.60 2e7k s HIS 19 N -3.38 -0.33 -0.15 1.61 3.76 -1.26 -4.23 115.29 111.31 2e7k s HIS 19 Ca 0.31 0.79 -0.11 0.00 -0.15 0.00 0.00 55.06 55.90 2e7k s HIS 19 Cb 0.04 0.10 -0.08 0.00 1.11 0.00 0.00 32.58 33.76 2e7k s HIS 19 CO 0.16 -0.18 0.02 -0.07 -0.85 0.00 0.00 174.74 173.82 2e7k h LEU 20 N 6.12 0.00 0.00 0.89 4.07 -1.97 -3.40 115.31 121.02 2e7k h LEU 20 Ca -0.30 -0.19 0.00 0.00 0.08 0.00 0.00 57.88 57.48 2e7k h LEU 20 Cb 1.18 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.92 2e7k h LEU 20 CO 0.34 0.87 0.00 0.61 -1.08 0.00 0.00 178.44 179.18 2e7k n GLY 21 N 1.61 0.78 3.19 0.83 0.00 -1.26 -3.34 105.19 107.00 2e7k n GLY 21 Ca -0.11 -0.72 -0.09 0.00 0.00 0.00 0.00 46.02 45.10 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 -1.39 0.13 -0.18 1.61 -7.23 -1.26 -1.59 120.40 110.49 2e7k s VAL 22 Ca 0.00 -1.07 0.01 0.00 -1.81 0.00 0.00 61.98 59.11 2e7k s VAL 22 Cb 0.00 -1.13 0.03 0.00 0.56 0.00 0.00 36.38 35.84 2e7k s VAL 22 CO 0.00 -0.59 -0.12 0.42 -0.31 0.00 0.00 175.10 174.50 2e7k s THR 23 N -3.23 1.64 0.07 5.32 -4.23 0.68 -4.94 115.64 110.95 2e7k s THR 23 Ca 0.00 -0.88 -0.02 0.00 -1.18 0.00 0.00 61.69 59.61 2e7k s THR 23 Cb 0.02 -1.64 -0.05 0.00 1.34 0.00 0.00 72.50 72.17 2e7k s THR 23 CO -0.07 0.29 0.26 -0.36 -0.54 0.00 0.00 174.62 174.19 2e7k s PHE 24 N 1.42 3.52 -0.11 3.99 0.08 -1.26 0.18 117.98 125.80 2e7k s PHE 24 Ca 0.01 0.39 0.01 0.00 0.12 0.00 0.00 56.93 57.46 2e7k s PHE 24 Cb -0.15 -1.86 0.02 0.00 -0.57 0.00 0.00 43.02 40.45 2e7k s PHE 24 CO -0.09 0.56 -0.13 -0.98 -0.10 0.00 0.00 175.22 174.47 2e7k s ARG 25 N -2.39 2.02 -0.63 0.44 1.70 -0.54 -4.76 118.95 114.78 2e7k s ARG 25 Ca 0.35 -0.48 -0.19 0.00 -0.47 0.00 0.00 55.73 54.93 2e7k s ARG 25 Cb -0.13 -1.78 0.10 0.00 -0.57 0.00 0.00 34.95 32.58 2e7k s ARG 25 CO 0.25 -0.10 0.78 0.54 -1.08 0.00 0.00 175.30 175.68 2e7k s VAL 26 N 1.11 4.75 -0.08 4.99 0.11 -1.26 -3.06 120.40 126.95 2e7k s VAL 26 Ca -0.05 -0.96 -0.03 0.00 -2.93 0.00 0.00 61.98 58.01 2e7k s VAL 26 Cb -0.14 -4.54 -0.01 0.00 -1.53 0.00 0.00 36.38 30.15 2e7k s VAL 26 CO -0.03 -1.20 0.11 -0.33 -3.33 0.00 0.00 175.10 170.32 2e7k h GLU 27 N 9.19 -0.09 0.00 1.54 5.08 -1.97 -3.48 114.58 124.85 2e7k h GLU 27 Ca -0.26 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.11 2e7k h GLU 27 Cb 1.08 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.35 2e7k h GLU 27 CO 1.11 -0.06 0.00 0.41 -1.00 0.00 0.00 179.01 179.46 2e7k n GLY 28 N 1.54 0.28 0.35 -3.84 0.00 -1.26 -4.99 105.19 97.26 2e7k n GLY 28 Ca -0.01 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.04 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 4.07 1.71 3.24 -0.02 0.00 -1.26 -5.08 105.19 107.85 2e7k n GLY 29 Ca 0.00 -0.34 -0.13 0.00 0.00 0.00 0.00 46.02 45.55 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 -0.87 1.08 -0.32 1.61 -1.05 -1.26 -4.95 118.70 112.94 2e7k s GLU 30 Ca 0.09 -1.50 -0.03 0.00 -0.15 0.00 0.00 54.97 53.39 2e7k s GLU 30 Cb 0.08 -0.33 0.06 0.00 -0.44 0.00 0.00 34.13 33.50 2e7k s GLU 30 CO 0.01 -0.08 0.04 -0.51 0.95 0.00 0.00 175.26 175.67 2e7k s LEU 31 N -3.16 4.14 -0.13 1.83 1.43 -1.26 -3.92 118.68 117.60 2e7k s LEU 31 Ca 0.21 -1.35 -0.03 0.00 -1.03 0.00 0.00 54.13 51.93 2e7k s LEU 31 Cb 0.05 -1.75 -0.03 0.00 0.03 0.00 0.00 46.19 44.49 2e7k s LEU 31 CO 0.03 -0.31 -0.01 -0.69 0.23 0.00 0.00 176.35 175.60 2e7k s VAL 32 N 1.26 4.18 -0.39 -1.59 1.01 -1.17 -2.31 120.40 121.38 2e7k s VAL 32 Ca -0.03 -0.27 -0.27 0.00 0.00 0.00 0.00 61.98 61.41 2e7k s VAL 32 Cb -0.20 -2.81 -0.07 0.00 0.00 0.00 0.00 36.38 33.30 2e7k s VAL 32 CO -0.01 0.53 2.35 -0.38 0.00 0.00 0.00 175.10 177.59 2e7k n ILE 33 N 2.98 0.08 0.36 2.22 5.41 0.11 -1.47 119.36 129.05 2e7k n ILE 33 Ca -0.18 -0.64 -0.15 0.00 1.00 0.00 0.00 62.75 62.78 2e7k n ILE 33 Cb 0.53 -2.64 -0.07 0.00 -0.71 0.00 0.00 39.64 36.75 2e7k n ILE 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2e7k h ALA 34 N 17.56 -0.94 -2.51 -1.39 0.00 0.16 -2.18 119.26 129.97 2e7k h ALA 34 Ca -0.30 -0.21 -0.12 0.00 0.00 0.00 0.00 54.91 54.28 2e7k h ALA 34 Cb 1.26 0.36 -0.14 0.00 0.00 0.00 0.00 17.79 19.28 2e7k h ALA 34 CO 1.08 -0.88 -0.45 0.50 0.00 0.00 0.00 179.25 179.51 2e7k s ARG 35 N -4.65 0.95 -0.28 0.00 3.52 -0.69 -4.75 118.95 113.05 2e7k s ARG 35 Ca -0.14 -1.17 0.01 0.00 -0.13 0.00 0.00 55.73 54.29 2e7k s ARG 35 Cb 0.01 0.32 0.08 0.00 -1.56 0.00 0.00 34.95 33.81 2e7k s ARG 35 CO 0.42 -0.31 0.03 0.42 -0.81 0.00 0.00 175.30 175.06 2e7k s ILE 36 N -3.95 1.35 0.16 4.11 1.01 -1.26 -0.23 121.20 122.38 2e7k s ILE 36 Ca 0.14 -1.46 -0.34 0.00 0.00 0.00 0.00 60.65 58.99 2e7k s ILE 36 Cb 0.05 -1.86 -0.14 0.00 0.01 0.00 0.00 42.46 40.52 2e7k s ILE 36 CO -0.04 -0.43 1.50 0.18 0.00 0.00 0.00 174.94 176.15 2e7k n LEU 37 N 4.69 2.79 -4.75 2.97 4.32 -0.62 -4.90 117.00 121.50 2e7k n LEU 37 Ca -0.05 1.10 -0.41 0.00 -0.02 0.00 0.00 56.01 56.63 2e7k n LEU 37 Cb 0.43 -1.38 -0.02 0.00 -1.62 0.00 0.00 43.42 40.83 2e7k n LEU 37 CO 0.16 -0.48 1.07 -2.28 -1.22 0.00 0.00 177.39 174.64 2e7k s HIS 38 N 0.67 3.02 0.00 -1.77 5.65 -1.26 -4.07 115.29 117.54 2e7k s HIS 38 Ca 0.78 1.14 0.00 0.00 0.25 0.00 0.00 55.06 57.23 2e7k s HIS 38 Cb -0.73 -3.78 0.00 0.00 -1.18 0.00 0.00 32.58 26.89 2e7k s HIS 38 CO 0.41 -2.43 0.00 0.41 -0.65 0.00 0.00 174.74 172.48 2e7k n GLY 39 N 1.78 0.63 3.49 1.59 0.00 -1.26 -5.11 105.19 106.30 2e7k n GLY 39 Ca 0.05 -0.32 -0.09 0.00 0.00 0.00 0.00 46.02 45.65 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 -1.87 0.26 0.00 -0.02 0.00 -1.26 -4.98 107.32 99.45 2e7k s GLY 40 Ca 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 44.72 44.10 2e7k s GLY 40 CO 0.00 -0.54 0.79 -0.13 0.00 0.00 0.00 173.10 173.22 2e7k n MET 41 N -0.31 0.00 -0.23 2.90 0.00 -1.21 -0.94 117.12 117.32 2e7k n MET 41 Ca -0.07 0.79 0.03 0.00 -0.00 0.00 0.00 57.70 58.45 2e7k n MET 41 Cb 0.62 -1.29 0.12 0.00 0.00 0.00 0.00 33.22 32.67 2e7k n MET 41 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 175.97 175.73 2e7k h VAL 42 N 0.00 0.39 -1.11 1.12 3.04 -1.88 0.44 116.25 118.24 2e7k h VAL 42 Ca 0.00 -0.03 0.32 0.00 -1.01 0.00 0.00 66.70 65.98 2e7k h VAL 42 Cb 0.00 0.30 -0.05 0.00 -2.01 0.00 0.00 31.29 29.52 2e7k h VAL 42 CO 0.00 0.02 0.79 0.00 -1.01 0.00 0.00 177.57 177.36 2e7k h ALA 43 N 1.65 2.94 0.16 3.17 0.00 -1.46 0.22 119.26 125.94 2e7k h ALA 43 Ca 0.36 -0.02 -0.30 0.00 0.00 0.00 0.00 54.91 54.95 2e7k h ALA 43 Cb 0.61 0.08 0.03 0.00 0.00 0.00 0.00 17.79 18.51 2e7k h ALA 43 CO -0.62 -1.27 -1.26 1.96 0.00 0.00 0.00 179.25 178.06 2e7k h GLN 44 N 0.06 0.56 -6.73 0.00 4.20 0.17 -3.46 115.11 109.91 2e7k h GLN 44 Ca 0.54 -0.83 -0.49 0.00 0.06 0.00 0.00 58.65 57.94 2e7k h GLN 44 Cb 2.05 0.29 -0.03 0.00 0.30 0.00 0.00 27.48 30.09 2e7k h GLN 44 CO -0.05 1.38 0.12 -0.65 -0.67 0.00 0.00 178.83 178.96 2e7k s GLN 45 N -2.81 4.06 -0.38 1.46 -0.21 0.78 -4.99 119.66 117.57 2e7k s GLN 45 Ca -0.10 0.74 0.07 0.00 0.02 0.00 0.00 55.36 56.09 2e7k s GLN 45 Cb 0.04 -2.48 0.64 0.00 1.00 0.00 0.00 33.01 32.22 2e7k s GLN 45 CO 0.92 0.18 1.78 0.41 -2.12 0.00 0.00 175.29 176.46 2e7k n GLY 46 N -0.22 4.42 0.09 3.09 0.00 -1.26 -4.51 105.19 106.80 2e7k n GLY 46 Ca 0.03 -1.10 -0.17 0.00 0.00 0.00 0.00 46.02 44.78 2e7k n GLY 46 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2e7k h LEU 47 N 1.34 0.00-10.11 0.99 3.38 -1.94 -3.47 115.31 105.50 2e7k h LEU 47 Ca 0.45 -0.45 -0.52 0.00 0.09 0.00 0.00 57.88 57.46 2e7k h LEU 47 Cb 2.45 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 43.20 2e7k h LEU 47 CO 0.85 1.27 -0.13 -0.76 0.09 0.00 0.00 178.44 179.76 2e7k s LEU 48 N -8.00 4.05 0.15 1.67 1.43 -1.26 -5.10 118.68 111.62 2e7k s LEU 48 Ca -0.24 0.73 -0.24 0.00 -1.03 0.00 0.00 54.13 53.34 2e7k s LEU 48 Cb 0.04 -3.55 0.06 0.00 0.03 0.00 0.00 46.19 42.77 2e7k s LEU 48 CO 0.51 -0.21 0.80 -1.38 0.23 0.00 0.00 176.35 176.31 2e7k s HIS 49 N -2.10 -0.29 -0.16 0.29 -3.43 -1.26 -4.97 115.29 103.37 2e7k s HIS 49 Ca 0.44 0.01 -0.39 0.00 -0.80 0.00 0.00 55.06 54.32 2e7k s HIS 49 Cb -0.11 0.61 -0.16 0.00 -1.43 0.00 0.00 32.58 31.50 2e7k s HIS 49 CO 0.30 -0.86 1.61 0.28 -2.00 0.00 0.00 174.74 174.06 2e7k n VAL 50 N -0.39 0.21 0.00 -5.38 0.31 -1.26 -1.36 118.33 110.45 2e7k n VAL 50 Ca -0.09 -0.04 0.00 0.00 -0.01 0.00 0.00 64.34 64.21 2e7k n VAL 50 Cb 0.62 -1.09 0.00 0.00 -0.91 0.00 0.00 33.84 32.46 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 3.63 1.87 3.72 2.92 0.00 -0.82 -5.01 105.19 111.51 2e7k n GLY 51 Ca 0.24 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.83 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 3.53 -4.36 1.61 9.92 -0.47 -4.63 116.55 122.15 2e7k n ASP 52 Ca 0.00 1.15 -0.34 0.00 -0.53 0.00 0.00 54.79 55.07 2e7k n ASP 52 Cb 0.00 -1.55 -0.14 0.00 -0.64 0.00 0.00 41.12 38.80 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 -0.06 3.28 -0.04 0.53 1.01 -1.12 -0.71 121.20 124.09 2e7k s ILE 53 Ca 0.65 -0.56 -0.13 0.00 0.00 0.00 0.00 60.65 60.61 2e7k s ILE 53 Cb -0.54 -2.43 -0.05 0.00 0.01 0.00 0.00 42.46 39.45 2e7k s ILE 53 CO 0.49 0.48 0.33 -0.63 0.00 0.00 0.00 174.94 175.62 2e7k s ILE 54 N 0.77 5.17 0.01 2.92 1.01 -0.98 -0.20 121.20 129.90 2e7k s ILE 54 Ca -0.03 0.66 -0.06 0.00 0.00 0.00 0.00 60.65 61.22 2e7k s ILE 54 Cb -0.15 -3.63 -0.02 0.00 0.01 0.00 0.00 42.46 38.67 2e7k s ILE 54 CO 0.01 0.58 -0.11 1.17 0.00 0.00 0.00 174.94 176.59 2e7k n LYS 55 N 1.99 0.17 -3.98 2.79 3.00 -0.56 -4.42 118.16 117.15 2e7k n LYS 55 Ca -0.15 0.07 -0.10 0.00 -0.00 0.00 0.00 58.31 58.12 2e7k n LYS 55 Cb 0.53 -0.80 -0.12 0.00 0.00 0.00 0.00 35.03 34.64 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 -2.28 0.30 -0.12 1.64 -6.30 -1.26 -4.29 118.70 106.39 2e7k s GLU 56 Ca -0.09 -0.52 0.02 0.00 -2.50 0.00 0.00 54.97 51.88 2e7k s GLU 56 Cb 0.01 0.01 0.01 0.00 0.00 0.00 0.00 34.13 34.16 2e7k s GLU 56 CO 0.14 -0.02 -0.19 0.08 0.02 0.00 0.00 175.26 175.29 2e7k s VAL 57 N -1.16 1.80 -1.57 3.70 1.01 0.47 -1.93 120.40 122.72 2e7k s VAL 57 Ca -0.12 -0.83 -0.16 0.00 0.00 0.00 0.00 61.98 60.87 2e7k s VAL 57 Cb -0.08 -1.61 0.16 0.00 0.00 0.00 0.00 36.38 34.85 2e7k s VAL 57 CO -0.01 0.50 0.40 -0.46 0.00 0.00 0.00 175.10 175.53 2e7k n ASN 58 N 4.08 -1.02 -2.05 3.32 0.23 -0.98 0.19 115.26 119.04 2e7k n ASN 58 Ca -0.20 -1.09 -0.12 0.00 -0.53 0.00 0.00 54.58 52.64 2e7k n ASN 58 Cb 0.52 -1.39 0.04 0.00 -2.08 0.00 0.00 39.78 36.87 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 -1.32 0.15 3.06 4.83 0.00 -1.26 -5.00 105.19 105.65 2e7k n GLY 59 Ca 0.01 -0.21 -0.13 0.00 0.00 0.00 0.00 46.02 45.70 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 -5.60 0.21 0.20 1.61 0.74 0.52 -5.14 119.66 112.20 2e7k s GLN 60 Ca 0.28 0.28 -0.30 0.00 0.05 0.00 0.00 55.36 55.67 2e7k s GLN 60 Cb -0.12 0.08 -0.09 0.00 1.10 0.00 0.00 33.01 33.98 2e7k s GLN 60 CO 0.35 -0.04 1.30 -1.25 -0.55 0.00 0.00 175.29 175.10 2e7k s PRO 61 N 0.20 4.40 0.10 1.67 0.04 -1.26 -0.39 135.00 139.75 2e7k s PRO 61 Ca -0.01 2.04 0.12 0.00 0.04 0.00 0.00 61.00 63.19 2e7k s PRO 61 Cb -0.02 -3.19 -0.15 0.00 0.04 0.00 0.00 34.50 31.18 2e7k s PRO 61 CO -0.00 -0.23 1.08 -0.39 0.04 0.00 0.00 177.00 177.49 2e7k h VAL 62 N 3.70 1.13 0.00 -0.36 -1.51 -1.95 -3.47 116.25 113.79 2e7k h VAL 62 Ca -0.45 -2.77 0.00 0.00 -1.23 0.00 0.00 66.70 62.25 2e7k h VAL 62 Cb 1.21 2.52 0.00 0.00 -2.13 0.00 0.00 31.29 32.90 2e7k h VAL 62 CO 0.76 0.64 0.00 0.61 -1.23 0.00 0.00 177.57 178.35 2e7k n GLY 63 N 1.39 -1.49 0.22 5.19 0.00 -1.26 -4.66 105.19 104.57 2e7k n GLY 63 Ca -0.06 -1.33 -0.19 0.00 0.00 0.00 0.00 46.02 44.45 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 0.02 1.96 -4.50 1.61 7.64 -1.26 -4.74 113.62 114.34 2e7k n SER 64 Ca 0.00 0.09 -0.46 0.00 1.01 0.00 0.00 58.87 59.51 2e7k n SER 64 Cb 0.00 -0.49 -0.06 0.00 -1.01 0.00 0.00 64.21 62.65 2e7k n SER 64 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2e7k n ASP 65 N -3.56 2.38 -0.11 6.43 2.03 -1.26 -4.72 116.55 117.74 2e7k n ASP 65 Ca -0.40 0.22 -0.13 0.00 0.52 0.00 0.00 54.79 55.00 2e7k n ASP 65 Cb 0.84 -1.37 -0.03 0.00 -0.72 0.00 0.00 41.12 39.84 2e7k n ASP 65 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 2e7k h PRO 66 N 14.10 0.84 -0.15 -0.67 0.13 -1.91 -2.90 132.00 141.44 2e7k h PRO 66 Ca -0.29 -0.44 -0.00 0.00 -0.87 0.00 0.00 66.00 64.39 2e7k h PRO 66 Cb 1.29 0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.43 2e7k h PRO 66 CO 1.04 1.08 0.08 0.00 -0.23 0.00 0.00 178.00 179.97 2e7k h ARG 67 N 0.63 0.20 0.00 0.86 3.08 -1.89 -0.37 114.38 116.88 2e7k h ARG 67 Ca 0.05 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.08 2e7k h ARG 67 Cb 0.93 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.93 2e7k h ARG 67 CO 0.08 0.15 -0.03 0.00 -1.07 0.00 0.00 179.97 179.10 2e7k h ALA 68 N 1.89 0.98 0.05 0.04 0.00 -1.93 -3.31 119.26 116.99 2e7k h ALA 68 Ca 0.05 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 2e7k h ALA 68 Cb 0.01 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2e7k h ALA 68 CO -0.01 0.04 -0.02 1.25 0.00 0.00 0.00 179.25 180.51 2e7k h LEU 69 N 0.00 -0.06 -1.58 0.00 5.85 -0.88 -3.00 115.31 115.64 2e7k h LEU 69 Ca -0.00 -0.45 0.05 0.00 0.84 0.00 0.00 57.88 58.32 2e7k h LEU 69 Cb 0.99 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 42.03 2e7k h LEU 69 CO 0.00 0.64 0.54 1.56 -0.34 0.00 0.00 178.44 180.84 2e7k h GLN 70 N -0.97 0.00 0.07 1.25 4.20 -1.51 0.63 115.11 118.77 2e7k h GLN 70 Ca -0.01 0.00 -0.29 0.00 0.06 0.00 0.00 58.65 58.41 2e7k h GLN 70 Cb 0.50 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.26 2e7k h GLN 70 CO 0.01 0.00 -1.54 1.49 -0.67 0.00 0.00 178.83 178.12 2e7k h GLU 71 N 0.00 0.15 -0.96 1.46 4.57 -1.64 -3.32 114.58 114.85 2e7k h GLU 71 Ca 0.08 -0.25 0.05 0.00 -1.18 0.00 0.00 59.36 58.05 2e7k h GLU 71 Cb 1.15 0.09 -0.06 0.00 -0.16 0.00 0.00 28.75 29.77 2e7k h GLU 71 CO -0.00 0.94 0.62 1.37 -1.18 0.00 0.00 179.01 180.77 2e7k h LEU 72 N 0.04 1.01 -0.43 1.64 8.10 0.42 -2.20 115.31 123.89 2e7k h LEU 72 Ca -0.23 -0.00 -0.05 0.00 0.11 0.00 0.00 57.88 57.70 2e7k h LEU 72 Cb 1.98 -0.22 -0.02 0.00 -0.44 0.00 0.00 40.66 41.96 2e7k h LEU 72 CO 0.13 0.67 0.08 -0.07 -4.11 0.00 0.00 178.44 175.13 2e7k h LEU 73 N 1.15 0.68 -0.33 0.17 3.38 -1.64 0.79 115.31 119.51 2e7k h LEU 73 Ca 0.40 -0.25 0.07 0.00 0.09 0.00 0.00 57.88 58.18 2e7k h LEU 73 Cb 0.10 -0.18 -0.08 0.00 0.09 0.00 0.00 40.66 40.59 2e7k h LEU 73 CO -0.14 0.76 -0.28 -0.09 0.09 0.00 0.00 178.44 178.78 2e7k h ARG 74 N 0.57 -0.24 -0.21 1.13 2.43 -1.49 -2.28 114.38 114.28 2e7k h ARG 74 Ca 0.13 0.02 -0.13 0.00 -0.81 0.00 0.00 59.98 59.18 2e7k h ARG 74 Cb 0.36 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.97 2e7k h ARG 74 CO 0.01 -0.16 -0.39 -2.95 -1.51 0.00 0.00 179.97 174.97 2e7k h ASN 75 N -0.25 0.71 -0.96 -3.80 7.08 -1.46 -2.99 115.58 113.92 2e7k h ASN 75 Ca 0.16 -0.54 -0.80 0.00 -3.08 0.00 0.00 56.30 52.04 2e7k h ASN 75 Cb 0.50 -0.20 -0.00 0.00 -2.08 0.00 0.00 38.32 36.54 2e7k h ASN 75 CO -0.47 1.12 0.93 0.00 -2.08 0.00 0.00 177.43 176.93 2e7k n ALA 76 N -2.52 -0.53 -2.60 4.14 0.00 0.26 -4.66 120.51 114.61 2e7k n ALA 76 Ca -0.05 0.36 -0.29 0.00 0.00 0.00 0.00 53.44 53.45 2e7k n ALA 76 Cb 0.53 -2.08 -0.06 0.00 0.00 0.00 0.00 19.45 17.84 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 4.09 4.29 0.70 0.00 0.15 -1.26 -4.64 113.70 117.04 2e7k s SER 77 Ca 1.07 -1.43 0.00 0.00 0.70 0.00 0.00 55.95 56.29 2e7k s SER 77 Cb -1.33 0.26 0.00 0.00 -1.71 0.00 0.00 66.02 63.23 2e7k s SER 77 CO 0.72 -0.84 0.00 0.61 1.20 0.00 0.00 173.24 174.93 2e7k n GLY 78 N -1.37 0.22 3.56 9.45 0.00 -1.22 -4.48 105.19 111.35 2e7k n GLY 78 Ca -0.10 -0.97 -0.39 0.00 0.00 0.00 0.00 46.02 44.56 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 5.28 -0.01 1.61 0.01 -1.25 -3.98 113.70 111.36 2e7k s SER 79 Ca 0.00 0.59 -0.16 0.00 1.31 0.00 0.00 55.95 57.69 2e7k s SER 79 Cb 0.00 -2.53 -0.06 0.00 0.21 0.00 0.00 66.02 63.65 2e7k s SER 79 CO 0.00 -2.32 0.45 -0.69 0.41 0.00 0.00 173.24 171.09 2e7k s VAL 80 N 9.08 5.00 0.05 3.43 1.01 0.90 -4.85 120.40 135.01 2e7k s VAL 80 Ca 0.73 0.94 0.08 0.00 0.00 0.00 0.00 61.98 63.72 2e7k s VAL 80 Cb -0.15 -3.77 -0.03 0.00 0.00 0.00 0.00 36.38 32.43 2e7k s VAL 80 CO 0.24 0.52 -0.19 -0.63 0.00 0.00 0.00 175.10 175.04 2e7k s ILE 81 N -0.75 2.70 -0.17 2.22 1.09 -1.26 -0.88 121.20 124.15 2e7k s ILE 81 Ca 0.25 -1.26 -0.03 0.00 -1.10 0.00 0.00 60.65 58.51 2e7k s ILE 81 Cb -0.17 -2.14 0.05 0.00 -1.06 0.00 0.00 42.46 39.15 2e7k s ILE 81 CO 0.14 0.31 0.04 -0.76 -0.10 0.00 0.00 174.94 174.57 2e7k s LEU 82 N -1.50 0.94 -0.55 2.97 1.43 -0.93 -2.31 118.68 118.74 2e7k s LEU 82 Ca 0.15 -0.65 -0.22 0.00 -1.03 0.00 0.00 54.13 52.37 2e7k s LEU 82 Cb -0.10 -0.51 0.05 0.00 0.03 0.00 0.00 46.19 45.66 2e7k s LEU 82 CO 0.05 -0.29 0.81 -0.75 0.23 0.00 0.00 176.35 176.40 2e7k s LYS 83 N 1.92 3.21 0.29 1.70 2.20 -0.81 -1.88 119.74 126.37 2e7k s LYS 83 Ca 0.01 -0.62 0.03 0.00 -0.36 0.00 0.00 55.97 55.03 2e7k s LYS 83 Cb -0.16 -4.10 -0.03 0.00 -1.51 0.00 0.00 37.83 32.03 2e7k s LYS 83 CO -0.08 -1.42 0.44 0.42 -0.36 0.00 0.00 175.35 174.35 2e7k s ILE 84 N 3.39 5.13 -0.02 5.43 -1.09 0.36 -1.50 121.20 132.89 2e7k s ILE 84 Ca 0.23 -0.78 -0.15 0.00 -2.23 0.00 0.00 60.65 57.71 2e7k s ILE 84 Cb -0.16 -3.83 0.02 0.00 -1.58 0.00 0.00 42.46 36.91 2e7k s ILE 84 CO 0.15 -0.41 0.32 -0.76 -1.23 0.00 0.00 174.94 173.01 2e7k s LEU 85 N -4.13 0.81 0.37 2.97 1.02 0.72 -0.74 118.68 119.70 2e7k s LEU 85 Ca 0.37 0.14 0.20 0.00 0.02 0.00 0.00 54.13 54.86 2e7k s LEU 85 Cb -0.09 1.29 0.52 0.00 0.02 0.00 0.00 46.19 47.92 2e7k s LEU 85 CO 0.32 -0.43 1.65 0.77 0.02 0.00 0.00 176.35 178.68 2e7k h SER 86 N 3.98 0.00 0.00 2.29 4.64 -1.93 -2.96 113.55 119.56 2e7k h SER 86 Ca -0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 2e7k h SER 86 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 2e7k h SER 86 CO 0.39 0.34 0.00 0.61 -0.87 0.00 0.00 176.83 177.30 2e7k n GLY 87 N 0.64 -0.87 3.66 -0.77 0.00 -1.26 -4.90 105.19 101.70 2e7k n GLY 87 Ca 0.01 -1.18 -0.29 0.00 0.00 0.00 0.00 46.02 44.56 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 0.00 0.19 0.07 1.61 0.04 -1.26 -4.98 135.00 130.67 2e7k s PRO 88 Ca 0.00 0.44 -0.28 0.00 0.04 0.00 0.00 61.00 61.20 2e7k s PRO 88 Cb 0.00 -1.72 -0.17 0.00 0.04 0.00 0.00 34.50 32.65 2e7k s PRO 88 CO 0.00 -2.88 1.61 1.03 0.04 0.00 0.00 177.00 176.80 2e7k h SER 89 N -2.00 -0.39 -2.90 6.66 0.87 -2.06 -3.46 113.55 110.27 2e7k h SER 89 Ca -0.55 -0.02 0.09 0.00 -1.23 0.00 0.00 61.79 60.09 2e7k h SER 89 Cb 1.33 0.10 -0.28 0.00 -0.44 0.00 0.00 62.40 63.12 2e7k h SER 89 CO 0.56 -0.24 0.53 -0.55 -0.53 0.00 0.00 176.83 176.60 2e7k s SER 90 N -4.83 -0.38 0.00 6.23 0.15 -1.26 -5.24 113.70 108.37 2e7k s SER 90 Ca -0.15 0.71 0.00 0.00 0.70 0.00 0.00 55.95 57.21 2e7k s SER 90 Cb 0.04 0.79 0.00 0.00 -1.71 0.00 0.00 66.02 65.14 2e7k s SER 90 CO 0.63 -0.12 0.07 0.61 1.20 0.00 0.00 173.24 175.63