#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x7v n SER 2 N 0.00 0.00 -4.72 4.39 3.41 -1.26 -5.10 113.62 110.35 1x7v n SER 2 Ca 0.00 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.19 1x7v n SER 2 Cb 0.00 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 63.91 1x7v n SER 2 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1x7v s THR 3 N -0.07 4.56 0.68 6.66 2.01 -1.26 -5.01 115.64 123.22 1x7v s THR 3 Ca 0.00 1.96 -0.17 0.00 0.31 0.00 0.00 61.69 63.79 1x7v s THR 3 Cb 0.00 -4.25 -0.01 0.00 0.01 0.00 0.00 72.50 68.25 1x7v s THR 3 CO 0.00 0.22 1.04 -2.65 -0.69 0.00 0.00 174.62 172.54 1x7v n PRO 4 N 3.39 0.70 -2.53 4.92 -0.02 -1.26 -4.93 135.00 135.27 1x7v n PRO 4 Ca 0.05 0.29 -0.43 0.00 -2.02 0.00 0.00 63.50 61.39 1x7v n PRO 4 Cb 0.49 -2.28 -0.02 0.00 -0.02 0.00 0.00 33.50 31.67 1x7v n PRO 4 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1x7v s LEU 5 N -3.23 4.15 -0.04 2.45 2.96 -0.36 -4.47 118.68 120.14 1x7v s LEU 5 Ca 0.76 1.56 -0.14 0.00 -0.22 0.00 0.00 54.13 56.09 1x7v s LEU 5 Cb -0.37 -3.54 -0.05 0.00 0.50 0.00 0.00 46.19 42.73 1x7v s LEU 5 CO 0.47 -0.72 0.37 -0.89 -1.32 0.00 0.00 176.35 174.26 1x7v s THR 6 N 3.35 5.13 -0.04 3.68 2.01 0.82 -0.80 115.64 129.78 1x7v s THR 6 Ca 0.50 0.74 0.04 0.00 0.31 0.00 0.00 61.69 63.28 1x7v s THR 6 Cb -0.19 -3.67 -0.00 0.00 0.01 0.00 0.00 72.50 68.65 1x7v s THR 6 CO 0.11 0.55 -0.17 -0.76 -0.69 0.00 0.00 174.62 173.66 1x7v s LEU 7 N -0.82 1.91 -0.16 4.42 1.02 0.28 -0.59 118.68 124.75 1x7v s LEU 7 Ca 0.22 -0.35 0.01 0.00 0.02 0.00 0.00 54.13 54.03 1x7v s LEU 7 Cb -0.16 -0.97 0.02 0.00 0.02 0.00 0.00 46.19 45.10 1x7v s LEU 7 CO 0.11 0.15 -0.18 -0.63 0.02 0.00 0.00 176.35 175.82 1x7v s ILE 8 N 0.05 1.86 -0.25 -0.59 1.01 -0.45 -0.93 121.20 121.90 1x7v s ILE 8 Ca -0.04 -0.82 -0.07 0.00 0.00 0.00 0.00 60.65 59.72 1x7v s ILE 8 Cb -0.12 -1.70 -0.02 0.00 0.01 0.00 0.00 42.46 40.63 1x7v s ILE 8 CO 0.02 0.51 0.06 0.00 0.00 0.00 0.00 174.94 175.53 1x7v s ALA 9 N 1.33 3.11 -0.35 9.38 0.00 -1.26 -0.83 121.76 133.14 1x7v s ALA 9 Ca 0.04 -1.18 -0.11 0.00 0.00 0.00 0.00 51.96 50.72 1x7v s ALA 9 Cb -0.13 -2.04 0.01 0.00 0.00 0.00 0.00 23.12 20.96 1x7v s ALA 9 CO -0.11 -0.54 0.19 0.99 0.00 0.00 0.00 175.76 176.29 1x7v s THR 10 N 1.58 4.63 -0.16 0.00 2.01 -0.05 -4.16 115.64 119.49 1x7v s THR 10 Ca 0.06 -0.64 -0.01 0.00 0.31 0.00 0.00 61.69 61.40 1x7v s THR 10 Cb -0.15 -3.48 -0.01 0.00 0.01 0.00 0.00 72.50 68.86 1x7v s THR 10 CO 0.03 -0.10 -0.10 -0.63 -0.69 0.00 0.00 174.62 173.12 1x7v s ILE 11 N 1.59 3.16 -0.21 1.82 1.01 0.11 -0.96 121.20 127.72 1x7v s ILE 11 Ca 0.03 -0.61 -0.02 0.00 0.00 0.00 0.00 60.65 60.05 1x7v s ILE 11 Cb -0.18 -2.36 0.00 0.00 0.01 0.00 0.00 42.46 39.93 1x7v s ILE 11 CO 0.07 0.50 -0.09 -0.89 0.00 0.00 0.00 174.94 174.52 1x7v s THR 12 N 0.67 2.97 0.45 2.92 2.01 -0.33 -0.97 115.64 123.37 1x7v s THR 12 Ca -0.05 -0.63 -0.22 0.00 0.31 0.00 0.00 61.69 61.10 1x7v s THR 12 Cb -0.15 -2.33 -0.09 0.00 0.01 0.00 0.00 72.50 69.95 1x7v s THR 12 CO 0.02 0.46 1.05 0.00 -0.69 0.00 0.00 174.62 175.46 1x7v s ALA 13 N 1.42 2.96 0.48 7.40 0.00 0.12 -0.54 121.76 133.61 1x7v s ALA 13 Ca 0.06 0.65 -0.24 0.00 0.00 0.00 0.00 51.96 52.43 1x7v s ALA 13 Cb -0.14 -3.26 -0.07 0.00 0.00 0.00 0.00 23.12 19.64 1x7v s ALA 13 CO -0.06 -0.28 1.32 0.00 0.00 0.00 0.00 175.76 176.74 1x7v n ALA 14 N -0.59 1.51 -1.57 0.00 0.00 0.11 -4.50 120.51 115.46 1x7v n ALA 14 Ca 0.07 0.20 -0.53 0.00 0.00 0.00 0.00 53.44 53.18 1x7v n ALA 14 Cb 0.51 -2.32 -0.06 0.00 0.00 0.00 0.00 19.45 17.58 1x7v n ALA 14 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1x7v n PRO 15 N -0.43 0.94 0.00 0.00 -0.02 -1.26 -1.11 135.00 133.12 1x7v n PRO 15 Ca 0.08 0.34 0.00 0.00 -2.02 0.00 0.00 63.50 61.90 1x7v n PRO 15 Cb 0.42 -1.95 0.00 0.00 -0.02 0.00 0.00 33.50 31.96 1x7v n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1x7v n GLY 16 N 2.31 2.33 1.34 -1.23 0.00 -1.26 -4.92 105.19 103.76 1x7v n GLY 16 Ca 0.18 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.28 1x7v n GLY 16 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1x7v n HIS 17 N -2.00 1.44 -0.22 1.61 8.25 -0.26 -4.70 115.22 119.33 1x7v n HIS 17 Ca 0.00 -0.79 -0.05 0.00 -0.26 0.00 0.00 57.72 56.62 1x7v n HIS 17 Cb 0.00 -0.39 0.05 0.00 1.12 0.00 0.00 29.99 30.78 1x7v n HIS 17 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1x7v h ALA 18 N 2.84 0.81 -0.52 -1.41 0.00 -1.89 -1.75 119.26 117.35 1x7v h ALA 18 Ca 0.00 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.77 1x7v h ALA 18 Cb 1.65 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 19.20 1x7v h ALA 18 CO 0.33 0.18 -0.10 0.93 0.00 0.00 0.00 179.25 180.58 1x7v h GLU 19 N 0.80 0.96 -0.32 0.00 4.39 -1.91 -1.18 114.58 117.32 1x7v h GLU 19 Ca 0.24 -0.34 -0.05 0.00 0.34 0.00 0.00 59.36 59.55 1x7v h GLU 19 Cb -0.03 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.54 1x7v h GLU 19 CO -0.08 1.01 0.00 0.00 -1.16 0.00 0.00 179.01 178.78 1x7v h ALA 20 N 1.01 0.43 -0.58 3.43 0.00 -1.86 -2.25 119.26 119.45 1x7v h ALA 20 Ca 0.14 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 1x7v h ALA 20 Cb 0.65 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 1x7v h ALA 20 CO 0.04 0.19 0.20 1.25 0.00 0.00 0.00 179.25 180.94 1x7v h LEU 21 N 0.37 0.82 -0.64 0.00 5.85 -1.15 -2.23 115.31 118.33 1x7v h LEU 21 Ca 0.09 -0.19 0.06 0.00 0.84 0.00 0.00 57.88 58.68 1x7v h LEU 21 Cb 0.44 -0.21 -0.06 0.00 0.37 0.00 0.00 40.66 41.20 1x7v h LEU 21 CO 0.02 0.79 0.34 -0.08 -0.34 0.00 0.00 178.44 179.16 1x7v h GLU 22 N 0.81 0.60 -0.45 1.25 4.81 -1.18 0.18 114.58 120.60 1x7v h GLU 22 Ca 0.19 -0.04 0.06 0.00 -0.13 0.00 0.00 59.36 59.44 1x7v h GLU 22 Cb 0.25 -0.14 -0.05 0.00 0.63 0.00 0.00 28.75 29.44 1x7v h GLU 22 CO -0.01 0.40 0.15 -0.09 -0.73 0.00 0.00 179.01 178.73 1x7v h ARG 23 N 0.62 0.31 -0.22 1.92 2.43 -1.17 -0.05 114.38 118.22 1x7v h ARG 23 Ca 0.29 -0.02 -0.08 0.00 -0.81 0.00 0.00 59.98 59.37 1x7v h ARG 23 Cb 0.21 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 29.69 1x7v h ARG 23 CO -0.20 0.21 -0.16 0.93 -1.51 0.00 0.00 179.97 179.24 1x7v h GLU 24 N 0.32 0.50 -0.76 0.20 4.39 -0.79 -3.13 114.58 115.31 1x7v h GLU 24 Ca 0.21 -0.24 -0.04 0.00 0.34 0.00 0.00 59.36 59.64 1x7v h GLU 24 Cb 0.21 -0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.82 1x7v h GLU 24 CO -0.22 0.80 0.33 -0.07 -1.16 0.00 0.00 179.01 178.70 1x7v h LEU 25 N 0.19 1.01 -1.71 1.33 3.38 -0.49 -2.93 115.31 116.09 1x7v h LEU 25 Ca 0.04 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 1x7v h LEU 25 Cb 0.68 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 1x7v h LEU 25 CO 0.04 0.87 0.04 0.03 0.09 0.00 0.00 178.44 179.51 1x7v h ARG 26 N 1.09 0.22 0.00 1.13 3.08 -0.95 -1.33 114.38 117.61 1x7v h ARG 26 Ca 0.26 -0.02 -0.03 0.00 0.07 0.00 0.00 59.98 60.25 1x7v h ARG 26 Cb 0.16 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.16 1x7v h ARG 26 CO -0.03 0.21 -0.16 0.00 -1.07 0.00 0.00 179.97 178.93 1x7v h ALA 27 N 1.82 1.36 0.00 0.04 0.00 -1.49 -2.24 119.26 118.76 1x7v h ALA 27 Ca 0.06 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 54.75 1x7v h ALA 27 Cb 0.09 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1x7v h ALA 27 CO -0.00 0.19 -0.37 -0.07 0.00 0.00 0.00 179.25 179.00 1x7v h LEU 28 N 0.00 0.00 0.22 0.00 3.38 -1.32 -3.41 115.31 114.18 1x7v h LEU 28 Ca -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1x7v h LEU 28 Cb 0.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1x7v h LEU 28 CO 0.02 0.37 -0.11 0.58 0.09 0.00 0.00 178.44 179.39 1x7v h VAL 29 N 0.00 0.76 -0.12 1.22 2.07 -1.51 -1.84 116.25 116.84 1x7v h VAL 29 Ca -0.00 -0.93 -0.00 0.00 0.82 0.00 0.00 66.70 66.59 1x7v h VAL 29 Cb 0.87 1.22 -0.01 0.00 -1.52 0.00 0.00 31.29 31.86 1x7v h VAL 29 CO 0.05 0.18 0.06 0.00 0.02 0.00 0.00 177.57 177.88 1x7v h ALA 30 N -0.30 0.15 -0.26 1.67 0.00 -1.78 -0.34 119.26 118.40 1x7v h ALA 30 Ca -0.03 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.75 1x7v h ALA 30 Cb 0.51 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1x7v h ALA 30 CO 0.05 -0.31 -0.19 -1.00 0.00 0.00 0.00 179.25 177.80 1x7v h PRO 31 N 0.10 0.46 -0.49 0.00 0.13 -1.79 -2.85 132.00 127.55 1x7v h PRO 31 Ca 0.04 -0.15 -0.10 0.00 -0.87 0.00 0.00 66.00 64.92 1x7v h PRO 31 Cb 0.07 -0.04 -0.02 0.00 0.13 0.00 0.00 31.00 31.15 1x7v h PRO 31 CO -0.01 0.64 -0.10 0.77 -0.23 0.00 0.00 178.00 179.07 1x7v h SER 32 N 0.42 0.94 0.03 1.44 0.02 -1.03 -2.94 113.55 112.43 1x7v h SER 32 Ca 0.07 -0.35 -0.01 0.00 -0.84 0.00 0.00 61.79 60.66 1x7v h SER 32 Cb 0.57 -0.26 -0.00 0.00 0.14 0.00 0.00 62.40 62.86 1x7v h SER 32 CO 0.04 1.08 -0.03 0.03 -1.14 0.00 0.00 176.83 176.81 1x7v h ARG 33 N 0.80 0.00 0.00 3.45 3.08 -0.85 -1.92 114.38 118.93 1x7v h ARG 33 Ca 0.13 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.18 1x7v h ARG 33 Cb 0.65 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.70 1x7v h ARG 33 CO 0.05 0.03 -0.01 0.00 -1.07 0.00 0.00 179.97 178.96 1x7v h ALA 34 N 1.97 0.99 -2.91 0.04 0.00 -1.33 -3.45 119.26 114.58 1x7v h ALA 34 Ca -0.00 -0.01 -0.53 0.00 0.00 0.00 0.00 54.91 54.37 1x7v h ALA 34 Cb 0.05 -0.00 0.10 0.00 0.00 0.00 0.00 17.79 17.93 1x7v h ALA 34 CO 0.00 0.01 0.64 -1.21 0.00 0.00 0.00 179.25 178.69 1x7v s GLU 35 N -3.34 3.80 0.20 0.00 2.02 -0.73 -4.93 118.70 115.73 1x7v s GLU 35 Ca 0.05 2.23 -0.31 0.00 0.02 0.00 0.00 54.97 56.96 1x7v s GLU 35 Cb 0.06 -2.67 -0.15 0.00 0.10 0.00 0.00 34.13 31.47 1x7v s GLU 35 CO 0.64 -0.66 1.10 0.00 0.02 0.00 0.00 175.26 176.36 1x7v n ALA 36 N -0.10 -0.67 -0.92 5.21 0.00 -1.26 -1.81 120.51 120.96 1x7v n ALA 36 Ca 0.05 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.93 1x7v n ALA 36 Cb 0.43 -2.02 0.00 0.00 0.00 0.00 0.00 19.45 17.87 1x7v n ALA 36 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1x7v n GLY 37 N 1.81 0.78 3.56 0.00 0.00 -1.26 -4.90 105.19 105.18 1x7v n GLY 37 Ca 0.14 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.73 1x7v n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x7v n LEU 39 N 7.26 0.66 -3.61 0.00 4.77 0.13 -4.92 117.00 121.28 1x7v n LEU 39 Ca 0.06 0.26 -0.14 0.00 -0.03 0.00 0.00 56.01 56.15 1x7v n LEU 39 Cb 0.48 -0.03 -0.07 0.00 -2.33 0.00 0.00 43.42 41.48 1x7v n LEU 39 CO 0.64 -0.11 0.46 -1.58 -1.33 0.00 0.00 177.39 175.46 1x7v s GLN 40 N -3.35 0.85 -0.35 3.23 0.74 -1.13 -4.83 119.66 114.82 1x7v s GLN 40 Ca -0.02 0.80 0.06 0.00 0.05 0.00 0.00 55.36 56.25 1x7v s GLN 40 Cb 0.10 0.41 0.18 0.00 1.10 0.00 0.00 33.01 34.81 1x7v s GLN 40 CO 0.82 -0.15 0.56 -0.47 -0.55 0.00 0.00 175.29 175.50 1x7v s TYR 41 N 0.02 -1.53 -0.06 1.67 5.04 -1.24 -1.36 117.35 119.88 1x7v s TYR 41 Ca -0.02 0.41 0.03 0.00 -2.44 0.00 0.00 57.07 55.05 1x7v s TYR 41 Cb -0.04 0.18 0.00 0.00 0.35 0.00 0.00 41.96 42.46 1x7v s TYR 41 CO 0.02 -1.10 -0.16 -0.51 -1.34 0.00 0.00 175.55 172.46 1x7v s ASP 42 N 2.20 2.14 -0.12 4.32 1.01 -0.34 -4.83 116.67 121.05 1x7v s ASP 42 Ca 0.13 -0.36 -0.08 0.00 0.71 0.00 0.00 52.55 52.95 1x7v s ASP 42 Cb -0.08 -0.84 -0.04 0.00 1.01 0.00 0.00 42.92 42.97 1x7v s ASP 42 CO -0.16 0.10 0.16 -0.22 0.21 0.00 0.00 175.17 175.27 1x7v s LEU 43 N 0.37 4.38 0.04 1.23 2.96 -1.26 -1.05 118.68 125.34 1x7v s LEU 43 Ca -0.11 0.49 -0.01 0.00 -0.22 0.00 0.00 54.13 54.27 1x7v s LEU 43 Cb -0.15 -2.11 -0.03 0.00 0.50 0.00 0.00 46.19 44.40 1x7v s LEU 43 CO 0.04 0.38 -0.01 -1.00 -1.32 0.00 0.00 176.35 174.44 1x7v s HIS 44 N -0.89 0.38 -0.04 5.38 3.76 -0.28 -4.99 115.29 118.61 1x7v s HIS 44 Ca 0.15 -0.80 0.06 0.00 -0.15 0.00 0.00 55.06 54.32 1x7v s HIS 44 Cb -0.12 -0.28 -0.02 0.00 1.11 0.00 0.00 32.58 33.27 1x7v s HIS 44 CO 0.04 -0.31 -0.22 -1.14 -0.85 0.00 0.00 174.74 172.25 1x7v s GLN 45 N -2.88 2.38 0.34 1.40 0.74 -1.26 -1.38 119.66 119.00 1x7v s GLN 45 Ca -0.03 -0.86 -0.26 0.00 0.05 0.00 0.00 55.36 54.26 1x7v s GLN 45 Cb 0.00 -2.18 -0.13 0.00 1.10 0.00 0.00 33.01 31.81 1x7v s GLN 45 CO -0.06 0.51 0.97 -3.47 -0.55 0.00 0.00 175.29 172.69 1x7v n ASP 46 N 2.60 1.11 0.18 6.67 2.03 0.07 -4.92 116.55 124.28 1x7v n ASP 46 Ca -0.17 1.12 0.03 0.00 0.52 0.00 0.00 54.79 56.29 1x7v n ASP 46 Cb 0.52 -1.29 0.32 0.00 -0.72 0.00 0.00 41.12 39.94 1x7v n ASP 46 CO 0.00 0.00 0.00 -0.09 -1.92 0.00 0.00 177.20 175.19 1x7v h ARG 47 N 1.76 0.00 0.00 -0.67 2.43 -1.99 -3.36 114.38 112.55 1x7v h ARG 47 Ca -0.41 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.76 1x7v h ARG 47 Cb 1.34 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.89 1x7v h ARG 47 CO 0.59 0.43 -1.01 0.72 -1.51 0.00 0.00 179.97 179.19 1x7v n HIS 48 N -3.76 0.00 -3.82 2.20 8.25 -1.26 -4.95 115.22 111.88 1x7v n HIS 48 Ca -0.01 0.00 -0.28 0.00 -0.26 0.00 0.00 57.72 57.17 1x7v n HIS 48 Cb 0.50 -0.10 -0.16 0.00 1.12 0.00 0.00 29.99 31.34 1x7v n HIS 48 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1x7v s ASP 49 N -2.40 2.85 0.60 0.41 -1.08 -1.26 -5.02 116.67 110.77 1x7v s ASP 49 Ca -0.01 -0.73 0.37 0.00 -0.52 0.00 0.00 52.55 51.66 1x7v s ASP 49 Cb 0.04 -0.77 1.90 0.00 -1.46 0.00 0.00 42.92 42.63 1x7v s ASP 49 CO 0.25 -0.24 2.20 0.77 0.52 0.00 0.00 175.17 178.68 1x7v h SER 50 N 8.17 0.00 0.48 -0.34 4.64 -1.93 -2.41 113.55 122.16 1x7v h SER 50 Ca -0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.12 1x7v h SER 50 Cb 1.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 1x7v h SER 50 CO 0.36 0.03 0.00 1.41 -0.87 0.00 0.00 176.83 177.76 1x7v n HIS 51 N -3.30 0.00 -4.20 4.77 8.25 -1.26 -4.78 115.22 114.69 1x7v n HIS 51 Ca -0.02 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.10 1x7v n HIS 51 Cb 0.17 -0.29 -0.13 0.00 1.12 0.00 0.00 29.99 30.86 1x7v n HIS 51 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1x7v s LEU 52 N -2.58 3.11 0.14 2.41 1.43 -0.91 0.15 118.68 122.44 1x7v s LEU 52 Ca 0.24 -0.24 0.07 0.00 -1.03 0.00 0.00 54.13 53.16 1x7v s LEU 52 Cb 0.17 -1.77 -0.04 0.00 0.03 0.00 0.00 46.19 44.58 1x7v s LEU 52 CO 0.38 0.08 -0.15 -0.36 0.23 0.00 0.00 176.35 176.53 1x7v s PHE 53 N 0.87 1.53 0.00 0.29 0.40 -0.14 -0.76 117.98 120.18 1x7v s PHE 53 Ca -0.00 -0.53 0.00 0.00 -0.60 0.00 0.00 56.93 55.79 1x7v s PHE 53 Cb -0.15 -0.79 0.00 0.00 0.51 0.00 0.00 43.02 42.60 1x7v s PHE 53 CO 0.01 0.20 0.00 0.66 0.70 0.00 0.00 175.22 176.80 1x7v n TYR 54 N 0.42 0.00 -3.39 0.36 4.02 -0.48 -0.72 117.16 117.38 1x7v n TYR 54 Ca -0.14 0.00 0.02 0.00 -0.01 0.00 0.00 57.90 57.76 1x7v n TYR 54 Cb 0.57 0.00 -0.04 0.00 -0.02 0.00 0.00 39.34 39.85 1x7v n TYR 54 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 1x7v s ILE 56 N -1.40 -0.37 0.03 -0.72 1.01 -0.22 -1.13 121.20 118.40 1x7v s ILE 56 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 60.65 60.70 1x7v s ILE 56 Cb 0.00 -1.00 -0.02 0.00 0.01 0.00 0.00 42.46 41.45 1x7v s ILE 56 CO 0.00 0.00 -0.14 -1.61 0.00 0.00 0.00 174.94 173.19 1x7v s GLU 57 N 2.26 0.95 -0.03 2.79 2.02 -0.11 -1.20 118.70 125.37 1x7v s GLU 57 Ca -0.03 -0.73 0.04 0.00 0.02 0.00 0.00 54.97 54.27 1x7v s GLU 57 Cb -0.05 -0.95 -0.00 0.00 0.10 0.00 0.00 34.13 33.23 1x7v s GLU 57 CO -0.17 0.24 -0.14 -0.65 0.02 0.00 0.00 175.26 174.56 1x7v s GLN 58 N -1.07 1.33 -0.01 1.61 -0.21 -0.47 -0.55 119.66 120.29 1x7v s GLN 58 Ca 0.02 -0.48 0.04 0.00 0.02 0.00 0.00 55.36 54.96 1x7v s GLN 58 Cb -0.08 -1.21 -0.01 0.00 1.00 0.00 0.00 33.01 32.71 1x7v s GLN 58 CO 0.01 0.21 -0.12 -1.58 -2.12 0.00 0.00 175.29 171.70 1x7v s TRP 59 N 0.00 1.06 0.26 0.91 0.52 0.02 -0.70 118.94 121.01 1x7v s TRP 59 Ca -0.01 -0.20 -0.03 0.00 0.02 0.00 0.00 56.10 55.88 1x7v s TRP 59 Cb -0.09 -0.68 0.40 0.00 -1.15 0.00 0.00 33.47 31.95 1x7v s TRP 59 CO 0.01 -0.02 1.86 -0.09 0.02 0.00 0.00 176.95 178.73 1x7v h ARG 60 N 5.85 1.01 -2.98 4.98 2.43 -1.29 -0.96 114.38 123.42 1x7v h ARG 60 Ca -0.33 -0.06 0.01 0.00 -0.81 0.00 0.00 59.98 58.79 1x7v h ARG 60 Cb 1.17 -0.23 -0.01 0.00 -0.42 0.00 0.00 29.97 30.48 1x7v h ARG 60 CO 0.49 0.67 0.28 0.16 -1.51 0.00 0.00 179.97 180.06 1x7v s ASP 61 N -5.79 -0.05 0.37 -3.80 1.47 -1.26 -4.45 116.67 103.16 1x7v s ASP 61 Ca -0.12 -1.03 0.04 0.00 1.18 0.00 0.00 52.55 52.62 1x7v s ASP 61 Cb 0.20 0.82 0.72 0.00 -0.34 0.00 0.00 42.92 44.31 1x7v s ASP 61 CO 0.80 -1.60 2.02 0.44 0.68 0.00 0.00 175.17 177.51 1x7v h ASP 62 N 2.00 0.64 -0.51 2.11 3.32 -1.99 -2.50 116.42 119.48 1x7v h ASP 62 Ca -0.30 -0.01 -0.06 0.00 0.02 0.00 0.00 57.03 56.68 1x7v h ASP 62 Cb 1.25 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 40.62 1x7v h ASP 62 CO 0.37 0.46 0.10 0.00 -1.72 0.00 0.00 179.24 178.45 1x7v h ALA 63 N 1.65 1.11 -0.37 3.45 0.00 -1.98 0.15 119.26 123.26 1x7v h ALA 63 Ca 0.21 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 1x7v h ALA 63 Cb -0.05 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 1x7v h ALA 63 CO -0.05 0.58 0.07 0.00 0.00 0.00 0.00 179.25 179.85 1x7v h ALA 64 N 1.26 0.49 -0.73 0.00 0.00 -1.80 -0.74 119.26 117.74 1x7v h ALA 64 Ca 0.18 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1x7v h ALA 64 Cb 0.36 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 1x7v h ALA 64 CO 0.01 0.19 0.44 1.25 0.00 0.00 0.00 179.25 181.14 1x7v h LEU 65 N 0.46 0.87 -0.49 0.00 5.85 -1.18 -1.57 115.31 119.26 1x7v h LEU 65 Ca 0.11 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.76 1x7v h LEU 65 Cb 0.34 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.13 1x7v h LEU 65 CO 0.01 0.68 0.27 -0.33 -0.34 0.00 0.00 178.44 178.72 1x7v h GLU 66 N 0.99 0.68 -0.60 1.25 3.07 -0.51 -2.60 114.58 116.86 1x7v h GLU 66 Ca 0.26 -0.08 0.02 0.00 -0.50 0.00 0.00 59.36 59.07 1x7v h GLU 66 Cb -0.04 -0.13 -0.04 0.00 -0.84 0.00 0.00 28.75 27.70 1x7v h GLU 66 CO -0.05 0.53 0.37 0.00 -1.40 0.00 0.00 179.01 178.47 1x7v h ARG 67 N 0.65 0.72 -1.01 2.33 3.08 -0.93 -2.52 114.38 116.69 1x7v h ARG 67 Ca 0.17 -0.04 0.26 0.00 0.07 0.00 0.00 59.98 60.44 1x7v h ARG 67 Cb 0.05 -0.16 -0.13 0.00 0.08 0.00 0.00 29.97 29.81 1x7v h ARG 67 CO -0.03 0.47 0.60 1.25 -1.07 0.00 0.00 179.97 181.20 1x7v h HIS 68 N 0.74 0.98 0.00 3.04 2.76 -0.90 -1.38 115.15 120.39 1x7v h HIS 68 Ca 0.24 0.04 0.00 0.00 -2.20 0.00 0.00 60.37 58.45 1x7v h HIS 68 Cb 0.01 -0.28 0.00 0.00 1.55 0.00 0.00 27.41 28.69 1x7v h HIS 68 CO -0.05 0.04 0.00 1.04 -1.30 0.00 0.00 177.93 177.65 1x7v n GLN 69 N -4.89 0.06 -0.06 5.26 6.02 -0.95 -2.25 117.38 120.57 1x7v n GLN 69 Ca 0.27 0.03 0.12 0.00 -0.01 0.00 0.00 57.00 57.42 1x7v n GLN 69 Cb 0.78 -1.50 0.23 0.00 1.02 0.00 0.00 30.24 30.78 1x7v n GLN 69 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1x7v n ASN 70 N -1.47 2.73 -4.84 1.08 3.02 -0.53 -4.62 115.26 110.65 1x7v n ASN 70 Ca 0.08 -1.88 -0.31 0.00 -0.03 0.00 0.00 54.58 52.43 1x7v n ASN 70 Cb 0.30 -0.08 0.02 0.00 -0.61 0.00 0.00 39.78 39.41 1x7v n ASN 70 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1x7v s THR 71 N -1.84 4.27 0.10 3.41 -4.23 -0.95 -4.92 115.64 111.48 1x7v s THR 71 Ca 0.33 0.82 -0.23 0.00 -1.18 0.00 0.00 61.69 61.43 1x7v s THR 71 Cb 0.21 -3.58 -0.13 0.00 1.34 0.00 0.00 72.50 70.33 1x7v s THR 71 CO 0.31 -0.89 1.72 -0.08 -0.54 0.00 0.00 174.62 175.14 1x7v h GLU 72 N -0.26 -0.08 -0.59 3.99 4.81 -1.93 -1.67 114.58 118.84 1x7v h GLU 72 Ca -0.45 0.01 0.01 0.00 -0.13 0.00 0.00 59.36 58.80 1x7v h GLU 72 Cb 1.20 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 30.57 1x7v h GLU 72 CO 0.59 -0.06 0.39 1.12 -0.73 0.00 0.00 179.01 180.32 1x7v h HIS 73 N -0.09 0.74 -0.41 0.92 2.07 -1.93 0.19 115.15 116.65 1x7v h HIS 73 Ca 0.01 0.02 -0.06 0.00 -2.85 0.00 0.00 60.37 57.49 1x7v h HIS 73 Cb 0.10 -0.25 -0.02 0.00 2.57 0.00 0.00 27.41 29.81 1x7v h HIS 73 CO -0.10 0.46 0.03 0.35 -3.07 0.00 0.00 177.93 175.60 1x7v h PHE 74 N 0.80 0.76 -0.03 6.12 3.57 -1.78 -2.57 116.94 123.79 1x7v h PHE 74 Ca 0.22 -0.12 -0.11 0.00 3.53 0.00 0.00 57.97 61.49 1x7v h PHE 74 Cb -0.08 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 38.44 1x7v h PHE 74 CO -0.04 0.75 -0.51 -0.07 -2.23 0.00 0.00 178.31 176.22 1x7v h LEU 75 N 0.54 0.09 -1.66 0.59 3.38 -1.06 -2.70 115.31 114.49 1x7v h LEU 75 Ca 0.12 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 1x7v h LEU 75 Cb 0.43 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 1x7v h LEU 75 CO 0.01 0.58 0.06 0.03 0.09 0.00 0.00 178.44 179.22 1x7v h ARG 76 N 0.07 0.28 -0.51 1.13 3.08 -0.75 -1.74 114.38 115.93 1x7v h ARG 76 Ca -0.00 -0.03 -0.09 0.00 0.07 0.00 0.00 59.98 59.93 1x7v h ARG 76 Cb 0.92 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.90 1x7v h ARG 76 CO 0.07 0.26 -0.02 0.35 -1.07 0.00 0.00 179.97 179.55 1x7v h PHE 77 N 0.28 1.01 0.00 3.04 3.57 -1.14 -2.82 116.94 120.88 1x7v h PHE 77 Ca 0.07 -0.18 -0.03 0.00 3.53 0.00 0.00 57.97 61.36 1x7v h PHE 77 Cb 0.09 -0.26 -0.00 0.00 2.79 0.00 0.00 35.95 38.57 1x7v h PHE 77 CO 0.00 0.94 -0.14 0.77 -2.23 0.00 0.00 178.31 177.66 1x7v h SER 78 N 0.78 0.00 -1.88 0.41 0.02 -1.20 -3.35 113.55 108.33 1x7v h SER 78 Ca 0.14 0.00 -0.66 0.00 -0.84 0.00 0.00 61.79 60.44 1x7v h SER 78 Cb 0.55 0.00 -0.15 0.00 0.14 0.00 0.00 62.40 62.95 1x7v h SER 78 CO 0.03 0.14 1.12 -0.13 -1.14 0.00 0.00 176.83 176.85 1x7v s ARG 79 N -4.67 3.61 0.00 3.45 0.52 -0.72 -4.00 118.95 117.14 1x7v s ARG 79 Ca -0.04 -1.54 0.00 0.00 -0.52 0.00 0.00 55.73 53.63 1x7v s ARG 79 Cb 0.16 -5.10 0.00 0.00 0.52 0.00 0.00 34.95 30.53 1x7v s ARG 79 CO 0.67 -1.95 0.00 0.41 0.02 0.00 0.00 175.30 174.46 1x7v n GLY 80 N 6.00 0.73 0.70 -3.53 0.00 -1.26 -4.98 105.19 102.85 1x7v n GLY 80 Ca 0.28 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.41 1x7v n GLY 80 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1x7v n ASN 81 N 0.00 2.13 -0.19 1.61 3.02 -1.26 -4.49 115.26 116.09 1x7v n ASN 81 Ca 0.00 -1.77 0.04 0.00 -0.03 0.00 0.00 54.58 52.82 1x7v n ASN 81 Cb 0.00 -0.12 0.31 0.00 -0.61 0.00 0.00 39.78 39.37 1x7v n ASN 81 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 1x7v h GLU 82 N 2.90 0.83 0.00 3.52 4.81 -1.88 0.56 114.58 125.31 1x7v h GLU 82 Ca 0.00 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 1x7v h GLU 82 Cb 0.63 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 29.83 1x7v h GLU 82 CO 0.00 0.55 0.00 0.00 -0.73 0.00 0.00 179.01 178.83 1x7v h ALA 83 N 1.59 1.00 0.00 2.92 0.00 -2.01 -2.13 119.26 120.63 1x7v h ALA 83 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.20 1x7v h ALA 83 Cb 0.09 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1x7v h ALA 83 CO -0.09 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.44 1x7v n LEU 84 N -2.42 0.34 -4.62 0.00 4.77 0.19 -4.74 117.00 110.52 1x7v n LEU 84 Ca 0.01 0.54 -0.34 0.00 -0.03 0.00 0.00 56.01 56.19 1x7v n LEU 84 Cb 0.22 -0.43 -0.10 0.00 -2.33 0.00 0.00 43.42 40.77 1x7v n LEU 84 CO 0.20 -0.10 -0.35 -0.76 -1.33 0.00 0.00 177.39 175.04 1x7v s LEU 85 N -3.64 3.33 -0.17 2.23 1.43 -0.80 -0.71 118.68 120.34 1x7v s LEU 85 Ca 0.12 0.02 0.03 0.00 -1.03 0.00 0.00 54.13 53.27 1x7v s LEU 85 Cb 0.16 -1.77 -0.13 0.00 0.03 0.00 0.00 46.19 44.48 1x7v s LEU 85 CO 0.54 0.35 -0.12 1.67 0.23 0.00 0.00 176.35 179.02 1x7v n GLN 86 N 2.07 0.66 -3.63 1.70 7.27 0.30 -4.51 117.38 121.24 1x7v n GLN 86 Ca -0.18 0.08 -0.15 0.00 0.07 0.00 0.00 57.00 56.83 1x7v n GLN 86 Cb 0.53 -1.36 -0.07 0.00 2.41 0.00 0.00 30.24 31.75 1x7v n GLN 86 CO 0.00 0.00 0.00 1.21 0.07 0.00 0.00 177.06 178.34 1x7v s ASN 87 N -5.57 -0.63 -0.09 1.69 2.47 -1.10 -5.00 114.94 106.71 1x7v s ASN 87 Ca -0.21 1.05 -0.01 0.00 0.42 0.00 0.00 52.86 54.11 1x7v s ASN 87 Cb 0.06 1.03 0.03 0.00 -1.45 0.00 0.00 41.25 40.92 1x7v s ASN 87 CO 0.44 -0.34 -0.05 -0.69 -3.72 0.00 0.00 177.10 172.75 1x7v s VAL 88 N -0.17 0.75 -0.11 -5.21 1.01 -1.26 -1.18 120.40 114.23 1x7v s VAL 88 Ca -0.04 -0.13 -0.00 0.00 0.00 0.00 0.00 61.98 61.81 1x7v s VAL 88 Cb -0.03 -0.82 -0.02 0.00 0.00 0.00 0.00 36.38 35.50 1x7v s VAL 88 CO 0.03 0.32 -0.08 -0.75 0.00 0.00 0.00 175.10 174.62 1x7v s LYS 89 N 1.72 3.16 -0.18 2.72 2.20 -0.13 -4.98 119.74 124.25 1x7v s LYS 89 Ca 0.03 -0.59 0.01 0.00 -0.36 0.00 0.00 55.97 55.06 1x7v s LYS 89 Cb -0.13 -2.67 0.02 0.00 -1.51 0.00 0.00 37.83 33.54 1x7v s LYS 89 CO -0.06 0.42 -0.18 0.42 -0.36 0.00 0.00 175.35 175.59 1x7v s ILE 90 N -0.16 1.93 -0.12 5.43 -1.09 -1.26 -0.88 121.20 125.06 1x7v s ILE 90 Ca 0.01 -0.89 -0.02 0.00 -2.23 0.00 0.00 60.65 57.52 1x7v s ILE 90 Cb -0.13 -1.78 -0.03 0.00 -1.58 0.00 0.00 42.46 38.94 1x7v s ILE 90 CO 0.03 0.49 -0.06 -1.81 -1.23 0.00 0.00 174.94 172.36 1x7v s ASP 91 N 1.33 4.66 -0.13 3.58 1.01 -0.01 -4.99 116.67 122.13 1x7v s ASP 91 Ca 0.04 -0.11 -0.02 0.00 0.71 0.00 0.00 52.55 53.18 1x7v s ASP 91 Cb -0.13 -1.55 -0.02 0.00 1.01 0.00 0.00 42.92 42.23 1x7v s ASP 91 CO -0.12 0.24 -0.07 -1.10 0.21 0.00 0.00 175.17 174.33 1x7v s GLN 92 N -0.07 3.37 0.12 8.23 -0.21 -1.26 -1.34 119.66 128.49 1x7v s GLN 92 Ca 0.01 -0.57 -0.21 0.00 0.02 0.00 0.00 55.36 54.61 1x7v s GLN 92 Cb -0.13 -2.76 0.05 0.00 1.00 0.00 0.00 33.01 31.18 1x7v s GLN 92 CO 0.03 0.34 0.52 -0.48 -2.12 0.00 0.00 175.29 173.57 1x7v s LEU 93 N 0.07 -0.13 -0.04 2.90 2.34 0.24 -5.01 118.68 119.05 1x7v s LEU 93 Ca -0.02 -0.04 0.05 0.00 0.06 0.00 0.00 54.13 54.17 1x7v s LEU 93 Cb -0.14 2.23 -0.01 0.00 -0.56 0.00 0.00 46.19 47.72 1x7v s LEU 93 CO 0.03 -0.86 -0.18 -0.31 -1.06 0.00 0.00 176.35 173.98 1x7v s TYR 94 N -3.39 1.73 0.31 3.48 1.51 -1.26 -0.12 117.35 119.61 1x7v s TYR 94 Ca -0.00 -0.47 -0.29 0.00 -1.01 0.00 0.00 57.07 55.30 1x7v s TYR 94 Cb 0.00 -1.15 -0.11 0.00 -0.11 0.00 0.00 41.96 40.59 1x7v s TYR 94 CO -0.09 -0.14 1.44 0.50 -1.11 0.00 0.00 175.55 176.14 1x7v s ARG 95 N -0.05 4.23 -0.00 -0.62 3.52 -1.26 -5.02 118.95 119.75 1x7v s ARG 95 Ca -0.02 2.39 -0.13 0.00 -0.13 0.00 0.00 55.73 57.84 1x7v s ARG 95 Cb -0.11 -3.05 -0.05 0.00 -1.56 0.00 0.00 34.95 30.18 1x7v s ARG 95 CO 0.02 -0.42 0.38 -0.51 -0.81 0.00 0.00 175.30 173.96 1x7v s LEU 96 N -1.21 4.45 0.00 -0.88 1.43 -1.26 -5.02 118.68 116.19 1x7v s LEU 96 Ca 0.55 0.89 0.00 0.00 -1.03 0.00 0.00 54.13 54.54 1x7v s LEU 96 Cb -0.43 -2.57 0.00 0.00 0.03 0.00 0.00 46.19 43.21 1x7v s LEU 96 CO 0.52 0.32 0.07 0.00 0.23 0.00 0.00 176.35 177.48