#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c7h n PRO 2 N 0.00 2.79 -1.84 1.61 -0.04 -1.26 -4.94 135.00 131.33 2c7h n PRO 2 Ca 0.00 0.00 -0.38 0.00 -0.04 0.00 0.00 63.50 63.08 2c7h n PRO 2 Cb 0.00 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.43 2c7h n PRO 2 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2c7h s LEU 3 N 0.00 3.37 -0.50 1.53 1.98 -1.26 -4.90 118.68 118.90 2c7h s LEU 3 Ca 0.00 0.82 -0.21 0.00 -2.89 0.00 0.00 54.13 51.85 2c7h s LEU 3 Cb 0.00 -2.70 0.04 0.00 0.66 0.00 0.00 46.19 44.19 2c7h s LEU 3 CO 0.00 -2.45 0.72 -0.83 -1.89 0.00 0.00 176.35 171.89 2c7h s GLY 4 N 9.34 1.66 -0.06 7.98 0.00 -1.26 -4.85 107.32 120.13 2c7h s GLY 4 Ca 0.82 -1.45 0.10 0.00 0.00 0.00 0.00 44.72 44.19 2c7h s GLY 4 CO 0.25 1.65 1.23 -1.26 0.00 0.00 0.00 173.10 174.97 2c7h n SER 5 N 6.55 2.75 -4.59 1.64 2.88 -1.26 -4.92 113.62 116.67 2c7h n SER 5 Ca -0.03 -2.23 -0.33 0.00 -1.33 0.00 0.00 58.87 54.95 2c7h n SER 5 Cb 0.47 -0.42 0.13 0.00 -0.75 0.00 0.00 64.21 63.64 2c7h n SER 5 CO 0.00 0.00 0.00 1.15 -1.23 0.00 0.00 175.04 174.96 2c7h n MET 6 N 0.50 -0.07 -4.21 -1.46 0.00 -1.26 -4.90 117.12 105.72 2c7h n MET 6 Ca 0.14 0.05 -0.28 0.00 0.00 0.00 0.00 57.70 57.61 2c7h n MET 6 Cb 0.53 -2.20 -0.17 0.00 0.00 0.00 0.00 33.22 31.38 2c7h n MET 6 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 175.97 174.85 2c7h s SER 7 N -2.13 2.29 -0.01 3.17 0.01 -1.24 -5.06 113.70 110.73 2c7h s SER 7 Ca 0.67 -0.38 0.00 0.00 1.31 0.00 0.00 55.95 57.55 2c7h s SER 7 Cb -0.27 -0.98 0.01 0.00 0.21 0.00 0.00 66.02 64.99 2c7h s SER 7 CO 0.57 -0.04 0.00 0.00 0.41 0.00 0.00 173.24 174.18 2c7h s VAL 9 N 0.44 4.54 -0.34 0.00 1.01 -0.58 -4.53 120.40 120.94 2c7h s VAL 9 Ca -0.04 -0.12 -0.27 0.00 0.00 0.00 0.00 61.98 61.55 2c7h s VAL 9 Cb -0.06 -3.03 0.01 0.00 0.00 0.00 0.00 36.38 33.30 2c7h s VAL 9 CO -0.01 0.46 0.96 -1.00 0.00 0.00 0.00 175.10 175.51 2c7h s HIS 10 N 0.41 3.13 0.01 5.22 3.76 -1.25 -2.36 115.29 124.21 2c7h s HIS 10 Ca 0.01 0.95 0.03 0.00 -0.15 0.00 0.00 55.06 55.90 2c7h s HIS 10 Cb -0.13 -3.58 -0.01 0.00 1.11 0.00 0.00 32.58 29.97 2c7h s HIS 10 CO 0.01 -0.75 -0.09 1.52 -0.85 0.00 0.00 174.74 174.58 2c7h s TYR 11 N 3.44 0.77 -0.04 1.40 -0.85 -0.36 -0.53 117.35 121.18 2c7h s TYR 11 Ca 0.40 -0.21 0.07 0.00 -0.52 0.00 0.00 57.07 56.81 2c7h s TYR 11 Cb -0.12 -0.49 -0.01 0.00 0.38 0.00 0.00 41.96 41.72 2c7h s TYR 11 CO 0.16 -0.01 -0.25 -1.59 -1.52 0.00 0.00 175.55 172.34 2c7h s LYS 12 N -0.49 2.36 0.82 -3.49 -2.85 -0.53 0.73 119.74 116.30 2c7h s LYS 12 Ca 0.01 -0.90 -0.10 0.00 -1.00 0.00 0.00 55.97 53.98 2c7h s LYS 12 Cb -0.05 -2.09 0.13 0.00 -2.06 0.00 0.00 37.83 33.76 2c7h s LYS 12 CO -0.00 0.44 1.15 0.12 0.10 0.00 0.00 175.35 177.16 2c7h s PHE 13 N -0.32 2.14 0.34 1.78 2.19 -1.26 0.36 117.98 123.22 2c7h s PHE 13 Ca 0.01 0.29 0.05 0.00 0.33 0.00 0.00 56.93 57.61 2c7h s PHE 13 Cb -0.12 -3.55 0.69 0.00 -1.31 0.00 0.00 43.02 38.73 2c7h s PHE 13 CO 0.02 -1.99 1.92 0.77 1.83 0.00 0.00 175.22 177.76 2c7h h SER 14 N -1.04 0.74 -0.08 6.13 0.02 -1.91 -0.70 113.55 116.70 2c7h h SER 14 Ca -0.43 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.53 2c7h h SER 14 Cb 1.28 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.68 2c7h h SER 14 CO 0.48 0.45 0.00 -1.20 -1.14 0.00 0.00 176.83 175.43 2c7h n SER 15 N -4.51 1.74 -4.69 3.07 7.64 -1.26 -4.85 113.62 110.76 2c7h n SER 15 Ca 0.13 -1.62 -0.36 0.00 1.01 0.00 0.00 58.87 58.03 2c7h n SER 15 Cb 0.28 -0.05 -0.08 0.00 -1.01 0.00 0.00 64.21 63.35 2c7h n SER 15 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2c7h s LYS 16 N -1.91 4.16 0.13 1.43 3.01 -0.27 -4.91 119.74 121.38 2c7h s LYS 16 Ca 0.35 -0.09 0.21 0.00 -1.01 0.00 0.00 55.97 55.43 2c7h s LYS 16 Cb 0.20 -3.49 -0.08 0.00 -1.01 0.00 0.00 37.83 33.45 2c7h s LYS 16 CO 0.31 0.14 0.90 -0.11 0.51 0.00 0.00 175.35 177.10 2c7h n LEU 17 N 3.99 0.74 -4.30 3.17 7.94 -1.26 -4.57 117.00 122.72 2c7h n LEU 17 Ca -0.13 0.30 -0.25 0.00 -1.11 0.00 0.00 56.01 54.81 2c7h n LEU 17 Cb 0.52 -0.01 -0.13 0.00 0.53 0.00 0.00 43.42 44.33 2c7h n LEU 17 CO 0.37 -0.07 -0.53 0.54 -1.11 0.00 0.00 177.39 176.60 2c7h s ASN 18 N -5.37 2.65 0.40 1.96 4.22 -1.26 -5.12 114.94 112.41 2c7h s ASN 18 Ca -0.02 -0.67 -0.23 0.00 -2.14 0.00 0.00 52.86 49.80 2c7h s ASN 18 Cb 0.10 -0.16 -0.10 0.00 1.28 0.00 0.00 41.25 42.37 2c7h s ASN 18 CO 0.81 0.09 0.98 -0.31 -2.04 0.00 0.00 177.10 176.64 2c7h s TYR 19 N -1.09 3.38 0.49 1.54 1.51 -1.26 -4.73 117.35 117.19 2c7h s TYR 19 Ca 0.08 1.67 0.09 0.00 -1.01 0.00 0.00 57.07 57.89 2c7h s TYR 19 Cb -0.10 -2.97 0.04 0.00 -0.11 0.00 0.00 41.96 38.82 2c7h s TYR 19 CO 0.04 -0.23 0.63 -0.51 -1.11 0.00 0.00 175.55 174.37 2c7h s ASP 20 N -1.82 5.33 -0.03 2.29 1.01 0.22 -4.85 116.67 118.82 2c7h s ASP 20 Ca 0.58 -0.66 0.01 0.00 0.71 0.00 0.00 52.55 53.18 2c7h s ASP 20 Cb -0.16 -0.21 0.02 0.00 1.01 0.00 0.00 42.92 43.57 2c7h s ASP 20 CO 0.21 -1.00 -0.03 0.42 0.21 0.00 0.00 175.17 174.98 2c7h s THR 21 N -2.51 0.36 -0.22 -1.27 -4.23 -1.26 -1.22 115.64 105.29 2c7h s THR 21 Ca 0.56 -0.06 -0.09 0.00 -1.18 0.00 0.00 61.69 60.92 2c7h s THR 21 Cb -0.07 -0.39 -0.04 0.00 1.34 0.00 0.00 72.50 73.33 2c7h s THR 21 CO 0.34 0.16 0.11 0.68 -0.54 0.00 0.00 174.62 175.38 2c7h s VAL 22 N 0.69 4.99 -0.15 2.29 -7.23 -1.00 -4.90 120.40 115.09 2c7h s VAL 22 Ca -0.08 0.05 -0.16 0.00 -1.81 0.00 0.00 61.98 59.98 2c7h s VAL 22 Cb -0.11 -3.30 -0.04 0.00 0.56 0.00 0.00 36.38 33.49 2c7h s VAL 22 CO -0.01 0.39 0.37 0.42 -0.31 0.00 0.00 175.10 175.96 2c7h s THR 23 N 0.88 5.26 0.07 5.32 -4.23 -1.26 -1.53 115.64 120.15 2c7h s THR 23 Ca 0.06 0.70 -0.08 0.00 -1.18 0.00 0.00 61.69 61.19 2c7h s THR 23 Cb -0.13 -3.71 -0.01 0.00 1.34 0.00 0.00 72.50 70.00 2c7h s THR 23 CO 0.03 0.35 0.16 0.72 -0.54 0.00 0.00 174.62 175.34 2c7h s PHE 24 N 0.61 0.17 -0.12 3.99 -0.71 -0.00 -4.99 117.98 116.93 2c7h s PHE 24 Ca 0.20 -0.57 -0.14 0.00 -1.04 0.00 0.00 56.93 55.38 2c7h s PHE 24 Cb -0.14 -0.09 -0.05 0.00 -1.21 0.00 0.00 43.02 41.53 2c7h s PHE 24 CO 0.06 -0.49 0.33 0.34 -1.34 0.00 0.00 175.22 174.12 2c7h s ASP 25 N -2.67 6.54 0.00 1.98 2.15 -1.26 -3.70 116.67 119.70 2c7h s ASP 25 Ca 0.03 0.64 0.00 0.00 0.43 0.00 0.00 52.55 53.64 2c7h s ASP 25 Cb 0.04 -2.20 0.00 0.00 -0.30 0.00 0.00 42.92 40.46 2c7h s ASP 25 CO -0.09 0.16 0.00 0.61 -0.17 0.00 0.00 175.17 175.68 2c7h n GLY 26 N 2.94 0.40 0.20 2.66 0.00 -1.26 -4.86 105.19 105.26 2c7h n GLY 26 Ca -0.12 -1.78 0.00 0.00 0.00 0.00 0.00 46.02 44.12 2c7h n GLY 26 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2c7h n LEU 27 N 0.00 2.37 -4.18 0.99 -0.00 -1.26 -4.63 117.00 110.29 2c7h n LEU 27 Ca 0.00 0.00 -0.17 0.00 -0.00 0.00 0.00 56.01 55.84 2c7h n LEU 27 Cb 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 43.42 43.31 2c7h n LEU 27 CO 0.00 0.39 -0.44 -1.38 -0.00 0.00 0.00 177.39 175.96 2c7h s HIS 28 N -1.99 1.17 -0.13 1.96 -3.43 -1.26 -1.36 115.29 110.25 2c7h s HIS 28 Ca 0.00 -0.55 0.02 0.00 -0.80 0.00 0.00 55.06 53.74 2c7h s HIS 28 Cb 0.00 -0.64 0.01 0.00 -1.43 0.00 0.00 32.58 30.52 2c7h s HIS 28 CO 0.00 0.05 -0.21 -1.50 -2.00 0.00 0.00 174.74 171.08 2c7h s ILE 29 N -1.85 2.17 0.40 -5.38 2.07 0.49 -4.89 121.20 114.21 2c7h s ILE 29 Ca 0.02 -0.95 -0.26 0.00 -1.41 0.00 0.00 60.65 58.06 2c7h s ILE 29 Cb -0.07 -1.87 -0.10 0.00 0.13 0.00 0.00 42.46 40.55 2c7h s ILE 29 CO 0.02 0.55 1.21 -1.20 -1.91 0.00 0.00 174.94 173.60 2c7h n SER 30 N 3.96 2.28 -0.27 4.50 7.64 -1.26 0.29 113.62 130.75 2c7h n SER 30 Ca -0.20 1.11 0.03 0.00 1.01 0.00 0.00 58.87 60.82 2c7h n SER 30 Cb 0.52 -1.46 0.25 0.00 -1.01 0.00 0.00 64.21 62.50 2c7h n SER 30 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 2c7h h LEU 31 N 2.04 0.88 -0.44 -3.43 5.85 0.11 0.89 115.31 121.22 2c7h h LEU 31 Ca -0.47 -0.00 0.05 0.00 0.84 0.00 0.00 57.88 58.30 2c7h h LEU 31 Cb 1.30 -0.20 -0.05 0.00 0.37 0.00 0.00 40.66 42.09 2c7h h LEU 31 CO 0.60 0.59 0.17 0.00 -0.34 0.00 0.00 178.44 179.46 2c7h h ASP 33 N 0.34 0.80 -0.15 0.00 3.58 -1.41 -1.69 116.42 117.89 2c7h h ASP 33 Ca 0.21 -0.37 -0.05 0.00 0.42 0.00 0.00 57.03 57.23 2c7h h ASP 33 Cb 0.19 -0.22 -0.00 0.00 1.72 0.00 0.00 39.33 41.01 2c7h h ASP 33 CO -0.20 1.11 -0.11 0.25 -2.88 0.00 0.00 179.24 177.41 2c7h h LEU 34 N 0.60 0.36 -0.62 2.28 6.46 -0.49 -2.29 115.31 121.61 2c7h h LEU 34 Ca 0.04 -0.45 -0.09 0.00 -0.12 0.00 0.00 57.88 57.26 2c7h h LEU 34 Cb 0.97 -0.10 -0.02 0.00 -0.73 0.00 0.00 40.66 40.78 2c7h h LEU 34 CO 0.09 0.73 0.02 0.11 -0.62 0.00 0.00 178.44 178.77 2c7h h LYS 35 N -0.01 1.09 -0.39 1.25 1.57 -0.34 -1.31 116.57 118.42 2c7h h LYS 35 Ca 0.03 -0.34 -0.05 0.00 -1.87 0.00 0.00 60.65 58.42 2c7h h LYS 35 Cb 0.61 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.80 2c7h h LYS 35 CO 0.03 1.05 0.03 0.87 -0.57 0.00 0.00 179.45 180.85 2c7h h LYS 36 N 0.99 0.61 -0.19 3.15 6.56 -1.32 0.18 116.57 126.55 2c7h h LYS 36 Ca 0.18 -0.13 -0.02 0.00 -1.06 0.00 0.00 60.65 59.62 2c7h h LYS 36 Cb 0.54 -0.09 -0.01 0.00 -0.57 0.00 0.00 32.23 32.11 2c7h h LYS 36 CO 0.03 0.61 0.04 1.96 -2.06 0.00 0.00 179.45 180.03 2c7h h GLN 37 N 0.58 0.32 -0.34 3.15 4.20 -0.87 -1.77 115.11 120.38 2c7h h GLN 37 Ca 0.13 -0.08 -0.05 0.00 0.06 0.00 0.00 58.65 58.71 2c7h h GLN 37 Cb 0.33 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.06 2c7h h GLN 37 CO 0.01 0.47 0.03 0.82 -0.67 0.00 0.00 178.83 179.49 2c7h h ILE 38 N 0.12 1.25 -0.62 2.54 2.04 -0.79 0.49 117.51 122.54 2c7h h ILE 38 Ca 0.06 -0.89 0.00 0.00 1.00 0.00 0.00 64.86 65.03 2c7h h ILE 38 Cb 0.30 1.16 -0.03 0.00 -0.74 0.00 0.00 36.82 37.51 2c7h h ILE 38 CO 0.00 0.30 0.40 0.24 0.00 0.00 0.00 178.15 179.09 2c7h h MET 39 N 0.41 0.82 -0.13 2.37 2.86 -0.66 0.83 114.93 121.42 2c7h h MET 39 Ca 0.10 -0.05 -0.11 0.00 -2.06 0.00 0.00 59.70 57.58 2c7h h MET 39 Cb 0.40 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 31.86 2c7h h MET 39 CO 0.01 0.55 -0.42 0.78 1.06 0.00 0.00 176.91 178.89 2c7h h GLY 40 N 0.84 0.33 0.45 8.32 0.00 -1.13 0.25 103.07 112.13 2c7h h GLY 40 Ca 0.23 -0.32 -0.00 0.00 0.00 0.00 0.00 47.33 47.23 2c7h h GLY 40 CO -0.05 0.29 -0.03 -0.09 0.00 0.00 0.00 176.54 176.66 2c7h h ARG 41 N 0.25 -0.07 -0.00 4.80 2.43 -0.32 -3.30 114.38 118.17 2c7h h ARG 41 Ca 0.02 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 2c7h h ARG 41 Cb 0.84 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.41 2c7h h ARG 41 CO 0.07 0.43 -0.15 0.39 -1.51 0.00 0.00 179.97 179.20 2c7h n GLU 42 N -4.87 0.44 -3.01 0.20 -0.58 0.23 -4.89 120.64 108.16 2c7h n GLU 42 Ca -0.09 -0.15 -0.12 0.00 -0.42 0.00 0.00 57.16 56.38 2c7h n GLU 42 Cb 0.27 -1.50 0.06 0.00 -0.57 0.00 0.00 31.44 29.70 2c7h n GLU 42 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2c7h n LYS 43 N -1.15 -4.57 -2.78 3.49 4.76 -0.33 -4.95 118.16 112.64 2c7h n LYS 43 Ca 0.12 0.55 -0.43 0.00 -2.87 0.00 0.00 58.31 55.68 2c7h n LYS 43 Cb 0.30 -4.69 -0.03 0.00 -1.84 0.00 0.00 35.03 28.76 2c7h n LYS 43 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 2c7h s LEU 44 N -4.91 3.99 -0.41 -0.35 2.96 0.73 -4.98 118.68 115.71 2c7h s LEU 44 Ca 0.12 0.75 -0.29 0.00 -0.22 0.00 0.00 54.13 54.49 2c7h s LEU 44 Cb -0.05 -3.31 0.01 0.00 0.50 0.00 0.00 46.19 43.33 2c7h s LEU 44 CO 0.47 -0.81 1.44 -1.59 -1.32 0.00 0.00 176.35 174.54 2c7h s LYS 45 N 3.42 3.55 0.00 1.98 0.00 -1.26 -4.77 119.74 122.66 2c7h s LYS 45 Ca 0.39 0.96 0.27 0.00 0.00 0.00 0.00 55.97 57.59 2c7h s LYS 45 Cb -0.12 -4.04 1.23 0.00 0.00 0.00 0.00 37.83 34.90 2c7h s LYS 45 CO 0.16 -1.60 1.88 0.00 0.00 0.00 0.00 175.35 175.80 2c7h n ALA 46 N 8.96 2.27 1.58 0.59 0.00 -1.26 -2.23 120.51 130.43 2c7h n ALA 46 Ca 0.17 -0.11 0.14 0.00 0.00 0.00 0.00 53.44 53.65 2c7h n ALA 46 Cb 0.48 -1.44 0.65 0.00 0.00 0.00 0.00 19.45 19.14 2c7h n ALA 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2c7h n ALA 47 N -1.42 2.70 -0.07 0.00 0.00 -1.26 -4.02 120.51 116.44 2c7h n ALA 47 Ca 0.09 -0.33 -0.15 0.00 0.00 0.00 0.00 53.44 53.06 2c7h n ALA 47 Cb 0.27 -1.30 -0.05 0.00 0.00 0.00 0.00 19.45 18.37 2c7h n ALA 47 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2c7h n ASP 48 N -0.51 1.16 -4.14 0.00 2.03 -0.95 -5.01 116.55 109.13 2c7h n ASP 48 Ca 0.18 0.20 -0.09 0.00 0.52 0.00 0.00 54.79 55.60 2c7h n ASP 48 Cb 0.27 -0.47 -0.10 0.00 -0.72 0.00 0.00 41.12 40.10 2c7h n ASP 48 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2c7h s ASP 50 N -3.03 4.88 -0.25 0.00 -1.08 0.18 -4.22 116.67 113.16 2c7h s ASP 50 Ca 0.22 -0.85 0.01 0.00 -0.52 0.00 0.00 52.55 51.41 2c7h s ASP 50 Cb 0.08 -0.48 0.05 0.00 -1.46 0.00 0.00 42.92 41.10 2c7h s ASP 50 CO 0.00 -0.66 -0.10 -0.22 0.52 0.00 0.00 175.17 174.71 2c7h s LEU 51 N -4.09 3.24 -0.23 -1.34 2.96 -1.26 -1.29 118.68 116.67 2c7h s LEU 51 Ca 0.46 -1.17 -0.09 0.00 -0.22 0.00 0.00 54.13 53.10 2c7h s LEU 51 Cb -0.01 -1.58 -0.04 0.00 0.50 0.00 0.00 46.19 45.05 2c7h s LEU 51 CO 0.26 -0.16 0.12 -1.58 -1.32 0.00 0.00 176.35 173.68 2c7h s GLN 52 N 1.19 3.98 -0.11 1.98 0.74 0.10 -4.97 119.66 122.57 2c7h s GLN 52 Ca -0.05 -0.32 0.00 0.00 0.05 0.00 0.00 55.36 55.05 2c7h s GLN 52 Cb -0.18 -3.42 -0.02 0.00 1.10 0.00 0.00 33.01 30.49 2c7h s GLN 52 CO -0.06 0.08 -0.12 0.42 -0.55 0.00 0.00 175.29 175.07 2c7h s ILE 53 N 0.95 3.20 -0.00 -2.34 -1.09 -1.23 0.10 121.20 120.80 2c7h s ILE 53 Ca 0.06 -0.62 0.06 0.00 -2.23 0.00 0.00 60.65 57.91 2c7h s ILE 53 Cb -0.13 -2.33 -0.02 0.00 -1.58 0.00 0.00 42.46 38.40 2c7h s ILE 53 CO 0.03 0.54 -0.18 -0.89 -1.23 0.00 0.00 174.94 173.21 2c7h s THR 54 N 0.05 1.42 0.10 2.92 2.01 0.60 0.06 115.64 122.81 2c7h s THR 54 Ca -0.04 -0.85 -0.31 0.00 0.31 0.00 0.00 61.69 60.80 2c7h s THR 54 Cb -0.14 -1.20 -0.11 0.00 0.01 0.00 0.00 72.50 71.07 2c7h s THR 54 CO 0.04 0.33 1.86 0.59 -0.69 0.00 0.00 174.62 176.76 2c7h n ASN 55 N 2.46 4.04 0.16 3.53 5.03 0.11 0.71 115.26 131.30 2c7h n ASN 55 Ca -0.15 0.97 0.02 0.00 0.87 0.00 0.00 54.58 56.29 2c7h n ASN 55 Cb 0.54 -1.54 0.27 0.00 -1.02 0.00 0.00 39.78 38.04 2c7h n ASN 55 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2c7h h ALA 56 N 8.89 1.09 0.02 5.41 0.00 -1.66 -0.47 119.26 132.55 2c7h h ALA 56 Ca -0.47 -0.44 -0.25 0.00 0.00 0.00 0.00 54.91 53.74 2c7h h ALA 56 Cb 1.23 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.91 2c7h h ALA 56 CO 0.95 0.61 -1.38 1.96 0.00 0.00 0.00 179.25 181.38 2c7h h GLN 57 N 0.00 0.05 -0.00 0.00 4.20 -1.90 -3.40 115.11 114.05 2c7h h GLN 57 Ca -0.00 -0.09 0.00 0.00 0.06 0.00 0.00 58.65 58.62 2c7h h GLN 57 Cb 0.92 0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.73 2c7h h GLN 57 CO 0.06 1.04 -0.65 0.25 -0.67 0.00 0.00 178.83 178.86 2c7h n THR 58 N -4.27 0.00 -2.01 -0.54 -2.24 -1.25 -4.97 114.28 99.01 2c7h n THR 58 Ca -0.32 -0.18 -0.20 0.00 -2.27 0.00 0.00 64.05 61.08 2c7h n THR 58 Cb 0.75 1.08 -0.05 0.00 -2.10 0.00 0.00 70.33 70.01 2c7h n THR 58 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2c7h n LYS 59 N -0.91 -1.59 -2.68 -0.78 4.01 -0.19 -4.96 118.16 111.06 2c7h n LYS 59 Ca 0.05 1.09 -0.42 0.00 -0.51 0.00 0.00 58.31 58.51 2c7h n LYS 59 Cb 0.31 -5.61 -0.03 0.00 -0.51 0.00 0.00 35.03 29.19 2c7h n LYS 59 CO 0.00 0.00 0.00 -2.00 -1.11 0.00 0.00 177.40 174.29 2c7h s GLU 60 N -4.40 4.44 0.00 1.97 2.12 -1.26 -4.70 118.70 116.87 2c7h s GLU 60 Ca 0.00 1.41 -0.17 0.00 0.36 0.00 0.00 54.97 56.57 2c7h s GLU 60 Cb 0.00 -3.53 -0.06 0.00 0.26 0.00 0.00 34.13 30.80 2c7h s GLU 60 CO 0.00 -0.28 0.49 -2.00 -0.54 0.00 0.00 175.26 172.93 2c7h s GLU 61 N 1.86 4.13 -0.42 4.30 2.12 -1.26 0.07 118.70 129.49 2c7h s GLU 61 Ca 0.49 0.56 -0.12 0.00 0.36 0.00 0.00 54.97 56.27 2c7h s GLU 61 Cb -0.19 -3.28 0.06 0.00 0.26 0.00 0.00 34.13 30.98 2c7h s GLU 61 CO 0.20 0.55 0.29 0.71 -0.54 0.00 0.00 175.26 176.46 2c7h s TYR 62 N -0.70 3.28 -0.21 5.30 2.02 0.11 -4.90 117.35 122.26 2c7h s TYR 62 Ca 0.27 -1.17 0.20 0.00 -0.37 0.00 0.00 57.07 56.00 2c7h s TYR 62 Cb -0.17 -2.86 -0.29 0.00 -0.40 0.00 0.00 41.96 38.24 2c7h s TYR 62 CO 0.15 -0.77 0.51 0.25 -1.57 0.00 0.00 175.55 174.13 2c7h n THR 63 N 5.03 0.00 -4.32 -0.71 -2.24 -1.26 -3.47 114.28 107.30 2c7h n THR 63 Ca -0.11 -0.37 -0.35 0.00 -2.27 0.00 0.00 64.05 60.95 2c7h n THR 63 Cb 0.44 0.25 -0.09 0.00 -2.10 0.00 0.00 70.33 68.83 2c7h n THR 63 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2c7h s ASP 64 N -3.97 5.36 0.41 3.42 -1.08 -1.26 -4.98 116.67 114.57 2c7h s ASP 64 Ca -0.04 0.18 0.29 0.00 -0.52 0.00 0.00 52.55 52.45 2c7h s ASP 64 Cb 0.13 -1.54 1.46 0.00 -1.46 0.00 0.00 42.92 41.51 2c7h s ASP 64 CO 0.81 0.38 1.87 0.44 0.52 0.00 0.00 175.17 179.19 2c7h h ASP 65 N 5.17 0.00 0.90 -0.34 5.19 -1.92 -1.37 116.42 124.05 2c7h h ASP 65 Ca -0.51 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.90 2c7h h ASP 65 Cb 1.20 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.71 2c7h h ASP 65 CO 0.55 0.00 0.00 -0.46 -3.12 0.00 0.00 179.24 176.21 2c7h n ASN 66 N -2.52 0.06 -4.77 6.45 2.04 -1.26 -1.16 115.26 114.09 2c7h n ASN 66 Ca -0.01 0.51 -0.35 0.00 -0.44 0.00 0.00 54.58 54.29 2c7h n ASN 66 Cb 0.10 -0.52 0.01 0.00 -2.53 0.00 0.00 39.78 36.84 2c7h n ASN 66 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 2c7h s ALA 67 N -3.01 2.67 -0.04 -2.53 0.00 -0.52 -4.75 121.76 113.58 2c7h s ALA 67 Ca 0.12 0.84 0.06 0.00 0.00 0.00 0.00 51.96 52.98 2c7h s ALA 67 Cb 0.16 -3.37 -0.02 0.00 0.00 0.00 0.00 23.12 19.89 2c7h s ALA 67 CO 0.47 -0.84 -0.23 -0.48 0.00 0.00 0.00 175.76 174.68 2c7h s LEU 68 N -3.87 2.19 -0.20 0.00 0.05 -1.26 0.12 118.68 115.71 2c7h s LEU 68 Ca 0.73 -0.43 0.01 0.00 0.05 0.00 0.00 54.13 54.49 2c7h s LEU 68 Cb -0.24 -1.39 0.03 0.00 -2.05 0.00 0.00 46.19 42.53 2c7h s LEU 68 CO 0.28 0.30 -0.16 -0.63 -0.55 0.00 0.00 176.35 175.59 2c7h s ILE 69 N -0.47 1.96 0.57 1.48 1.09 0.14 -4.91 121.20 121.07 2c7h s ILE 69 Ca 0.06 -1.05 -0.16 0.00 -1.10 0.00 0.00 60.65 58.39 2c7h s ILE 69 Cb -0.11 -1.88 -0.05 0.00 -1.06 0.00 0.00 42.46 39.36 2c7h s ILE 69 CO 0.01 0.36 1.03 -2.16 -0.10 0.00 0.00 174.94 174.08 2c7h s PRO 70 N 1.29 3.56 0.00 2.79 0.04 -1.26 -0.38 135.00 141.04 2c7h s PRO 70 Ca 0.01 1.09 0.18 0.00 0.04 0.00 0.00 61.00 62.32 2c7h s PRO 70 Cb -0.15 -2.07 0.83 0.00 0.04 0.00 0.00 34.50 33.15 2c7h s PRO 70 CO -0.10 -0.60 1.58 0.36 0.04 0.00 0.00 177.00 178.27 2c7h n LYS 71 N -1.90 0.09 0.00 4.56 -0.00 -0.46 -1.56 118.16 118.88 2c7h n LYS 71 Ca 0.08 0.16 0.15 0.00 -0.00 0.00 0.00 58.31 58.70 2c7h n LYS 71 Cb 0.53 -1.50 0.68 0.00 -0.00 0.00 0.00 35.03 34.74 2c7h n LYS 71 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 2c7h n ASN 72 N -1.43 0.69 -4.70 -5.58 3.02 -1.26 -4.70 115.26 101.30 2c7h n ASN 72 Ca 0.06 -1.03 -0.31 0.00 -0.03 0.00 0.00 54.58 53.27 2c7h n ASN 72 Cb 0.19 -0.02 -0.09 0.00 -0.61 0.00 0.00 39.78 39.25 2c7h n ASN 72 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 2c7h s SER 73 N -2.17 4.03 -0.00 6.41 0.01 -0.60 -5.13 113.70 116.25 2c7h s SER 73 Ca 0.38 -1.52 0.01 0.00 1.31 0.00 0.00 55.95 56.13 2c7h s SER 73 Cb 0.21 0.10 -0.00 0.00 0.21 0.00 0.00 66.02 66.54 2c7h s SER 73 CO 0.40 -0.67 -0.03 -0.44 0.41 0.00 0.00 173.24 172.91 2c7h s SER 74 N -3.81 0.30 0.16 2.44 0.01 -1.26 -3.81 113.70 107.73 2c7h s SER 74 Ca 0.19 -0.05 0.04 0.00 1.31 0.00 0.00 55.95 57.44 2c7h s SER 74 Cb 0.05 -0.03 -0.05 0.00 0.21 0.00 0.00 66.02 66.20 2c7h s SER 74 CO 0.10 0.03 -0.06 0.68 0.41 0.00 0.00 173.24 174.40 2c7h s VAL 75 N -0.05 1.01 -0.15 3.43 -7.23 0.31 -1.86 120.40 115.85 2c7h s VAL 75 Ca 0.01 -2.03 -0.05 0.00 -1.81 0.00 0.00 61.98 58.10 2c7h s VAL 75 Cb -0.01 -1.95 -0.03 0.00 0.56 0.00 0.00 36.38 34.94 2c7h s VAL 75 CO -0.00 -0.65 0.01 -0.63 -0.31 0.00 0.00 175.10 173.52 2c7h s ILE 76 N -3.43 4.36 -0.29 -0.62 -1.09 0.22 -1.46 121.20 118.89 2c7h s ILE 76 Ca 0.19 -0.20 -0.09 0.00 -2.23 0.00 0.00 60.65 58.33 2c7h s ILE 76 Cb 0.04 -2.92 -0.01 0.00 -1.58 0.00 0.00 42.46 37.99 2c7h s ILE 76 CO 0.02 0.50 0.12 -0.69 -1.23 0.00 0.00 174.94 173.66 2c7h s VAL 77 N 0.12 4.49 -0.17 2.92 1.01 0.16 -0.29 120.40 128.64 2c7h s VAL 77 Ca 0.02 -0.33 0.01 0.00 0.00 0.00 0.00 61.98 61.68 2c7h s VAL 77 Cb -0.13 -3.22 0.02 0.00 0.00 0.00 0.00 36.38 33.05 2c7h s VAL 77 CO 0.02 0.17 -0.20 -0.60 0.00 0.00 0.00 175.10 174.48 2c7h s ARG 78 N 1.61 3.01 -0.27 2.72 3.52 0.12 -2.47 118.95 127.19 2c7h s ARG 78 Ca 0.05 -0.83 -0.28 0.00 -0.13 0.00 0.00 55.73 54.55 2c7h s ARG 78 Cb -0.16 -2.55 0.01 0.00 -1.56 0.00 0.00 34.95 30.68 2c7h s ARG 78 CO 0.05 -0.16 0.98 0.50 -0.81 0.00 0.00 175.30 175.86 2c7h s ARG 79 N 1.18 4.16 0.16 5.12 3.52 -1.26 0.01 118.95 131.83 2c7h s ARG 79 Ca 0.02 1.11 0.09 0.00 -0.13 0.00 0.00 55.73 56.82 2c7h s ARG 79 Cb -0.14 -3.68 -0.04 0.00 -1.56 0.00 0.00 34.95 29.53 2c7h s ARG 79 CO -0.10 -0.69 -0.20 0.96 -0.81 0.00 0.00 175.30 174.45 2c7h s ILE 80 N 3.24 1.95 0.19 4.11 -5.25 -0.41 -4.95 121.20 120.08 2c7h s ILE 80 Ca 0.41 -1.89 -0.32 0.00 -0.99 0.00 0.00 60.65 57.87 2c7h s ILE 80 Cb -0.14 -1.88 -0.11 0.00 2.95 0.00 0.00 42.46 43.28 2c7h s ILE 80 CO 0.10 -0.21 1.67 -2.16 -1.79 0.00 0.00 174.94 172.54 2c7h s PRO 81 N -2.61 4.16 0.36 0.37 0.04 -1.26 0.51 135.00 136.57 2c7h s PRO 81 Ca 0.16 2.52 0.18 0.00 0.04 0.00 0.00 61.00 63.89 2c7h s PRO 81 Cb -0.07 -3.13 1.17 0.00 0.04 0.00 0.00 34.50 32.50 2c7h s PRO 81 CO 0.07 -0.70 1.65 -0.84 0.04 0.00 0.00 177.00 177.22 2c7h h ILE 82 N 3.94 0.25 0.00 0.56 3.07 -1.84 -2.16 117.51 121.33 2c7h h ILE 82 Ca -0.43 -0.09 -0.00 0.00 1.55 0.00 0.00 64.86 65.89 2c7h h ILE 82 Cb 1.20 -0.03 -0.01 0.00 -0.27 0.00 0.00 36.82 37.72 2c7h h ILE 82 CO 0.94 0.05 -0.35 0.61 -1.05 0.00 0.00 178.15 178.34 2c7h n GLY 83 N -1.33 1.94 4.40 0.16 0.00 -1.26 -4.89 105.19 104.22 2c7h n GLY 83 Ca 0.33 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.96 2c7h n GLY 83 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2c7h n GLY 84 N -0.45 1.76 3.61 -0.02 0.00 -0.81 -4.79 105.19 104.49 2c7h n GLY 84 Ca 0.05 -0.10 -0.42 0.00 0.00 0.00 0.00 46.02 45.56 2c7h n GLY 84 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2c7h s VAL 85 N 0.00 4.78 -2.33 1.61 1.01 -1.26 -4.81 120.40 119.40 2c7h s VAL 85 Ca 0.00 1.21 0.29 0.00 0.00 0.00 0.00 61.98 63.48 2c7h s VAL 85 Cb 0.00 -4.16 0.67 0.00 0.00 0.00 0.00 36.38 32.89 2c7h s VAL 85 CO 0.00 -0.27 1.91 0.29 0.00 0.00 0.00 175.10 177.03