#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c97 n ALA 15 N 0.00 0.00 0.22 2.24 0.00 -1.26 -4.48 120.51 117.24 2c97 n ALA 15 Ca 0.00 0.00 0.16 0.00 0.00 0.00 0.00 53.44 53.60 2c97 n ALA 15 Cb 0.00 -0.15 0.84 0.00 0.00 0.00 0.00 19.45 20.14 2c97 n ALA 15 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2c97 h SER 16 N 0.00 0.00 0.47 0.00 4.64 -1.82 -2.05 113.55 114.79 2c97 h SER 16 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2c97 h SER 16 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2c97 h SER 16 CO 0.00 0.00 -0.19 0.61 -0.87 0.00 0.00 176.83 176.38 2c97 n GLY 17 N -1.39 -1.04 3.72 -0.77 0.00 -1.26 -4.86 105.19 99.59 2c97 n GLY 17 Ca 0.01 -0.27 -0.42 0.00 0.00 0.00 0.00 46.02 45.33 2c97 n GLY 17 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2c97 s VAL 18 N -2.66 3.80 -0.52 1.61 1.01 -0.77 -4.99 120.40 117.88 2c97 s VAL 18 Ca 0.23 1.38 -0.21 0.00 0.00 0.00 0.00 61.98 63.37 2c97 s VAL 18 Cb 0.19 -3.88 0.05 0.00 0.00 0.00 0.00 36.38 32.74 2c97 s VAL 18 CO 0.53 0.15 0.75 -0.13 0.00 0.00 0.00 175.10 176.41 2c97 s ARG 19 N 0.53 3.23 -0.15 2.72 0.52 -1.26 -4.97 118.95 119.57 2c97 s ARG 19 Ca 0.57 -0.57 -0.07 0.00 -0.52 0.00 0.00 55.73 55.14 2c97 s ARG 19 Cb -0.31 -4.06 -0.04 0.00 0.52 0.00 0.00 34.95 31.06 2c97 s ARG 19 CO 0.32 -1.30 0.08 -1.17 0.02 0.00 0.00 175.30 173.25 2c97 s LEU 20 N 3.18 3.97 0.08 2.53 2.96 -1.26 -0.12 118.68 130.01 2c97 s LEU 20 Ca 0.22 0.22 0.09 0.00 -0.22 0.00 0.00 54.13 54.44 2c97 s LEU 20 Cb -0.16 -1.98 -0.03 0.00 0.50 0.00 0.00 46.19 44.52 2c97 s LEU 20 CO 0.16 0.28 -0.22 0.00 -1.32 0.00 0.00 176.35 175.24 2c97 s ALA 21 N -0.26 2.47 -0.11 5.97 0.00 -0.24 -1.59 121.76 128.00 2c97 s ALA 21 Ca 0.09 -1.31 -0.00 0.00 0.00 0.00 0.00 51.96 50.74 2c97 s ALA 21 Cb -0.12 -0.57 0.02 0.00 0.00 0.00 0.00 23.12 22.46 2c97 s ALA 21 CO 0.01 0.56 -0.07 0.42 0.00 0.00 0.00 175.76 176.68 2c97 s ILE 22 N -0.96 0.99 -0.19 0.00 1.01 0.18 -0.15 121.20 122.07 2c97 s ILE 22 Ca 0.14 -0.27 -0.03 0.00 0.00 0.00 0.00 60.65 60.49 2c97 s ILE 22 Cb -0.10 -1.01 -0.01 0.00 0.01 0.00 0.00 42.46 41.35 2c97 s ILE 22 CO 0.05 0.36 -0.08 0.54 0.00 0.00 0.00 174.94 175.82 2c97 s VAL 23 N 1.68 3.21 -0.06 2.92 0.11 0.11 -0.97 120.40 127.40 2c97 s VAL 23 Ca 0.04 -0.56 0.03 0.00 -2.93 0.00 0.00 61.98 58.56 2c97 s VAL 23 Cb -0.13 -2.43 0.01 0.00 -1.53 0.00 0.00 36.38 32.30 2c97 s VAL 23 CO -0.08 0.46 -0.14 0.00 -3.33 0.00 0.00 175.10 172.01 2c97 s ALA 24 N 1.17 1.40 0.96 1.54 0.00 -0.28 -0.66 121.76 125.90 2c97 s ALA 24 Ca 0.02 -0.53 -0.11 0.00 0.00 0.00 0.00 51.96 51.34 2c97 s ALA 24 Cb -0.14 -0.57 0.17 0.00 0.00 0.00 0.00 23.12 22.57 2c97 s ALA 24 CO -0.02 0.17 1.01 -1.13 0.00 0.00 0.00 175.76 175.78 2c97 n SER 25 N 3.63 0.19 0.00 0.00 3.41 -0.30 -0.89 113.62 119.66 2c97 n SER 25 Ca -0.21 -1.44 0.00 0.00 -0.26 0.00 0.00 58.87 56.96 2c97 n SER 25 Cb 0.52 -0.76 0.00 0.00 -0.26 0.00 0.00 64.21 63.71 2c97 n SER 25 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2c97 n SER 26 N -3.58 0.38 -0.05 4.04 7.64 0.71 -4.74 113.62 118.01 2c97 n SER 26 Ca 0.13 -0.98 0.24 0.00 1.01 0.00 0.00 58.87 59.28 2c97 n SER 26 Cb 0.45 0.01 0.72 0.00 -1.01 0.00 0.00 64.21 64.38 2c97 n SER 26 CO 0.00 0.00 0.00 -0.25 -3.01 0.00 0.00 175.04 171.78 2c97 h TRP 27 N 0.00 0.00 -2.66 1.43 2.91 -1.59 -2.90 115.95 113.14 2c97 h TRP 27 Ca 0.00 0.00 -0.60 0.00 1.13 0.00 0.00 58.89 59.42 2c97 h TRP 27 Cb 0.30 0.00 -0.39 0.00 -0.51 0.00 0.00 29.16 28.55 2c97 h TRP 27 CO 0.00 0.00 -0.83 -1.01 -1.03 0.00 0.00 178.44 175.57 2c97 s HIS 28 N -4.80 1.64 0.05 2.65 3.76 -1.26 -5.07 115.29 112.27 2c97 s HIS 28 Ca -0.05 -2.40 -0.10 0.00 -0.15 0.00 0.00 55.06 52.37 2c97 s HIS 28 Cb 0.18 -1.43 -0.02 0.00 1.11 0.00 0.00 32.58 32.42 2c97 s HIS 28 CO 0.66 -0.77 0.74 0.41 -0.85 0.00 0.00 174.74 174.93 2c97 n GLY 29 N 3.05 -1.63 0.21 -2.22 0.00 -1.10 -1.55 105.19 101.94 2c97 n GLY 29 Ca 0.20 0.52 -0.02 0.00 0.00 0.00 0.00 46.02 46.73 2c97 n GLY 29 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2c97 h LYS 30 N 0.00 0.29 0.02 1.61 3.64 -1.97 -0.35 116.57 119.80 2c97 h LYS 30 Ca 0.05 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.41 2c97 h LYS 30 Cb 0.13 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 31.88 2c97 h LYS 30 CO -0.29 0.19 -0.01 0.82 -2.27 0.00 0.00 179.45 177.89 2c97 h ILE 31 N 0.30 1.12 -0.48 2.00 2.04 -1.70 -2.45 117.51 118.33 2c97 h ILE 31 Ca 0.26 -0.42 0.03 0.00 1.00 0.00 0.00 64.86 65.73 2c97 h ILE 31 Cb 0.32 1.40 -0.03 0.00 -0.74 0.00 0.00 36.82 37.77 2c97 h ILE 31 CO -0.30 0.11 0.28 0.00 0.00 0.00 0.00 178.15 178.24 2c97 h ASP 33 N 0.56 0.85 -0.26 0.00 5.19 -1.08 -1.95 116.42 119.73 2c97 h ASP 33 Ca 0.20 -0.05 -0.04 0.00 -0.62 0.00 0.00 57.03 56.51 2c97 h ASP 33 Cb 0.04 -0.22 -0.01 0.00 0.18 0.00 0.00 39.33 39.32 2c97 h ASP 33 CO -0.10 0.67 -0.00 0.00 -3.12 0.00 0.00 179.24 176.69 2c97 h ALA 34 N 1.47 0.35 -0.49 3.45 0.00 -0.78 -1.06 119.26 122.20 2c97 h ALA 34 Ca 0.25 -0.22 0.08 0.00 0.00 0.00 0.00 54.91 55.02 2c97 h ALA 34 Cb -0.01 -0.10 -0.07 0.00 0.00 0.00 0.00 17.79 17.61 2c97 h ALA 34 CO -0.04 0.09 0.10 -0.07 0.00 0.00 0.00 179.25 179.32 2c97 h LEU 35 N 0.24 -0.00 -0.82 0.00 3.38 -1.15 -2.18 115.31 114.77 2c97 h LEU 35 Ca 0.07 0.09 -0.04 0.00 0.09 0.00 0.00 57.88 58.10 2c97 h LEU 35 Cb 0.42 0.12 -0.04 0.00 0.09 0.00 0.00 40.66 41.26 2c97 h LEU 35 CO 0.01 0.03 0.38 0.25 0.09 0.00 0.00 178.44 179.19 2c97 h LEU 36 N 0.23 1.09 -0.84 1.67 5.85 -1.16 -1.43 115.31 120.72 2c97 h LEU 36 Ca 0.25 -0.15 0.01 0.00 0.84 0.00 0.00 57.88 58.83 2c97 h LEU 36 Cb 0.33 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 41.04 2c97 h LEU 36 CO -0.33 0.94 0.55 -0.78 -0.34 0.00 0.00 178.44 178.48 2c97 h ASP 37 N 1.18 0.97 -0.44 1.25 -0.00 -0.95 -0.91 116.42 117.52 2c97 h ASP 37 Ca 0.28 -0.03 -0.07 0.00 -0.00 0.00 0.00 57.03 57.21 2c97 h ASP 37 Cb 0.15 -0.24 -0.02 0.00 -0.00 0.00 0.00 39.33 39.22 2c97 h ASP 37 CO -0.03 0.71 -0.00 1.23 -0.00 0.00 0.00 179.24 181.15 2c97 h GLY 38 N 1.14 0.84 0.99 -0.78 0.00 -0.89 -0.56 103.07 103.82 2c97 h GLY 38 Ca 0.31 -0.62 0.00 0.00 0.00 0.00 0.00 47.33 47.02 2c97 h GLY 38 CO -0.06 0.57 0.14 0.00 0.00 0.00 0.00 176.54 177.18 2c97 h ALA 39 N 0.90 0.27 -0.46 3.60 0.00 -1.05 -2.31 119.26 120.21 2c97 h ALA 39 Ca 0.12 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.91 2c97 h ALA 39 Cb 0.49 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 2c97 h ALA 39 CO 0.02 -0.24 -0.10 0.00 0.00 0.00 0.00 179.25 178.93 2c97 h ARG 40 N 0.28 0.83 -0.19 0.00 3.08 -1.09 -1.69 114.38 115.59 2c97 h ARG 40 Ca 0.08 -0.28 -0.09 0.00 0.07 0.00 0.00 59.98 59.76 2c97 h ARG 40 Cb -0.01 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 29.96 2c97 h ARG 40 CO -0.02 0.89 -0.29 0.87 -1.07 0.00 0.00 179.97 180.35 2c97 h LYS 41 N 0.75 0.36 -0.12 0.04 1.57 -0.95 -0.59 116.57 117.63 2c97 h LYS 41 Ca 0.13 -0.14 -0.04 0.00 -1.87 0.00 0.00 60.65 58.72 2c97 h LYS 41 Cb 0.59 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.88 2c97 h LYS 41 CO 0.04 0.63 -0.09 0.28 -0.57 0.00 0.00 179.45 179.74 2c97 h VAL 42 N 0.32 1.34 -0.41 0.50 2.07 -1.15 -0.77 116.25 118.14 2c97 h VAL 42 Ca 0.04 -1.19 0.06 0.00 0.82 0.00 0.00 66.70 66.44 2c97 h VAL 42 Cb 0.68 1.87 -0.05 0.00 -1.52 0.00 0.00 31.29 32.27 2c97 h VAL 42 CO 0.05 0.34 0.10 0.00 0.02 0.00 0.00 177.57 178.08 2c97 h ALA 43 N 0.62 0.46 -0.76 1.67 0.00 -1.14 -1.22 119.26 118.88 2c97 h ALA 43 Ca 0.02 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 2c97 h ALA 43 Cb 0.58 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.42 2c97 h ALA 43 CO 0.02 -0.30 0.42 0.00 0.00 0.00 0.00 179.25 179.39 2c97 h ALA 44 N 1.30 1.30 0.00 0.00 0.00 -0.76 0.21 119.26 121.32 2c97 h ALA 44 Ca 0.20 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 2c97 h ALA 44 Cb 0.23 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2c97 h ALA 44 CO -0.24 0.57 -0.18 0.78 0.00 0.00 0.00 179.25 180.17 2c97 h GLY 45 N 1.10 0.00 -3.47 0.00 0.00 -0.21 -2.55 103.07 97.94 2c97 h GLY 45 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.60 2c97 h GLY 45 CO -0.04 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.50 2c97 n GLY 47 N 0.66 0.44 3.05 0.00 0.00 -0.96 -3.20 105.19 105.18 2c97 n GLY 47 Ca 0.27 -0.94 -0.34 0.00 0.00 0.00 0.00 46.02 45.00 2c97 n GLY 47 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2c97 s LEU 48 N 0.00 4.94 0.40 0.99 1.02 0.68 -4.69 118.68 122.03 2c97 s LEU 48 Ca 0.00 -2.96 0.22 0.00 0.02 0.00 0.00 54.13 51.41 2c97 s LEU 48 Cb 0.00 -1.79 0.28 0.00 0.02 0.00 0.00 46.19 44.71 2c97 s LEU 48 CO 0.00 -0.31 1.55 0.44 0.02 0.00 0.00 176.35 178.05 2c97 h ASP 49 N 6.79 0.00 -1.57 2.29 3.32 -1.87 -2.70 116.42 122.68 2c97 h ASP 49 Ca -0.03 0.00 -0.48 0.00 0.02 0.00 0.00 57.03 56.54 2c97 h ASP 49 Cb 0.92 0.00 -0.41 0.00 0.22 0.00 0.00 39.33 40.07 2c97 h ASP 49 CO 0.71 0.07 -1.01 -0.67 -1.72 0.00 0.00 179.24 176.62 2c97 n ASP 50 N -3.09 2.49 -4.75 6.45 2.03 -1.26 -4.96 116.55 113.45 2c97 n ASP 50 Ca 0.03 -3.16 -0.32 0.00 0.52 0.00 0.00 54.79 51.86 2c97 n ASP 50 Cb 0.56 -0.54 0.10 0.00 -0.72 0.00 0.00 41.12 40.52 2c97 n ASP 50 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 2c97 s PRO 51 N -3.09 2.12 -0.21 -0.67 0.04 -1.26 -4.96 135.00 126.97 2c97 s PRO 51 Ca 0.38 1.33 -0.29 0.00 0.04 0.00 0.00 61.00 62.46 2c97 s PRO 51 Cb 0.39 -1.87 -0.00 0.00 0.04 0.00 0.00 34.50 33.06 2c97 s PRO 51 CO -0.07 -1.77 1.19 0.99 0.04 0.00 0.00 177.00 177.38 2c97 s THR 52 N -2.68 4.40 -0.18 1.26 2.01 -0.62 -4.92 115.64 114.91 2c97 s THR 52 Ca 0.64 1.67 -0.02 0.00 0.31 0.00 0.00 61.69 64.30 2c97 s THR 52 Cb -0.20 -4.14 -0.01 0.00 0.01 0.00 0.00 72.50 68.16 2c97 s THR 52 CO 0.53 -0.22 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.45 2c97 s VAL 53 N 3.53 3.05 -0.01 3.82 1.01 -1.26 0.47 120.40 131.01 2c97 s VAL 53 Ca 0.51 -0.63 0.05 0.00 0.00 0.00 0.00 61.98 61.92 2c97 s VAL 53 Cb -0.18 -2.33 -0.01 0.00 0.00 0.00 0.00 36.38 33.85 2c97 s VAL 53 CO 0.13 0.48 -0.17 -0.69 0.00 0.00 0.00 175.10 174.85 2c97 s VAL 54 N 1.01 1.32 -0.12 2.92 1.01 -0.14 -4.99 120.40 121.41 2c97 s VAL 54 Ca -0.01 -0.71 -0.04 0.00 0.00 0.00 0.00 61.98 61.22 2c97 s VAL 54 Cb -0.15 -1.10 -0.04 0.00 0.00 0.00 0.00 36.38 35.09 2c97 s VAL 54 CO -0.01 0.38 0.03 -0.13 0.00 0.00 0.00 175.10 175.36 2c97 s ARG 55 N -0.37 3.39 0.30 2.72 1.81 -1.26 -1.12 118.95 124.43 2c97 s ARG 55 Ca 0.06 -0.37 0.06 0.00 -1.72 0.00 0.00 55.73 53.76 2c97 s ARG 55 Cb -0.07 -2.96 -0.06 0.00 -0.45 0.00 0.00 34.95 31.41 2c97 s ARG 55 CO -0.00 0.54 -0.03 0.14 -0.68 0.00 0.00 175.30 175.26 2c97 s VAL 56 N -0.41 1.63 -0.00 3.52 -7.23 -0.07 -4.95 120.40 112.89 2c97 s VAL 56 Ca 0.08 -2.09 -0.12 0.00 -1.81 0.00 0.00 61.98 58.04 2c97 s VAL 56 Cb -0.12 -2.58 -0.07 0.00 0.56 0.00 0.00 36.38 34.18 2c97 s VAL 56 CO 0.02 -0.21 0.78 0.25 -0.31 0.00 0.00 175.10 175.63 2c97 h LEU 57 N 2.19 -0.37 -9.39 1.32 5.85 -1.92 -1.17 115.31 111.81 2c97 h LEU 57 Ca -0.41 0.01 -0.53 0.00 0.84 0.00 0.00 57.88 57.80 2c97 h LEU 57 Cb 1.24 0.10 -0.14 0.00 0.37 0.00 0.00 40.66 42.23 2c97 h LEU 57 CO 0.69 -0.16 -0.57 -0.83 -0.34 0.00 0.00 178.44 177.24 2c97 s GLY 58 N -2.06 2.35 0.43 3.75 0.00 -1.26 -0.21 107.32 110.33 2c97 s GLY 58 Ca -0.06 -1.67 0.17 0.00 0.00 0.00 0.00 44.72 43.16 2c97 s GLY 58 CO 0.19 -1.87 1.90 0.00 0.00 0.00 0.00 173.10 173.32 2c97 h ALA 59 N 1.93 2.18 0.00 3.20 0.00 -1.92 -2.02 119.26 122.62 2c97 h ALA 59 Ca -0.40 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.50 2c97 h ALA 59 Cb 1.26 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.00 2c97 h ALA 59 CO 0.67 -0.41 -0.10 0.82 0.00 0.00 0.00 179.25 180.24 2c97 h ILE 60 N 0.39 0.41 0.00 0.00 2.04 -1.96 -2.14 117.51 116.25 2c97 h ILE 60 Ca 0.40 -0.51 0.00 0.00 1.00 0.00 0.00 64.86 65.74 2c97 h ILE 60 Cb 0.98 1.36 0.00 0.00 -0.74 0.00 0.00 36.82 38.42 2c97 h ILE 60 CO -0.13 0.09 -0.30 -0.33 0.00 0.00 0.00 178.15 177.49 2c97 h GLU 61 N 0.00 0.00 -0.05 2.37 3.07 -1.78 -3.39 114.58 114.80 2c97 h GLU 61 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2c97 h GLU 61 Cb 0.35 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.26 2c97 h GLU 61 CO 0.01 0.00 0.02 0.82 -1.40 0.00 0.00 179.01 178.46 2c97 h ILE 62 N 0.00 0.99 -0.38 3.13 2.04 -1.45 -3.16 117.51 118.69 2c97 h ILE 62 Ca 0.00 -0.01 0.05 0.00 1.00 0.00 0.00 64.86 65.90 2c97 h ILE 62 Cb 0.88 0.95 -0.05 0.00 -0.74 0.00 0.00 36.82 37.86 2c97 h ILE 62 CO 0.00 0.01 0.11 -0.65 0.00 0.00 0.00 178.15 177.62 2c97 h PRO 63 N 0.04 0.24 -0.41 2.37 0.11 -1.76 0.62 132.00 133.21 2c97 h PRO 63 Ca 0.02 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 66.07 2c97 h PRO 63 Cb 0.01 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 31.04 2c97 h PRO 63 CO -0.02 0.16 0.05 -0.24 -0.21 0.00 0.00 178.00 177.74 2c97 h VAL 64 N 0.25 1.20 -0.10 3.15 3.04 -1.84 0.20 116.25 122.15 2c97 h VAL 64 Ca 0.18 -0.78 -0.23 0.00 -1.01 0.00 0.00 66.70 64.86 2c97 h VAL 64 Cb 0.18 0.84 0.01 0.00 -2.01 0.00 0.00 31.29 30.31 2c97 h VAL 64 CO -0.20 0.28 -0.84 0.58 -1.01 0.00 0.00 177.57 176.38 2c97 h VAL 65 N 0.61 1.30 -0.70 1.51 2.07 -1.38 -2.77 116.25 116.89 2c97 h VAL 65 Ca 0.13 -2.08 0.04 0.00 0.82 0.00 0.00 66.70 65.61 2c97 h VAL 65 Cb 0.31 2.10 -0.04 0.00 -1.52 0.00 0.00 31.29 32.14 2c97 h VAL 65 CO 0.01 0.65 0.46 0.00 0.02 0.00 0.00 177.57 178.70 2c97 h ALA 66 N 0.59 1.62 -0.55 1.67 0.00 0.86 -1.42 119.26 122.04 2c97 h ALA 66 Ca -0.07 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.70 2c97 h ALA 66 Cb 1.46 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 19.01 2c97 h ALA 66 CO 0.17 0.30 -0.10 0.37 0.00 0.00 0.00 179.25 179.99 2c97 h GLN 67 N 0.82 1.04 -0.20 0.00 4.15 -0.51 -0.59 115.11 119.82 2c97 h GLN 67 Ca 0.28 -0.38 -0.04 0.00 0.77 0.00 0.00 58.65 59.28 2c97 h GLN 67 Cb 0.09 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 27.71 2c97 h GLN 67 CO -0.08 1.07 -0.03 1.49 -1.93 0.00 0.00 178.83 179.36 2c97 h GLU 68 N 0.92 0.38 -0.71 1.69 4.57 -1.08 -3.22 114.58 117.13 2c97 h GLU 68 Ca 0.14 -0.13 -0.02 0.00 -1.18 0.00 0.00 59.36 58.17 2c97 h GLU 68 Cb 0.67 -0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 29.20 2c97 h GLU 68 CO 0.05 0.60 0.38 -0.07 -1.18 0.00 0.00 179.01 178.79 2c97 h LEU 69 N 0.11 0.88 -1.18 1.64 3.38 -1.17 -2.41 115.31 116.57 2c97 h LEU 69 Ca 0.05 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2c97 h LEU 69 Cb 0.45 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.98 2c97 h LEU 69 CO 0.02 0.72 0.00 0.00 0.09 0.00 0.00 178.44 179.26 2c97 h ALA 70 N 1.42 1.00 0.00 1.53 0.00 -1.11 -2.45 119.26 119.66 2c97 h ALA 70 Ca 0.25 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 55.09 2c97 h ALA 70 Cb 0.04 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2c97 h ALA 70 CO -0.04 0.00 -0.33 0.00 0.00 0.00 0.00 179.25 178.88 2c97 h ARG 71 N 0.00 0.00 -0.22 0.00 3.08 -1.50 -3.34 114.38 112.39 2c97 h ARG 71 Ca 0.00 0.00 -0.22 0.00 0.07 0.00 0.00 59.98 59.83 2c97 h ARG 71 Cb 0.17 0.00 -0.36 0.00 0.08 0.00 0.00 29.97 29.86 2c97 h ARG 71 CO 0.00 0.33 -1.01 0.27 -1.07 0.00 0.00 179.97 178.49 2c97 n ASN 72 N -3.62 1.57 -4.00 7.04 2.04 -0.93 -5.07 115.26 112.28 2c97 n ASN 72 Ca -0.01 -2.29 -0.08 0.00 -0.44 0.00 0.00 54.58 51.76 2c97 n ASN 72 Cb 0.45 -0.39 -0.10 0.00 -2.53 0.00 0.00 39.78 37.20 2c97 n ASN 72 CO 0.00 0.00 0.00 -1.00 -0.44 0.00 0.00 177.26 175.82 2c97 s HIS 73 N -2.03 0.33 -0.34 -2.53 3.76 -1.17 -4.99 115.29 108.32 2c97 s HIS 73 Ca 0.33 -0.69 0.22 0.00 -0.15 0.00 0.00 55.06 54.77 2c97 s HIS 73 Cb 0.36 -0.24 0.36 0.00 1.11 0.00 0.00 32.58 34.16 2c97 s HIS 73 CO -0.10 -0.28 1.60 -0.44 -0.85 0.00 0.00 174.74 174.68 2c97 h ASP 74 N 4.03 0.00 -4.67 1.40 3.32 -0.87 -3.46 116.42 116.16 2c97 h ASP 74 Ca -0.33 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.66 2c97 h ASP 74 Cb 1.18 0.00 -0.20 0.00 0.22 0.00 0.00 39.33 40.54 2c97 h ASP 74 CO 0.50 0.10 0.13 0.00 -1.72 0.00 0.00 179.24 178.26 2c97 s ALA 75 N -3.20 -1.69 -0.08 3.45 0.00 -1.14 -4.25 121.76 114.86 2c97 s ALA 75 Ca 0.06 1.46 0.03 0.00 0.00 0.00 0.00 51.96 53.51 2c97 s ALA 75 Cb 0.06 -0.36 0.01 0.00 0.00 0.00 0.00 23.12 22.82 2c97 s ALA 75 CO 0.68 -0.35 -0.18 0.08 0.00 0.00 0.00 175.76 175.99 2c97 s VAL 76 N -0.70 1.58 -0.21 0.00 1.01 -0.62 -1.08 120.40 120.38 2c97 s VAL 76 Ca -0.08 -0.74 -0.13 0.00 0.00 0.00 0.00 61.98 61.03 2c97 s VAL 76 Cb -0.02 -1.39 -0.05 0.00 0.00 0.00 0.00 36.38 34.92 2c97 s VAL 76 CO 0.07 0.45 0.27 -0.69 0.00 0.00 0.00 175.10 175.20 2c97 s VAL 77 N 0.46 5.29 -0.24 2.92 1.01 0.78 -0.47 120.40 130.16 2c97 s VAL 77 Ca -0.16 0.44 -0.08 0.00 0.00 0.00 0.00 61.98 62.18 2c97 s VAL 77 Cb -0.16 -3.60 -0.03 0.00 0.00 0.00 0.00 36.38 32.58 2c97 s VAL 77 CO 0.06 0.32 0.09 0.00 0.00 0.00 0.00 175.10 175.57 2c97 s ALA 78 N 1.03 3.26 -0.06 5.51 0.00 -0.73 -0.71 121.76 130.06 2c97 s ALA 78 Ca 0.13 -1.07 0.05 0.00 0.00 0.00 0.00 51.96 51.07 2c97 s ALA 78 Cb -0.14 -2.12 -0.00 0.00 0.00 0.00 0.00 23.12 20.86 2c97 s ALA 78 CO 0.05 -0.40 -0.20 -0.51 0.00 0.00 0.00 175.76 174.70 2c97 s LEU 79 N 1.46 1.96 0.10 0.00 1.43 0.17 -0.62 118.68 123.18 2c97 s LEU 79 Ca 0.06 -0.42 -0.25 0.00 -1.03 0.00 0.00 54.13 52.49 2c97 s LEU 79 Cb -0.15 -1.14 0.08 0.00 0.03 0.00 0.00 46.19 45.02 2c97 s LEU 79 CO 0.05 0.17 1.15 -0.83 0.23 0.00 0.00 176.35 177.12 2c97 s GLY 80 N 0.05 0.02 -0.13 -3.19 0.00 -1.08 -1.15 107.32 101.85 2c97 s GLY 80 Ca -0.06 -0.20 -0.04 0.00 0.00 0.00 0.00 44.72 44.42 2c97 s GLY 80 CO 0.04 4.09 0.20 0.14 0.00 0.00 0.00 173.10 177.56 2c97 s VAL 81 N -2.06 -0.31 -0.17 1.40 1.01 -1.26 0.03 120.40 119.04 2c97 s VAL 81 Ca 0.26 0.19 0.01 0.00 0.00 0.00 0.00 61.98 62.44 2c97 s VAL 81 Cb -0.02 -0.45 0.01 0.00 0.00 0.00 0.00 36.38 35.93 2c97 s VAL 81 CO 0.03 0.03 -0.18 -0.69 0.00 0.00 0.00 175.10 174.28 2c97 s VAL 82 N 2.33 2.28 -0.05 2.92 1.01 0.11 -4.74 120.40 124.25 2c97 s VAL 82 Ca 0.04 -0.88 0.06 0.00 0.00 0.00 0.00 61.98 61.20 2c97 s VAL 82 Cb -0.13 -1.96 -0.01 0.00 0.00 0.00 0.00 36.38 34.28 2c97 s VAL 82 CO -0.08 0.53 -0.25 -0.63 0.00 0.00 0.00 175.10 174.67 2c97 s ILE 83 N 1.15 2.01 0.25 2.22 1.01 -1.26 -0.85 121.20 125.72 2c97 s ILE 83 Ca 0.01 -1.05 -0.30 0.00 0.00 0.00 0.00 60.65 59.31 2c97 s ILE 83 Cb -0.14 -1.70 -0.10 0.00 0.01 0.00 0.00 42.46 40.53 2c97 s ILE 83 CO -0.08 0.56 1.49 -0.60 0.00 0.00 0.00 174.94 176.32 2c97 s ARG 84 N -0.18 4.22 0.00 2.79 3.52 -0.11 -4.93 118.95 124.25 2c97 s ARG 84 Ca -0.03 2.38 0.00 0.00 -0.13 0.00 0.00 55.73 57.95 2c97 s ARG 84 Cb -0.13 -3.09 0.00 0.00 -1.56 0.00 0.00 34.95 30.17 2c97 s ARG 84 CO 0.03 -0.50 0.00 0.41 -0.81 0.00 0.00 175.30 174.44 2c97 n GLY 85 N 2.36 2.62 0.00 8.12 0.00 -1.26 -4.85 105.19 112.18 2c97 n GLY 85 Ca 0.08 -1.82 0.13 0.00 0.00 0.00 0.00 46.02 44.41 2c97 n GLY 85 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2c97 n GLN 86 N 0.00 0.01 -4.67 1.61 6.02 -1.26 -4.94 117.38 114.15 2c97 n GLN 86 Ca 0.00 0.01 -0.30 0.00 -0.01 0.00 0.00 57.00 56.70 2c97 n GLN 86 Cb 0.00 -1.51 -0.10 0.00 1.02 0.00 0.00 30.24 29.65 2c97 n GLN 86 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 2c97 s THR 87 N -3.01 1.67 -1.24 5.09 -4.23 -1.26 -5.02 115.64 107.66 2c97 s THR 87 Ca 0.12 -2.00 0.08 0.00 -1.18 0.00 0.00 61.69 58.71 2c97 s THR 87 Cb 0.18 -2.68 0.10 0.00 1.34 0.00 0.00 72.50 71.44 2c97 s THR 87 CO 0.62 0.00 1.17 -2.65 -0.54 0.00 0.00 174.62 173.22 2c97 n PRO 88 N -1.08 0.06 -0.29 3.99 -0.02 -1.26 -4.14 135.00 132.27 2c97 n PRO 88 Ca -0.10 0.28 0.11 0.00 -2.02 0.00 0.00 63.50 61.77 2c97 n PRO 88 Cb 0.67 -1.50 0.26 0.00 -0.02 0.00 0.00 33.50 32.91 2c97 n PRO 88 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2c97 h HIS 89 N 0.00 0.43 -0.89 6.00 2.76 -1.96 0.41 115.15 121.90 2c97 h HIS 89 Ca 0.00 0.04 0.22 0.00 -2.20 0.00 0.00 60.37 58.43 2c97 h HIS 89 Cb 0.10 -0.06 -0.13 0.00 1.55 0.00 0.00 27.41 28.88 2c97 h HIS 89 CO 0.00 -0.11 0.37 0.35 -1.30 0.00 0.00 177.93 177.23 2c97 h PHE 90 N 0.29 0.60 -0.61 5.26 3.57 -1.92 -0.73 116.94 123.40 2c97 h PHE 90 Ca 0.51 0.04 0.02 0.00 3.53 0.00 0.00 57.97 62.07 2c97 h PHE 90 Cb 0.96 -0.13 -0.04 0.00 2.79 0.00 0.00 35.95 39.54 2c97 h PHE 90 CO -0.22 -0.07 0.39 -0.44 -2.23 0.00 0.00 178.31 175.74 2c97 h ASP 91 N 0.37 0.65 0.62 0.41 3.32 -1.22 -1.24 116.42 119.33 2c97 h ASP 91 Ca 0.55 -0.00 -0.19 0.00 0.02 0.00 0.00 57.03 57.41 2c97 h ASP 91 Cb 1.06 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 40.45 2c97 h ASP 91 CO -0.54 0.46 -0.87 1.88 -1.72 0.00 0.00 179.24 178.45 2c97 h TYR 92 N 0.77 0.24 -0.31 4.55 0.05 -1.31 -1.26 116.97 119.70 2c97 h TYR 92 Ca 0.24 -0.13 -0.03 0.00 0.05 0.00 0.00 58.73 58.85 2c97 h TYR 92 Cb -0.02 -0.03 -0.01 0.00 1.01 0.00 0.00 36.73 37.68 2c97 h TYR 92 CO -0.05 0.95 0.06 0.28 -1.05 0.00 0.00 178.16 178.35 2c97 h VAL 93 N 0.09 1.23 -0.37 -2.88 2.07 -1.00 -0.77 116.25 114.63 2c97 h VAL 93 Ca -0.04 -0.79 -0.10 0.00 0.82 0.00 0.00 66.70 66.59 2c97 h VAL 93 Cb 1.50 1.15 -0.02 0.00 -1.52 0.00 0.00 31.29 32.40 2c97 h VAL 93 CO 0.13 0.26 -0.20 0.00 0.02 0.00 0.00 177.57 177.78 2c97 h ASP 95 N 0.62 0.11 -0.37 0.00 3.32 -1.13 -1.11 116.42 117.86 2c97 h ASP 95 Ca 0.09 -0.07 0.06 0.00 0.02 0.00 0.00 57.03 57.13 2c97 h ASP 95 Cb 0.68 -0.03 -0.05 0.00 0.22 0.00 0.00 39.33 40.15 2c97 h ASP 95 CO 0.05 0.15 0.08 0.00 -1.72 0.00 0.00 179.24 177.80 2c97 h ALA 96 N 0.97 0.40 -0.41 3.45 0.00 -0.98 -1.34 119.26 121.35 2c97 h ALA 96 Ca 0.03 0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 2c97 h ALA 96 Cb 0.06 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 2c97 h ALA 96 CO -0.01 -0.33 0.08 0.28 0.00 0.00 0.00 179.25 179.28 2c97 h VAL 97 N 0.20 1.24 -0.08 0.00 2.07 -1.39 -1.31 116.25 116.97 2c97 h VAL 97 Ca 0.18 -0.84 0.02 0.00 0.82 0.00 0.00 66.70 66.88 2c97 h VAL 97 Cb 0.21 0.99 -0.02 0.00 -1.52 0.00 0.00 31.29 30.95 2c97 h VAL 97 CO -0.23 0.29 -0.03 0.74 0.02 0.00 0.00 177.57 178.36 2c97 h THR 98 N 0.53 0.90 -0.70 2.57 2.02 -0.92 -0.81 112.91 116.50 2c97 h THR 98 Ca 0.13 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.24 2c97 h THR 98 Cb 0.35 0.90 -0.03 0.00 -1.74 0.00 0.00 68.15 67.63 2c97 h THR 98 CO 0.01 0.00 0.19 1.56 0.37 0.00 0.00 175.52 177.65 2c97 h GLN 99 N -0.01 1.10 0.09 6.66 4.20 -1.18 -2.34 115.11 123.64 2c97 h GLN 99 Ca 0.04 -0.25 -0.00 0.00 0.06 0.00 0.00 58.65 58.50 2c97 h GLN 99 Cb 0.07 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 27.70 2c97 h GLN 99 CO -0.09 0.96 -0.04 0.78 -0.67 0.00 0.00 178.83 179.76 2c97 h GLY 100 N 1.09 -0.12 0.98 3.46 0.00 -0.96 -0.54 103.07 106.97 2c97 h GLY 100 Ca 0.22 0.05 -0.02 0.00 0.00 0.00 0.00 47.33 47.58 2c97 h GLY 100 CO -0.00 -0.05 0.24 1.41 0.00 0.00 0.00 176.54 178.14 2c97 h LEU 101 N -0.58 0.69 -0.36 3.11 3.38 -1.18 0.50 115.31 120.87 2c97 h LEU 101 Ca -0.01 -0.14 0.03 0.00 0.09 0.00 0.00 57.88 57.85 2c97 h LEU 101 Cb 0.48 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.02 2c97 h LEU 101 CO 0.02 0.64 0.17 0.74 0.09 0.00 0.00 178.44 180.09 2c97 h THR 102 N 0.70 0.96 -0.28 0.22 2.02 -1.44 -0.24 112.91 114.84 2c97 h THR 102 Ca 0.18 -0.12 -0.01 0.00 0.77 0.00 0.00 66.41 67.23 2c97 h THR 102 Cb 0.14 0.58 -0.01 0.00 -1.74 0.00 0.00 68.15 67.12 2c97 h THR 102 CO -0.02 0.06 0.13 -0.09 0.37 0.00 0.00 175.52 175.97 2c97 h ARG 103 N 0.34 0.41 -0.51 6.66 2.43 -0.73 -2.89 114.38 120.10 2c97 h ARG 103 Ca 0.16 -0.07 0.06 0.00 -0.81 0.00 0.00 59.98 59.32 2c97 h ARG 103 Cb 0.08 -0.07 -0.05 0.00 -0.42 0.00 0.00 29.97 29.51 2c97 h ARG 103 CO -0.12 0.41 0.22 0.28 -1.51 0.00 0.00 179.97 179.25 2c97 h VAL 104 N 0.31 0.88 -0.52 0.20 2.07 -0.53 0.61 116.25 119.28 2c97 h VAL 104 Ca 0.10 -0.15 -0.05 0.00 0.82 0.00 0.00 66.70 67.42 2c97 h VAL 104 Cb 0.15 0.42 -0.02 0.00 -1.52 0.00 0.00 31.29 30.31 2c97 h VAL 104 CO -0.01 0.08 0.11 0.77 0.02 0.00 0.00 177.57 178.53 2c97 h SER 105 N 0.43 0.75 0.37 0.57 4.64 -1.00 -1.81 113.55 117.50 2c97 h SER 105 Ca 0.24 -0.14 -0.32 0.00 -0.47 0.00 0.00 61.79 61.10 2c97 h SER 105 Cb 0.21 -0.20 0.02 0.00 -0.31 0.00 0.00 62.40 62.12 2c97 h SER 105 CO -0.21 0.75 -1.47 -0.07 -0.87 0.00 0.00 176.83 174.96 2c97 h LEU 106 N 0.77 0.65 -1.11 5.97 3.38 -1.23 0.25 115.31 123.99 2c97 h LEU 106 Ca 0.17 -0.75 0.06 0.00 0.09 0.00 0.00 57.88 57.45 2c97 h LEU 106 Cb 0.31 -0.21 -0.06 0.00 0.09 0.00 0.00 40.66 40.79 2c97 h LEU 106 CO 0.00 1.60 0.61 0.44 0.09 0.00 0.00 178.44 181.18 2c97 h ASP 107 N 0.11 0.95 -0.02 -0.43 3.45 -0.83 -3.10 116.42 116.54 2c97 h ASP 107 Ca -0.24 0.01 0.00 0.00 0.43 0.00 0.00 57.03 57.23 2c97 h ASP 107 Cb 2.09 -0.20 0.00 0.00 -0.56 0.00 0.00 39.33 40.66 2c97 h ASP 107 CO 0.23 0.61 -0.20 -1.54 -1.57 0.00 0.00 179.24 176.77 2c97 n SER 108 N -4.49 2.57 -3.96 6.45 3.41 -0.69 -4.98 113.62 111.94 2c97 n SER 108 Ca 0.14 -1.79 -0.28 0.00 -0.26 0.00 0.00 58.87 56.69 2c97 n SER 108 Cb 0.18 0.20 -0.00 0.00 -0.26 0.00 0.00 64.21 64.33 2c97 n SER 108 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2c97 n SER 109 N 0.76 -1.90 -3.80 4.04 7.64 -0.03 -4.97 113.62 115.36 2c97 n SER 109 Ca 0.12 -0.93 -0.17 0.00 1.01 0.00 0.00 58.87 58.90 2c97 n SER 109 Cb 0.54 -3.33 -0.16 0.00 -1.01 0.00 0.00 64.21 60.25 2c97 n SER 109 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2c97 s THR 110 N -3.65 0.11 0.10 0.44 2.01 -0.59 -5.04 115.64 109.02 2c97 s THR 110 Ca 0.28 0.14 -0.34 0.00 0.31 0.00 0.00 61.69 62.08 2c97 s THR 110 Cb -0.14 -0.23 -0.14 0.00 0.01 0.00 0.00 72.50 72.00 2c97 s THR 110 CO 0.87 0.14 1.63 -0.81 -0.69 0.00 0.00 174.62 175.76 2c97 n PRO 111 N 4.26 2.09 -3.94 4.92 -0.04 -1.26 -4.39 135.00 136.64 2c97 n PRO 111 Ca -0.25 0.76 -0.33 0.00 -0.04 0.00 0.00 63.50 63.64 2c97 n PRO 111 Cb 0.50 -2.54 -0.14 0.00 -0.04 0.00 0.00 33.50 31.29 2c97 n PRO 111 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2c97 s ILE 112 N 1.62 2.64 0.30 0.52 -1.09 -1.26 -1.59 121.20 122.34 2c97 s ILE 112 Ca 0.82 -2.07 -0.28 0.00 -2.23 0.00 0.00 60.65 56.89 2c97 s ILE 112 Cb -0.70 -2.81 -0.09 0.00 -1.58 0.00 0.00 42.46 37.27 2c97 s ILE 112 CO 0.42 -0.50 1.00 0.00 -1.23 0.00 0.00 174.94 174.62 2c97 s ALA 113 N 1.03 3.28 -0.63 9.38 0.00 0.38 -4.90 121.76 130.30 2c97 s ALA 113 Ca 0.06 0.68 -0.22 0.00 0.00 0.00 0.00 51.96 52.47 2c97 s ALA 113 Cb -0.20 -3.24 0.07 0.00 0.00 0.00 0.00 23.12 19.74 2c97 s ALA 113 CO -0.06 0.03 0.93 1.21 0.00 0.00 0.00 175.76 177.87 2c97 s ASN 114 N -1.29 6.20 -0.19 0.00 2.47 -1.26 -1.77 114.94 119.10 2c97 s ASN 114 Ca 0.47 -0.90 0.14 0.00 0.42 0.00 0.00 52.86 53.00 2c97 s ASN 114 Cb -0.25 -2.41 0.44 0.00 -1.45 0.00 0.00 41.25 37.58 2c97 s ASN 114 CO 0.31 -1.36 1.20 0.61 -3.72 0.00 0.00 177.10 174.14 2c97 n GLY 115 N 5.28 4.31 3.49 1.21 0.00 0.21 -4.54 105.19 115.15 2c97 n GLY 115 Ca -0.03 -1.45 -0.43 0.00 0.00 0.00 0.00 46.02 44.11 2c97 n GLY 115 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2c97 s VAL 116 N -2.87 5.10 0.18 1.61 1.01 -1.18 -2.62 120.40 121.62 2c97 s VAL 116 Ca 0.39 -0.31 -0.30 0.00 0.00 0.00 0.00 61.98 61.76 2c97 s VAL 116 Cb 0.38 -4.02 -0.08 0.00 0.00 0.00 0.00 36.38 32.66 2c97 s VAL 116 CO -0.07 -0.39 1.25 -0.76 0.00 0.00 0.00 175.10 175.14 2c97 s LEU 117 N 2.12 4.43 -0.40 3.92 1.43 0.10 -4.90 118.68 125.39 2c97 s LEU 117 Ca 0.12 2.30 0.01 0.00 -1.03 0.00 0.00 54.13 55.53 2c97 s LEU 117 Cb -0.17 -3.61 0.12 0.00 0.03 0.00 0.00 46.19 42.57 2c97 s LEU 117 CO 0.13 -0.45 0.18 0.42 0.23 0.00 0.00 176.35 176.86 2c97 s THR 118 N 0.11 1.36 0.24 5.49 -4.23 -1.25 0.06 115.64 117.42 2c97 s THR 118 Ca 0.55 -2.22 0.11 0.00 -1.18 0.00 0.00 61.69 58.95 2c97 s THR 118 Cb -0.34 -1.97 -0.05 0.00 1.34 0.00 0.00 72.50 71.48 2c97 s THR 118 CO 0.37 -0.80 -0.20 0.42 -0.54 0.00 0.00 174.62 173.86 2c97 s THR 119 N 0.75 2.31 0.13 3.99 -4.23 -0.03 -5.01 115.64 113.54 2c97 s THR 119 Ca 0.15 -2.27 -0.01 0.00 -1.18 0.00 0.00 61.69 58.37 2c97 s THR 119 Cb -0.22 -2.20 -0.20 0.00 1.34 0.00 0.00 72.50 71.22 2c97 s THR 119 CO -0.08 -0.36 1.28 0.78 -0.54 0.00 0.00 174.62 175.70 2c97 h ASN 120 N 2.56 0.37 -3.29 3.99 2.35 -1.92 -0.27 115.58 119.37 2c97 h ASN 120 Ca -0.41 -0.33 -0.44 0.00 -0.55 0.00 0.00 56.30 54.57 2c97 h ASN 120 Cb 1.24 -0.12 -0.14 0.00 0.05 0.00 0.00 38.32 39.35 2c97 h ASN 120 CO 0.57 1.17 -0.71 0.42 -1.65 0.00 0.00 177.43 177.24 2c97 s THR 121 N -3.05 1.57 0.22 2.81 -4.23 -1.26 -3.98 115.64 107.71 2c97 s THR 121 Ca -0.04 -2.15 -0.03 0.00 -1.18 0.00 0.00 61.69 58.29 2c97 s THR 121 Cb 0.09 -2.17 0.02 0.00 1.34 0.00 0.00 72.50 71.77 2c97 s THR 121 CO 0.86 -0.50 1.61 -0.08 -0.54 0.00 0.00 174.62 175.97 2c97 h GLU 122 N 2.49 0.67 -0.33 3.99 4.81 -1.95 -2.89 114.58 121.38 2c97 h GLU 122 Ca -0.38 -0.30 0.07 0.00 -0.13 0.00 0.00 59.36 58.61 2c97 h GLU 122 Cb 1.22 -0.01 -0.07 0.00 0.63 0.00 0.00 28.75 30.52 2c97 h GLU 122 CO 0.64 0.90 -0.10 1.49 -0.73 0.00 0.00 179.01 181.21 2c97 h GLU 123 N 0.57 -0.03 -0.83 1.92 4.81 -1.99 0.18 114.58 119.23 2c97 h GLU 123 Ca 0.07 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.29 2c97 h GLU 123 Cb 0.81 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 30.16 2c97 h GLU 123 CO 0.07 -0.02 0.49 1.96 -0.73 0.00 0.00 179.01 180.78 2c97 h GLN 124 N -0.03 1.13 -0.24 1.92 4.20 -1.97 -0.78 115.11 119.35 2c97 h GLN 124 Ca 0.16 -0.11 -0.09 0.00 0.06 0.00 0.00 58.65 58.68 2c97 h GLN 124 Cb 0.27 -0.23 -0.00 0.00 0.30 0.00 0.00 27.48 27.81 2c97 h GLN 124 CO -0.35 0.81 -0.19 0.00 -0.67 0.00 0.00 178.83 178.43 2c97 h ALA 125 N 1.26 0.34 -0.82 3.87 0.00 -1.25 -2.79 119.26 119.87 2c97 h ALA 125 Ca 0.30 -0.35 0.12 0.00 0.00 0.00 0.00 54.91 54.98 2c97 h ALA 125 Cb -0.02 -0.08 -0.08 0.00 0.00 0.00 0.00 17.79 17.61 2c97 h ALA 125 CO -0.05 0.26 0.43 -0.07 0.00 0.00 0.00 179.25 179.82 2c97 h LEU 126 N 0.25 0.56 -0.14 0.00 3.38 -0.77 -1.90 115.31 116.69 2c97 h LEU 126 Ca 0.04 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.09 2c97 h LEU 126 Cb 0.72 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.45 2c97 h LEU 126 CO 0.05 0.28 0.00 -0.67 0.09 0.00 0.00 178.44 178.18 2c97 n ASP 127 N -4.83 0.13 -0.05 -0.43 2.03 -0.32 -2.84 116.55 110.24 2c97 n ASP 127 Ca 0.15 0.53 0.01 0.00 0.52 0.00 0.00 54.79 56.00 2c97 n ASP 127 Cb 0.36 -0.56 0.02 0.00 -0.72 0.00 0.00 41.12 40.22 2c97 n ASP 127 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2c97 n ARG 128 N -1.64 2.93 0.00 -0.67 1.74 -0.73 -1.18 116.66 117.11 2c97 n ARG 128 Ca 0.03 -1.58 0.07 0.00 -0.77 0.00 0.00 57.85 55.60 2c97 n ARG 128 Cb 0.17 -1.04 0.04 0.00 -1.02 0.00 0.00 32.46 30.62 2c97 n ARG 128 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2c97 n ALA 129 N -0.46 2.59 -2.87 7.54 0.00 -1.10 -1.32 120.51 124.89 2c97 n ALA 129 Ca 0.01 -0.58 -0.13 0.00 0.00 0.00 0.00 53.44 52.74 2c97 n ALA 129 Cb 0.28 -0.46 0.03 0.00 0.00 0.00 0.00 19.45 19.30 2c97 n ALA 129 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c97 n GLY 130 N 0.82 0.04 3.82 0.00 0.00 -0.24 -3.50 105.19 106.13 2c97 n GLY 130 Ca 0.07 -0.21 -0.30 0.00 0.00 0.00 0.00 46.02 45.58 2c97 n GLY 130 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2c97 s LEU 131 N -4.26 2.65 0.28 0.99 1.43 -1.26 -4.90 118.68 113.60 2c97 s LEU 131 Ca 0.24 1.25 -0.07 0.00 -1.03 0.00 0.00 54.13 54.52 2c97 s LEU 131 Cb -0.11 -3.90 0.48 0.00 0.03 0.00 0.00 46.19 42.70 2c97 s LEU 131 CO 0.30 -1.85 1.56 -0.65 0.23 0.00 0.00 176.35 175.95 2c97 h PRO 132 N -1.00 0.00 -0.63 1.29 0.11 -1.96 0.87 132.00 130.68 2c97 h PRO 132 Ca -0.47 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2c97 h PRO 132 Cb 1.27 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 2c97 h PRO 132 CO 0.60 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.64 2c97 n THR 133 N -5.61 0.95 -2.14 -1.15 -2.24 -1.26 -4.97 114.28 97.86 2c97 n THR 133 Ca 0.16 -0.86 -0.37 0.00 -2.27 0.00 0.00 64.05 60.71 2c97 n THR 133 Cb 0.52 0.37 0.01 0.00 -2.10 0.00 0.00 70.33 69.13 2c97 n THR 133 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2c97 s SER 134 N -0.98 5.78 0.18 3.42 0.01 0.30 -4.95 113.70 117.46 2c97 s SER 134 Ca 0.42 2.37 -0.05 0.00 1.31 0.00 0.00 55.95 60.00 2c97 s SER 134 Cb 0.23 -2.60 0.07 0.00 0.21 0.00 0.00 66.02 63.92 2c97 s SER 134 CO 0.28 -1.19 1.49 0.00 0.41 0.00 0.00 173.24 174.23 2c97 h ALA 135 N 1.61 0.66 -2.92 1.44 0.00 -1.46 -3.47 119.26 115.12 2c97 h ALA 135 Ca -0.50 -0.50 -0.27 0.00 0.00 0.00 0.00 54.91 53.64 2c97 h ALA 135 Cb 1.27 -0.09 -0.08 0.00 0.00 0.00 0.00 17.79 18.89 2c97 h ALA 135 CO 0.58 0.68 -0.20 -1.83 0.00 0.00 0.00 179.25 178.48 2c97 s GLU 136 N -4.09 1.89 -0.31 0.00 -1.05 -0.77 -5.05 118.70 109.32 2c97 s GLU 136 Ca -0.08 -1.75 -0.01 0.00 -0.15 0.00 0.00 54.97 52.98 2c97 s GLU 136 Cb 0.11 0.44 0.10 0.00 -0.44 0.00 0.00 34.13 34.34 2c97 s GLU 136 CO 0.85 -0.78 0.11 0.34 0.95 0.00 0.00 175.26 176.73 2c97 s ASP 137 N -3.23 3.95 0.38 0.83 -1.08 -1.26 -1.08 116.67 115.18 2c97 s ASP 137 Ca 0.31 -1.64 0.12 0.00 -0.52 0.00 0.00 52.55 50.82 2c97 s ASP 137 Cb -0.00 -0.80 0.76 0.00 -1.46 0.00 0.00 42.92 41.42 2c97 s ASP 137 CO 0.20 -0.41 1.86 0.11 0.52 0.00 0.00 175.17 177.45 2c97 h LYS 138 N 8.07 0.06 -0.14 4.34 1.79 -1.51 -1.72 116.57 127.46 2c97 h LYS 138 Ca -0.14 -0.02 -0.00 0.00 -2.18 0.00 0.00 60.65 58.31 2c97 h LYS 138 Cb 1.01 -0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 31.65 2c97 h LYS 138 CO 0.47 0.35 0.08 0.78 -1.08 0.00 0.00 179.45 180.05 2c97 h GLY 139 N 0.94 0.20 0.99 3.86 0.00 -1.81 0.73 103.07 107.98 2c97 h GLY 139 Ca 0.01 -0.08 -0.02 0.00 0.00 0.00 0.00 47.33 47.24 2c97 h GLY 139 CO 0.04 0.08 0.31 0.00 0.00 0.00 0.00 176.54 176.97 2c97 h ALA 140 N 1.01 0.76 -0.33 3.60 0.00 -1.64 -2.58 119.26 120.07 2c97 h ALA 140 Ca 0.05 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 2c97 h ALA 140 Cb 0.03 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 2c97 h ALA 140 CO -0.01 0.29 0.11 1.96 0.00 0.00 0.00 179.25 181.60 2c97 h GLN 141 N 0.80 0.52 -0.22 0.00 4.20 -1.11 -1.87 115.11 117.43 2c97 h GLN 141 Ca 0.21 -0.11 -0.03 0.00 0.06 0.00 0.00 58.65 58.77 2c97 h GLN 141 Cb 0.08 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 27.77 2c97 h GLN 141 CO -0.03 0.55 -0.01 0.00 -0.67 0.00 0.00 178.83 178.67 2c97 h ALA 142 N 0.94 1.59 -0.08 3.87 0.00 -0.87 -1.79 119.26 122.92 2c97 h ALA 142 Ca 0.11 -0.14 -0.22 0.00 0.00 0.00 0.00 54.91 54.66 2c97 h ALA 142 Cb 0.25 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2c97 h ALA 142 CO -0.00 0.30 -0.83 1.15 0.00 0.00 0.00 179.25 179.87 2c97 h THR 143 N 0.31 1.34 -0.83 0.00 2.02 -1.18 -1.89 112.91 112.67 2c97 h THR 143 Ca 0.07 -2.16 0.05 0.00 0.77 0.00 0.00 66.41 65.14 2c97 h THR 143 Cb 0.23 2.16 -0.06 0.00 -1.74 0.00 0.00 68.15 68.74 2c97 h THR 143 CO 0.01 0.66 0.52 0.58 0.37 0.00 0.00 175.52 177.65 2c97 h VAL 144 N 0.37 1.06 -0.33 3.16 2.07 -0.94 -1.52 116.25 120.12 2c97 h VAL 144 Ca -0.06 -0.33 -0.05 0.00 0.82 0.00 0.00 66.70 67.08 2c97 h VAL 144 Cb 1.44 0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 31.22 2c97 h VAL 144 CO 0.15 0.18 0.02 0.00 0.02 0.00 0.00 177.57 177.94 2c97 h ALA 145 N 1.38 0.44 0.04 1.67 0.00 -1.23 -1.53 119.26 120.03 2c97 h ALA 145 Ca 0.35 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 2c97 h ALA 145 Cb 0.12 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2c97 h ALA 145 CO -0.15 0.18 -0.02 0.00 0.00 0.00 0.00 179.25 179.25 2c97 h ALA 146 N 0.86 -0.06 0.05 0.00 0.00 -1.12 -1.78 119.26 117.22 2c97 h ALA 146 Ca 0.10 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 2c97 h ALA 146 Cb 0.42 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.23 2c97 h ALA 146 CO 0.01 -0.53 -0.02 -0.07 0.00 0.00 0.00 179.25 178.64 2c97 h LEU 147 N -0.06 -0.06 -0.85 0.00 3.38 -1.27 -1.62 115.31 114.84 2c97 h LEU 147 Ca -0.01 -0.13 0.05 0.00 0.09 0.00 0.00 57.88 57.88 2c97 h LEU 147 Cb 0.04 0.01 -0.06 0.00 0.09 0.00 0.00 40.66 40.75 2c97 h LEU 147 CO 0.01 0.10 0.53 0.00 0.09 0.00 0.00 178.44 179.17 2c97 h ALA 148 N 0.73 1.14 -0.25 1.53 0.00 -1.28 -1.33 119.26 119.80 2c97 h ALA 148 Ca -0.01 -0.02 -0.18 0.00 0.00 0.00 0.00 54.91 54.70 2c97 h ALA 148 Cb 0.19 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.73 2c97 h ALA 148 CO 0.01 0.30 -0.56 1.15 0.00 0.00 0.00 179.25 180.15 2c97 h THR 149 N 0.99 1.28 -0.48 0.00 2.02 -1.26 -1.18 112.91 114.27 2c97 h THR 149 Ca 0.36 -1.75 0.05 0.00 0.77 0.00 0.00 66.41 65.84 2c97 h THR 149 Cb 0.12 1.72 -0.05 0.00 -1.74 0.00 0.00 68.15 68.20 2c97 h THR 149 CO -0.15 0.56 0.21 0.00 0.37 0.00 0.00 175.52 176.51 2c97 h ALA 150 N 0.65 0.60 -0.63 6.16 0.00 -1.13 0.32 119.26 125.22 2c97 h ALA 150 Ca 0.00 0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 2c97 h ALA 150 Cb 1.17 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.91 2c97 h ALA 150 CO 0.12 -0.16 0.11 -0.07 0.00 0.00 0.00 179.25 179.25 2c97 h LEU 151 N 0.42 0.99 -0.12 0.00 3.38 -1.05 -1.37 115.31 117.55 2c97 h LEU 151 Ca 0.22 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2c97 h LEU 151 Cb 0.17 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 2c97 h LEU 151 CO -0.18 0.99 0.08 0.74 0.09 0.00 0.00 178.44 180.16 2c97 h THR 152 N 0.94 1.02 -0.57 0.22 2.02 -0.98 -2.08 112.91 113.49 2c97 h THR 152 Ca 0.19 -0.05 -0.01 0.00 0.77 0.00 0.00 66.41 67.31 2c97 h THR 152 Cb 0.42 0.85 -0.03 0.00 -1.74 0.00 0.00 68.15 67.66 2c97 h THR 152 CO 0.01 0.03 0.31 -0.07 0.37 0.00 0.00 175.52 176.17 2c97 h LEU 153 N 0.16 0.69 -0.82 2.58 3.38 -0.74 -0.10 115.31 120.46 2c97 h LEU 153 Ca 0.05 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 2c97 h LEU 153 Cb -0.01 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.52 2c97 h LEU 153 CO -0.01 0.56 0.51 -0.09 0.09 0.00 0.00 178.44 179.49 2c97 h ARG 154 N 0.79 1.10 -0.29 1.13 9.65 -1.02 -0.73 114.38 125.00 2c97 h ARG 154 Ca 0.20 -0.09 -0.09 0.00 -1.10 0.00 0.00 59.98 58.91 2c97 h ARG 154 Cb 0.02 -0.24 -0.01 0.00 -1.39 0.00 0.00 29.97 28.36 2c97 h ARG 154 CO -0.03 0.76 -0.16 1.49 2.80 0.00 0.00 179.97 184.82 2c97 h GLU 155 N 1.12 0.63 -0.01 0.20 4.57 -0.69 -3.22 114.58 117.18 2c97 h GLU 155 Ca 0.30 -0.28 -0.10 0.00 -1.18 0.00 0.00 59.36 58.09 2c97 h GLU 155 Cb -0.07 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.49 2c97 h GLU 155 CO -0.06 0.87 -0.47 -0.07 -1.18 0.00 0.00 179.01 178.10 2c97 h LEU 156 N 0.37 0.03 0.00 1.64 3.38 -0.74 -3.46 115.31 116.53 2c97 h LEU 156 Ca 0.06 -0.01 -0.32 0.00 0.09 0.00 0.00 57.88 57.71 2c97 h LEU 156 Cb 0.69 -0.01 0.09 0.00 0.09 0.00 0.00 40.66 41.52 2c97 h LEU 156 CO 0.05 0.49 0.18 0.54 0.09 0.00 0.00 178.44 179.80 2c97 n ARG 157 N -3.98 -0.38 -2.02 1.13 1.74 -0.31 -4.98 116.66 107.87 2c97 n ARG 157 Ca -0.02 -1.69 -0.42 0.00 -0.77 0.00 0.00 57.85 54.95 2c97 n ARG 157 Cb 0.49 -0.71 -0.03 0.00 -1.02 0.00 0.00 32.46 31.20 2c97 n ARG 157 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2c97 s ALA 158 N -3.50 3.64 0.12 7.54 0.00 -1.26 -4.99 121.76 123.32 2c97 s ALA 158 Ca 0.50 1.05 -0.24 0.00 0.00 0.00 0.00 51.96 53.26 2c97 s ALA 158 Cb -0.02 -3.69 0.07 0.00 0.00 0.00 0.00 23.12 19.48 2c97 s ALA 158 CO 0.34 -1.16 0.64 -3.38 0.00 0.00 0.00 175.76 172.20 2c97 s HIS 159 N 3.04 -0.53 0.00 0.00 -3.43 -1.26 -5.11 115.29 108.01 2c97 s HIS 159 Ca 0.71 0.38 0.00 0.00 -0.80 0.00 0.00 55.06 55.36 2c97 s HIS 159 Cb -0.36 0.55 0.00 0.00 -1.43 0.00 0.00 32.58 31.34 2c97 s HIS 159 CO 0.30 -0.80 0.10 -1.13 -2.00 0.00 0.00 174.74 171.21