#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rpp n SER 8 N 0.00 -2.67 -4.27 1.61 7.64 -1.26 -2.91 113.62 111.76 2rpp n SER 8 Ca 0.00 -0.23 -0.36 0.00 1.01 0.00 0.00 58.87 59.29 2rpp n SER 8 Cb 0.00 -0.86 -0.08 0.00 -1.01 0.00 0.00 64.21 62.26 2rpp n SER 8 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2rpp n SER 9 N -1.25 -0.84 0.00 6.43 7.64 -1.26 -4.83 113.62 119.51 2rpp n SER 9 Ca 0.02 -1.16 0.00 0.00 1.01 0.00 0.00 58.87 58.74 2rpp n SER 9 Cb 0.55 -1.47 0.00 0.00 -1.01 0.00 0.00 64.21 62.28 2rpp n SER 9 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2rpp n GLY 10 N -1.49 5.53 3.08 0.23 0.00 -1.15 -5.09 105.19 106.31 2rpp n GLY 10 Ca -0.03 -1.13 -0.35 0.00 0.00 0.00 0.00 46.02 44.51 2rpp n GLY 10 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2rpp s SER 11 N 1.00 5.56 -0.24 1.61 0.01 -1.26 -5.06 113.70 115.33 2rpp s SER 11 Ca 0.00 -3.38 -0.20 0.00 1.31 0.00 0.00 55.95 53.68 2rpp s SER 11 Cb 0.00 -1.86 -0.02 0.00 0.21 0.00 0.00 66.02 64.35 2rpp s SER 11 CO 0.00 -0.25 0.59 -0.94 0.41 0.00 0.00 173.24 173.05 2rpp s SER 12 N 0.07 6.57 -0.71 2.44 1.04 -1.26 -4.52 113.70 117.33 2rpp s SER 12 Ca 0.23 0.69 -0.12 0.00 0.48 0.00 0.00 55.95 57.23 2rpp s SER 12 Cb -0.12 -2.32 0.02 0.00 0.10 0.00 0.00 66.02 63.69 2rpp s SER 12 CO -0.09 -0.31 0.62 0.61 0.98 0.00 0.00 173.24 175.05 2rpp n GLY 13 N 4.09 -0.85 0.00 7.32 0.00 -1.26 -4.77 105.19 109.72 2rpp n GLY 13 Ca -0.02 0.78 0.08 0.00 0.00 0.00 0.00 46.02 46.86 2rpp n GLY 13 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2rpp n PRO 14 N -1.87 0.48 -1.06 1.61 -0.04 -1.26 -4.84 135.00 128.01 2rpp n PRO 14 Ca -0.25 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 62.80 2rpp n PRO 14 Cb 0.69 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.55 2rpp n PRO 14 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 2rpp n VAL 15 N -1.01 0.00 -3.69 0.52 0.24 -1.26 -4.88 118.33 108.25 2rpp n VAL 15 Ca 0.12 0.00 -0.14 0.00 -2.04 0.00 0.00 64.34 62.28 2rpp n VAL 15 Cb 0.06 -0.40 -0.14 0.00 -1.47 0.00 0.00 33.84 31.89 2rpp n VAL 15 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 2rpp s ARG 16 N 5.65 0.15 0.17 7.34 1.81 -1.26 -5.15 118.95 127.66 2rpp s ARG 16 Ca 1.00 0.63 -0.09 0.00 -1.72 0.00 0.00 55.73 55.55 2rpp s ARG 16 Cb -1.12 -0.10 -0.07 0.00 -0.45 0.00 0.00 34.95 33.22 2rpp s ARG 16 CO 0.47 -0.24 0.48 0.34 -0.68 0.00 0.00 175.30 175.67 2rpp s ASP 17 N 1.94 6.62 -1.20 0.23 2.15 -1.26 -4.98 116.67 120.17 2rpp s ASP 17 Ca -0.03 0.84 -0.17 0.00 0.43 0.00 0.00 52.55 53.61 2rpp s ASP 17 Cb -0.11 -2.19 -0.03 0.00 -0.30 0.00 0.00 42.92 40.28 2rpp s ASP 17 CO -0.08 0.02 2.07 1.07 -0.17 0.00 0.00 175.17 178.08 2rpp n THR 18 N 0.22 2.88 -0.06 1.71 5.66 -1.26 -4.38 114.28 119.04 2rpp n THR 18 Ca -0.02 -2.59 -0.05 0.00 -3.05 0.00 0.00 64.05 58.34 2rpp n THR 18 Cb 0.52 -2.47 -0.13 0.00 -1.55 0.00 0.00 70.33 66.71 2rpp n THR 18 CO 0.00 0.00 0.00 2.29 -3.05 0.00 0.00 175.07 174.31 2rpp n LYS 19 N 6.71 1.25 -0.83 1.09 -0.00 -1.26 -4.39 118.16 120.74 2rpp n LYS 19 Ca 0.51 -0.04 -0.01 0.00 -0.00 0.00 0.00 58.31 58.77 2rpp n LYS 19 Cb 0.40 -1.40 0.29 0.00 -0.00 0.00 0.00 35.03 34.32 2rpp n LYS 19 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 177.40 174.73 2rpp n TRP 20 N -2.49 1.96 -2.51 5.58 4.27 -1.26 -4.24 117.44 118.75 2rpp n TRP 20 Ca -0.21 -0.86 -0.12 0.00 -3.89 0.00 0.00 57.50 52.41 2rpp n TRP 20 Cb 0.90 -0.55 0.03 0.00 -1.36 0.00 0.00 31.31 30.34 2rpp n TRP 20 CO 0.00 0.00 0.00 1.28 -2.29 0.00 0.00 177.69 176.68 2rpp n LEU 21 N 0.17 2.98 -4.79 5.67 4.77 -1.26 -4.91 117.00 119.63 2rpp n LEU 21 Ca 0.30 -3.96 -0.22 0.00 -0.03 0.00 0.00 56.01 52.10 2rpp n LEU 21 Cb 1.16 0.10 -0.05 0.00 -2.33 0.00 0.00 43.42 42.30 2rpp n LEU 21 CO 0.33 1.61 -0.20 0.42 -1.33 0.00 0.00 177.39 178.22 2rpp s THR 22 N -4.16 4.25 -0.14 -5.08 -4.23 -1.26 -0.26 115.64 104.76 2rpp s THR 22 Ca 0.37 -1.48 -0.16 0.00 -1.18 0.00 0.00 61.69 59.23 2rpp s THR 22 Cb 0.38 -3.29 0.04 0.00 1.34 0.00 0.00 72.50 70.98 2rpp s THR 22 CO -0.02 -0.34 0.45 -0.76 -0.54 0.00 0.00 174.62 173.41 2rpp s LEU 23 N -3.76 0.29 0.04 4.79 1.43 -0.50 -4.87 118.68 116.10 2rpp s LEU 23 Ca 0.32 0.80 -0.30 0.00 -1.03 0.00 0.00 54.13 53.92 2rpp s LEU 23 Cb -0.08 1.57 -0.07 0.00 0.03 0.00 0.00 46.19 47.64 2rpp s LEU 23 CO 0.24 -0.22 1.57 -0.70 0.23 0.00 0.00 176.35 177.48 2rpp s GLU 24 N -0.03 4.22 0.41 1.70 2.56 -1.26 -2.06 118.70 124.24 2rpp s GLU 24 Ca -0.02 2.20 -0.23 0.00 0.00 0.00 0.00 54.97 56.92 2rpp s GLU 24 Cb -0.03 -3.63 -0.10 0.00 2.00 0.00 0.00 34.13 32.37 2rpp s GLU 24 CO 0.02 -0.70 1.00 0.08 -0.56 0.00 0.00 175.26 175.10 2rpp s VAL 25 N 2.70 4.00 -0.53 3.70 1.01 -1.25 -3.52 120.40 126.51 2rpp s VAL 25 Ca 0.71 1.42 -0.27 0.00 0.00 0.00 0.00 61.98 63.83 2rpp s VAL 25 Cb -0.37 -3.67 -0.01 0.00 0.00 0.00 0.00 36.38 32.33 2rpp s VAL 25 CO 0.30 -0.11 1.70 0.00 0.00 0.00 0.00 175.10 176.99 2rpp n ARG 27 N 8.84 -0.27 0.15 0.00 0.63 -1.26 -0.52 116.66 124.23 2rpp n ARG 27 Ca 0.18 1.41 -0.14 0.00 -0.92 0.00 0.00 57.85 58.38 2rpp n ARG 27 Cb 0.50 -2.08 -0.07 0.00 0.45 0.00 0.00 32.46 31.25 2rpp n ARG 27 CO 0.00 0.00 0.00 1.96 -2.51 0.00 0.00 177.63 177.08 2rpp h GLN 28 N 0.00 -0.63 -0.86 -0.14 4.20 -1.91 -2.67 115.11 113.10 2rpp h GLN 28 Ca 0.27 0.04 0.13 0.00 0.06 0.00 0.00 58.65 59.15 2rpp h GLN 28 Cb 0.50 0.14 -0.13 0.00 0.30 0.00 0.00 27.48 28.29 2rpp h GLN 28 CO -0.90 -0.42 -0.35 0.34 -0.67 0.00 0.00 178.83 176.82 2rpp n PHE 29 N -5.46 -0.02 -0.21 2.96 7.35 0.32 0.64 117.46 123.03 2rpp n PHE 29 Ca -0.08 1.06 -0.01 0.00 -0.76 0.00 0.00 57.45 57.65 2rpp n PHE 29 Cb 0.36 -0.79 0.05 0.00 0.35 0.00 0.00 39.48 39.46 2rpp n PHE 29 CO 0.00 0.00 0.00 1.96 -0.76 0.00 0.00 176.76 177.96 2rpp h GLN 30 N 0.00 -0.04 0.00 -4.13 1.08 -1.08 0.26 115.11 111.20 2rpp h GLN 30 Ca 0.28 0.00 -0.11 0.00 -1.45 0.00 0.00 58.65 57.37 2rpp h GLN 30 Cb 0.49 0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 27.92 2rpp h GLN 30 CO -0.84 -0.03 -0.53 0.00 -0.95 0.00 0.00 178.83 176.48 2rpp h ARG 31 N -0.04 0.00 0.00 1.46 -0.00 0.25 -3.47 114.38 112.57 2rpp h ARG 31 Ca 0.29 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.77 2rpp h ARG 31 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.47 2rpp h ARG 31 CO -0.67 0.53 0.00 0.41 0.00 0.00 0.00 179.97 180.24 2rpp n GLY 32 N 0.06 0.99 1.83 0.04 0.00 0.14 -5.00 105.19 103.26 2rpp n GLY 32 Ca -0.01 -0.08 -0.20 0.00 0.00 0.00 0.00 46.02 45.72 2rpp n GLY 32 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2rpp n THR 33 N -2.05 2.95 -3.96 2.61 -2.24 -1.11 -4.93 114.28 105.56 2rpp n THR 33 Ca 0.00 -2.97 -0.34 0.00 -2.27 0.00 0.00 64.05 58.46 2rpp n THR 33 Cb 0.00 -0.74 -0.14 0.00 -2.10 0.00 0.00 70.33 67.35 2rpp n THR 33 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2rpp n SER 35 N 4.58 4.16 -4.40 0.00 2.88 -1.26 -4.91 113.62 114.67 2rpp n SER 35 Ca -0.14 -3.66 -0.32 0.00 -1.33 0.00 0.00 58.87 53.41 2rpp n SER 35 Cb 0.44 -0.82 -0.14 0.00 -0.75 0.00 0.00 64.21 62.93 2rpp n SER 35 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 2rpp s ARG 36 N -3.37 2.61 0.68 -1.46 0.52 -1.26 -5.09 118.95 111.56 2rpp s ARG 36 Ca 0.56 -0.76 -0.11 0.00 -0.52 0.00 0.00 55.73 54.90 2rpp s ARG 36 Cb 0.47 -2.34 0.17 0.00 0.52 0.00 0.00 34.95 33.77 2rpp s ARG 36 CO 0.08 0.50 0.63 -1.13 0.02 0.00 0.00 175.30 175.40 2rpp n SER 37 N 2.64 -1.45 0.09 0.23 3.41 -1.26 -4.64 113.62 112.65 2rpp n SER 37 Ca -0.17 -0.91 -0.13 0.00 -0.26 0.00 0.00 58.87 57.40 2rpp n SER 37 Cb 0.52 -0.57 -0.11 0.00 -0.26 0.00 0.00 64.21 63.80 2rpp n SER 37 CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 2rpp h ASP 38 N -1.87 0.31 1.46 4.04 2.03 -1.90 -0.03 116.42 120.45 2rpp h ASP 38 Ca -0.23 -0.32 0.00 0.00 -0.73 0.00 0.00 57.03 55.75 2rpp h ASP 38 Cb 0.70 -0.10 0.00 0.00 -0.83 0.00 0.00 39.33 39.10 2rpp h ASP 38 CO 0.15 1.21 0.00 -0.08 -1.03 0.00 0.00 179.24 179.50 2rpp h GLU 39 N 0.08 0.00 0.00 4.15 4.22 -1.94 -3.35 114.58 117.73 2rpp h GLU 39 Ca -0.09 0.00 -0.26 0.00 0.08 0.00 0.00 59.36 59.10 2rpp h GLU 39 Cb 1.82 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 31.03 2rpp h GLU 39 CO 0.17 0.00 -1.85 0.39 -2.18 0.00 0.00 179.01 175.55 2rpp n GLU 40 N -2.31 0.56 -2.04 1.92 -0.58 -1.21 -4.96 120.64 112.02 2rpp n GLU 40 Ca 0.05 0.24 -0.41 0.00 -0.42 0.00 0.00 57.16 56.61 2rpp n GLU 40 Cb 0.42 -1.46 -0.03 0.00 -0.57 0.00 0.00 31.44 29.81 2rpp n GLU 40 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2rpp n LYS 42 N 2.69 1.04 -4.45 0.00 -0.00 -1.26 -4.78 118.16 111.40 2rpp n LYS 42 Ca 0.08 -0.05 -0.22 0.00 -0.00 0.00 0.00 58.31 58.12 2rpp n LYS 42 Cb 0.40 -1.22 -0.10 0.00 -0.00 0.00 0.00 35.03 34.11 2rpp n LYS 42 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.40 177.34 2rpp s PHE 43 N -1.58 2.10 -0.12 5.58 0.08 -1.26 -5.02 117.98 117.76 2rpp s PHE 43 Ca 0.01 -0.51 -0.12 0.00 0.12 0.00 0.00 56.93 56.43 2rpp s PHE 43 Cb 0.01 -1.06 -0.05 0.00 -0.57 0.00 0.00 43.02 41.35 2rpp s PHE 43 CO 0.00 0.50 0.27 0.00 -0.10 0.00 0.00 175.22 175.90 2rpp s ALA 44 N -2.76 3.69 -0.51 5.36 0.00 -1.23 -4.87 121.76 121.45 2rpp s ALA 44 Ca 0.29 -0.46 0.02 0.00 0.00 0.00 0.00 51.96 51.80 2rpp s ALA 44 Cb -0.00 -2.27 0.13 0.00 0.00 0.00 0.00 23.12 20.98 2rpp s ALA 44 CO 0.13 0.31 0.27 -1.01 0.00 0.00 0.00 175.76 175.46 2rpp s HIS 45 N -0.26 3.39 0.32 0.00 0.09 -1.26 -2.89 115.29 114.67 2rpp s HIS 45 Ca 0.17 -2.95 -0.29 0.00 -0.00 0.00 0.00 55.06 51.99 2rpp s HIS 45 Cb -0.13 -2.98 -0.10 0.00 -0.00 0.00 0.00 32.58 29.37 2rpp s HIS 45 CO 0.06 -0.83 1.22 -1.25 -0.00 0.00 0.00 174.74 173.94 2rpp s PRO 46 N 0.11 4.42 1.07 8.40 0.04 -1.26 -4.96 135.00 142.81 2rpp s PRO 46 Ca 0.15 2.04 -0.14 0.00 0.04 0.00 0.00 61.00 63.08 2rpp s PRO 46 Cb -0.23 -3.07 0.22 0.00 0.04 0.00 0.00 34.50 31.47 2rpp s PRO 46 CO -0.03 -0.07 1.10 -1.25 0.04 0.00 0.00 177.00 176.79 2rpp s PRO 47 N -1.73 -0.14 0.19 0.56 0.04 -1.26 -4.94 135.00 127.71 2rpp s PRO 47 Ca 0.48 0.32 -0.09 0.00 0.04 0.00 0.00 61.00 61.76 2rpp s PRO 47 Cb -0.36 -1.69 0.09 0.00 0.04 0.00 0.00 34.50 32.58 2rpp s PRO 47 CO 0.47 -3.07 1.67 -0.22 0.04 0.00 0.00 177.00 175.90 2rpp h LYS 48 N -2.13 1.09 -0.61 4.56 1.63 -2.01 -2.98 116.57 116.12 2rpp h LYS 48 Ca -0.52 -0.31 -0.01 0.00 -0.85 0.00 0.00 60.65 58.96 2rpp h LYS 48 Cb 1.32 -0.12 -0.03 0.00 -0.60 0.00 0.00 32.23 32.80 2rpp h LYS 48 CO 0.51 1.02 0.32 0.66 -3.45 0.00 0.00 179.45 178.51 2rpp h SER 49 N 1.01 0.77 -3.94 4.20 4.64 -1.93 -3.43 113.55 114.87 2rpp h SER 49 Ca 0.19 -0.10 -0.51 0.00 -0.47 0.00 0.00 61.79 60.90 2rpp h SER 49 Cb 0.47 -0.20 0.05 0.00 -0.31 0.00 0.00 62.40 62.42 2rpp h SER 49 CO 0.02 0.65 0.52 0.00 -0.87 0.00 0.00 176.83 177.15 2rpp s GLN 51 N -2.28 4.62 -0.11 0.00 0.74 -1.13 -4.70 119.66 116.79 2rpp s GLN 51 Ca 0.57 1.31 0.03 0.00 0.05 0.00 0.00 55.36 57.32 2rpp s GLN 51 Cb -0.31 -2.97 0.00 0.00 1.10 0.00 0.00 33.01 30.83 2rpp s GLN 51 CO 0.40 0.38 -0.22 0.08 -0.55 0.00 0.00 175.29 175.37 2rpp s VAL 52 N -1.45 1.99 0.70 1.34 1.01 -1.26 -4.47 120.40 118.25 2rpp s VAL 52 Ca 0.46 -0.96 -0.08 0.00 0.00 0.00 0.00 61.98 61.40 2rpp s VAL 52 Cb -0.21 -1.74 0.05 0.00 0.00 0.00 0.00 36.38 34.49 2rpp s VAL 52 CO 0.26 0.54 1.03 -0.70 0.00 0.00 0.00 175.10 176.23 2rpp s GLU 53 N 0.54 2.31 -0.40 2.72 2.12 0.59 -4.93 118.70 121.65 2rpp s GLU 53 Ca -0.14 -0.12 -0.32 0.00 0.36 0.00 0.00 54.97 54.75 2rpp s GLU 53 Cb -0.17 -2.14 -0.10 0.00 0.26 0.00 0.00 34.13 31.98 2rpp s GLU 53 CO 0.05 -1.20 2.28 0.09 -0.54 0.00 0.00 175.26 175.94 2rpp n ASN 54 N -2.94 2.24 -2.10 -1.70 4.13 -1.26 -0.99 115.26 112.65 2rpp n ASN 54 Ca 0.07 0.18 -0.15 0.00 1.68 0.00 0.00 54.58 56.36 2rpp n ASN 54 Cb 0.60 -1.35 -0.03 0.00 -1.54 0.00 0.00 39.78 37.46 2rpp n ASN 54 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2rpp n GLY 55 N 6.29 0.16 3.69 7.41 0.00 -1.26 -4.90 105.19 116.58 2rpp n GLY 55 Ca 0.40 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.33 2rpp n GLY 55 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2rpp s ARG 56 N -4.45 1.88 -0.25 1.61 3.52 -0.16 -3.95 118.95 117.14 2rpp s ARG 56 Ca 0.00 -1.36 -0.23 0.00 -0.13 0.00 0.00 55.73 54.02 2rpp s ARG 56 Cb 0.00 0.54 0.07 0.00 -1.56 0.00 0.00 34.95 34.00 2rpp s ARG 56 CO 0.00 -0.83 0.67 0.54 -0.81 0.00 0.00 175.30 174.87 2rpp s VAL 57 N -3.30 -0.00 0.19 7.11 0.11 -0.87 -0.30 120.40 123.34 2rpp s VAL 57 Ca 0.20 0.00 -0.26 0.00 -2.93 0.00 0.00 61.98 58.99 2rpp s VAL 57 Cb -0.03 -0.94 -0.08 0.00 -1.53 0.00 0.00 36.38 33.80 2rpp s VAL 57 CO 0.12 0.00 0.82 -0.63 -3.33 0.00 0.00 175.10 172.08 2rpp s ILE 58 N 0.47 4.30 0.35 7.04 1.01 -1.26 -1.40 121.20 131.71 2rpp s ILE 58 Ca -0.01 1.78 0.00 0.00 0.00 0.00 0.00 60.65 62.43 2rpp s ILE 58 Cb -0.05 -4.17 -0.03 0.00 0.01 0.00 0.00 42.46 38.22 2rpp s ILE 58 CO -0.01 0.49 0.56 0.00 0.00 0.00 0.00 174.94 175.98 2rpp s ALA 59 N -1.19 3.69 0.26 9.38 0.00 0.64 -2.43 121.76 132.11 2rpp s ALA 59 Ca 0.38 -0.90 -0.12 0.00 0.00 0.00 0.00 51.96 51.32 2rpp s ALA 59 Cb -0.23 -2.13 -0.08 0.00 0.00 0.00 0.00 23.12 20.68 2rpp s ALA 59 CO 0.27 -0.04 0.63 0.00 0.00 0.00 0.00 175.76 176.63 2rpp h PHE 61 N 2.52 -0.08 -0.45 0.00 3.57 -1.95 -3.33 116.94 117.21 2rpp h PHE 61 Ca -0.47 -0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.11 2rpp h PHE 61 Cb 1.17 0.03 -0.08 0.00 2.79 0.00 0.00 35.95 39.86 2rpp h PHE 61 CO 0.62 0.17 -0.07 -0.44 -2.23 0.00 0.00 178.31 176.35 2rpp h ASP 62 N -1.00 -0.34 -1.00 0.41 5.19 -1.96 -0.68 116.42 117.04 2rpp h ASP 62 Ca -0.01 0.13 0.38 0.00 -0.62 0.00 0.00 57.03 56.90 2rpp h ASP 62 Cb 0.29 0.25 -0.17 0.00 0.18 0.00 0.00 39.33 39.88 2rpp h ASP 62 CO 0.01 -0.12 0.55 0.77 -3.12 0.00 0.00 179.24 177.33 2rpp h SER 63 N 0.03 0.40 -0.98 6.45 4.64 -1.82 0.95 113.55 123.22 2rpp h SER 63 Ca 0.22 0.23 0.15 0.00 -0.47 0.00 0.00 61.79 61.92 2rpp h SER 63 Cb 0.34 0.22 -0.09 0.00 -0.31 0.00 0.00 62.40 62.55 2rpp h SER 63 CO -0.44 -0.31 0.59 -0.07 -0.87 0.00 0.00 176.83 175.74 2rpp h LEU 64 N 0.14 0.82 -1.18 5.97 3.38 -1.22 0.14 115.31 123.35 2rpp h LEU 64 Ca 0.80 0.07 -0.09 0.00 0.09 0.00 0.00 57.88 58.75 2rpp h LEU 64 Cb 1.99 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 42.65 2rpp h LEU 64 CO -0.70 0.38 -0.40 0.11 0.09 0.00 0.00 178.44 177.92 2rpp h LYS 65 N 0.86 0.02 0.00 1.13 1.79 0.85 -3.47 116.57 117.75 2rpp h LYS 65 Ca 0.52 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.98 2rpp h LYS 65 Cb 0.65 -0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.30 2rpp h LYS 65 CO -0.32 0.42 0.00 0.41 -1.08 0.00 0.00 179.45 178.88 2rpp n GLY 66 N -0.37 2.09 2.80 3.86 0.00 0.50 -5.06 105.19 109.01 2rpp n GLY 66 Ca -0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.71 2rpp n GLY 66 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2rpp s ARG 67 N -0.29 0.96 -0.13 1.61 1.81 -1.26 -4.98 118.95 116.67 2rpp s ARG 67 Ca 0.00 -0.78 -0.07 0.00 -1.72 0.00 0.00 55.73 53.16 2rpp s ARG 67 Cb 0.00 -2.24 -0.04 0.00 -0.45 0.00 0.00 34.95 32.22 2rpp s ARG 67 CO 0.00 -0.73 0.13 0.00 -0.68 0.00 0.00 175.30 174.03 2rpp n SER 69 N 2.22 1.81 -4.40 0.00 2.88 -1.26 -4.96 113.62 109.91 2rpp n SER 69 Ca -0.19 -0.12 -0.63 0.00 -1.33 0.00 0.00 58.87 56.60 2rpp n SER 69 Cb 0.54 -0.23 -0.10 0.00 -0.75 0.00 0.00 64.21 63.67 2rpp n SER 69 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2rpp n ARG 70 N -3.18 0.00 0.30 -1.46 5.12 -1.26 -4.85 116.66 111.33 2rpp n ARG 70 Ca -0.43 0.00 -0.12 0.00 -1.93 0.00 0.00 57.85 55.37 2rpp n ARG 70 Cb 1.00 -1.42 -0.06 0.00 -1.16 0.00 0.00 32.46 30.82 2rpp n ARG 70 CO 0.00 0.00 0.00 0.93 -1.93 0.00 0.00 177.63 176.63 2rpp h GLU 71 N 5.46 -0.76 -1.07 5.56 4.39 -2.05 -3.26 114.58 122.84 2rpp h GLU 71 Ca -0.35 0.05 -0.69 0.00 0.34 0.00 0.00 59.36 58.71 2rpp h GLU 71 Cb 1.30 0.17 -0.29 0.00 -0.10 0.00 0.00 28.75 29.84 2rpp h GLU 71 CO 0.95 -0.51 0.89 -1.71 -1.16 0.00 0.00 179.01 177.46 2rpp n ASN 72 N -4.74 7.70 -3.11 1.42 5.15 -1.26 -5.02 115.26 115.39 2rpp n ASN 72 Ca -0.10 -3.79 -0.39 0.00 -0.60 0.00 0.00 54.58 49.70 2rpp n ASN 72 Cb 0.31 -0.98 -0.05 0.00 -0.53 0.00 0.00 39.78 38.53 2rpp n ASN 72 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2rpp n LYS 74 N 0.95 1.93 -4.86 0.00 -0.00 -1.26 -4.41 118.16 110.52 2rpp n LYS 74 Ca 0.14 -1.47 -0.33 0.00 -0.00 0.00 0.00 58.31 56.64 2rpp n LYS 74 Cb 0.09 -1.47 -0.13 0.00 -0.00 0.00 0.00 35.03 33.52 2rpp n LYS 74 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.40 178.11 2rpp s TYR 75 N -2.08 2.73 0.58 5.58 2.02 -1.26 -2.85 117.35 122.07 2rpp s TYR 75 Ca 0.29 -0.18 -0.17 0.00 -0.37 0.00 0.00 57.07 56.65 2rpp s TYR 75 Cb 0.20 -1.66 -0.04 0.00 -0.40 0.00 0.00 41.96 40.06 2rpp s TYR 75 CO 0.35 0.17 1.06 -1.17 -1.57 0.00 0.00 175.55 174.39 2rpp s LEU 76 N -0.64 3.55 -0.61 -1.29 2.96 -1.02 -4.39 118.68 117.25 2rpp s LEU 76 Ca 0.10 1.87 -0.10 0.00 -0.22 0.00 0.00 54.13 55.78 2rpp s LEU 76 Cb -0.11 -4.54 0.16 0.00 0.50 0.00 0.00 46.19 42.19 2rpp s LEU 76 CO 0.01 -1.16 0.50 -1.00 -1.32 0.00 0.00 176.35 173.38 2rpp s HIS 77 N -2.33 3.49 0.55 5.38 3.76 -1.26 -0.36 115.29 124.52 2rpp s HIS 77 Ca 0.65 -2.00 -0.19 0.00 -0.15 0.00 0.00 55.06 53.37 2rpp s HIS 77 Cb -0.17 -3.56 -0.05 0.00 1.11 0.00 0.00 32.58 29.90 2rpp s HIS 77 CO 0.34 -0.97 1.13 -1.25 -0.85 0.00 0.00 174.74 173.14 2rpp s PRO 78 N 0.79 3.31 1.09 8.40 0.04 -1.26 -5.01 135.00 142.35 2rpp s PRO 78 Ca 0.11 1.59 -0.15 0.00 0.04 0.00 0.00 61.00 62.58 2rpp s PRO 78 Cb -0.21 -2.00 0.23 0.00 0.04 0.00 0.00 34.50 32.56 2rpp s PRO 78 CO -0.03 -0.88 1.10 -1.25 0.04 0.00 0.00 177.00 175.98 2rpp s PRO 79 N -3.36 -0.29 0.03 0.56 0.04 -1.26 -4.71 135.00 126.00 2rpp s PRO 79 Ca 0.72 0.27 -0.25 0.00 0.04 0.00 0.00 61.00 61.77 2rpp s PRO 79 Cb -0.23 -1.67 -0.17 0.00 0.04 0.00 0.00 34.50 32.46 2rpp s PRO 79 CO 0.28 -3.16 1.40 1.15 0.04 0.00 0.00 177.00 176.71 2rpp h THR 80 N -2.19 0.93 -0.70 1.26 2.02 -1.96 0.41 112.91 112.68 2rpp h THR 80 Ca -0.51 -0.55 0.20 0.00 0.77 0.00 0.00 66.41 66.32 2rpp h THR 80 Cb 1.32 1.26 -0.03 0.00 -1.74 0.00 0.00 68.15 68.96 2rpp h THR 80 CO 0.49 0.13 0.66 1.12 0.37 0.00 0.00 175.52 178.28 2rpp h HIS 81 N -0.51 0.00 0.08 3.16 2.07 -1.97 0.01 115.15 117.99 2rpp h HIS 81 Ca -0.02 0.00 -0.37 0.00 -2.85 0.00 0.00 60.37 57.12 2rpp h HIS 81 Cb 0.39 0.00 -0.04 0.00 2.57 0.00 0.00 27.41 30.33 2rpp h HIS 81 CO 0.01 0.00 -2.17 1.28 -3.07 0.00 0.00 177.93 173.99 2rpp n LEU 82 N -3.80 2.64 -0.32 6.12 4.77 -1.04 -4.31 117.00 121.07 2rpp n LEU 82 Ca 0.14 0.09 0.16 0.00 -0.03 0.00 0.00 56.01 56.38 2rpp n LEU 82 Cb 0.91 -0.97 0.33 0.00 -2.33 0.00 0.00 43.42 41.36 2rpp n LEU 82 CO 0.31 0.86 0.90 0.50 -1.33 0.00 0.00 177.39 178.63 2rpp h LYS 83 N 0.04 0.09 -0.69 3.23 3.64 0.18 0.52 116.57 123.60 2rpp h LYS 83 Ca -0.48 -0.01 0.11 0.00 -1.27 0.00 0.00 60.65 59.00 2rpp h LYS 83 Cb 1.99 -0.02 -0.08 0.00 -0.41 0.00 0.00 32.23 33.71 2rpp h LYS 83 CO 0.03 0.06 0.29 1.15 -2.27 0.00 0.00 179.45 178.71 2rpp h THR 84 N 0.10 0.77 -0.56 1.00 2.02 -1.69 0.88 112.91 115.42 2rpp h THR 84 Ca 0.61 -0.17 0.16 0.00 0.77 0.00 0.00 66.41 67.79 2rpp h THR 84 Cb 1.33 0.23 -0.02 0.00 -1.74 0.00 0.00 68.15 67.95 2rpp h THR 84 CO -0.78 0.09 0.67 1.56 0.37 0.00 0.00 175.52 177.43 2rpp h GLN 85 N 0.49 0.00 0.14 6.66 1.08 -0.16 0.87 115.11 124.20 2rpp h GLN 85 Ca 0.35 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.55 2rpp h GLN 85 Cb 0.44 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.88 2rpp h GLN 85 CO -0.32 0.00 -0.07 -0.07 -0.95 0.00 0.00 178.83 177.42 2rpp h LEU 86 N 0.00 -0.16 -1.98 1.46 3.38 -0.84 -3.24 115.31 113.94 2rpp h LEU 86 Ca 0.26 -0.29 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 2rpp h LEU 86 Cb 1.61 0.04 -0.00 0.00 0.09 0.00 0.00 40.66 42.40 2rpp h LEU 86 CO -0.00 0.42 -0.07 1.05 0.09 0.00 0.00 178.44 179.93 2rpp h GLU 87 N -0.96 0.00 -0.67 1.13 4.11 -1.11 -2.41 114.58 114.66 2rpp h GLU 87 Ca -0.02 0.00 0.02 0.00 0.07 0.00 0.00 59.36 59.43 2rpp h GLU 87 Cb 0.45 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.66 2rpp h GLU 87 CO 0.03 0.07 0.43 0.82 0.07 0.00 0.00 179.01 180.43 2rpp h ILE 88 N 0.00 1.11 -2.82 -1.06 2.04 -0.97 -3.35 117.51 112.45 2rpp h ILE 88 Ca -0.00 -0.29 -0.69 0.00 1.00 0.00 0.00 64.86 64.88 2rpp h ILE 88 Cb 0.14 0.19 -0.19 0.00 -0.74 0.00 0.00 36.82 36.22 2rpp h ILE 88 CO 0.01 0.15 0.36 0.21 0.00 0.00 0.00 178.15 178.88 2rpp s ASN 89 N -5.74 6.33 -0.18 1.72 3.84 -0.91 -4.85 114.94 115.16 2rpp s ASN 89 Ca -0.13 -1.58 -0.14 0.00 0.21 0.00 0.00 52.86 51.22 2rpp s ASN 89 Cb 0.15 -2.34 -0.22 0.00 -0.55 0.00 0.00 41.25 38.29 2rpp s ASN 89 CO 0.76 -1.13 0.23 -1.54 -2.79 0.00 0.00 177.10 172.64 2rpp n SER 90 N 6.47 1.98 -3.01 -4.21 3.41 -1.26 -4.95 113.62 112.05 2rpp n SER 90 Ca 0.01 0.31 0.00 0.00 -0.26 0.00 0.00 58.87 58.93 2rpp n SER 90 Cb 0.45 -0.90 0.00 0.00 -0.26 0.00 0.00 64.21 63.50 2rpp n SER 90 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2rpp n GLY 91 N 1.69 0.76 3.77 5.00 0.00 -1.26 -5.02 105.19 110.12 2rpp n GLY 91 Ca -0.34 -1.49 -0.34 0.00 0.00 0.00 0.00 46.02 43.85 2rpp n GLY 91 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2rpp s PRO 92 N 0.00 3.04 -1.21 1.61 0.04 -1.26 -4.94 135.00 132.29 2rpp s PRO 92 Ca 0.00 1.49 -0.18 0.00 0.04 0.00 0.00 61.00 62.34 2rpp s PRO 92 Cb 0.00 -1.97 0.08 0.00 0.04 0.00 0.00 34.50 32.65 2rpp s PRO 92 CO 0.00 -1.08 1.60 -1.12 0.04 0.00 0.00 177.00 176.44 2rpp s SER 93 N -2.23 6.79 -0.30 6.66 0.01 -1.26 -4.71 113.70 118.67 2rpp s SER 93 Ca 0.69 -2.30 0.11 0.00 1.31 0.00 0.00 55.95 55.77 2rpp s SER 93 Cb -0.22 -2.54 0.47 0.00 0.21 0.00 0.00 66.02 63.94 2rpp s SER 93 CO 0.35 -1.17 1.16 -1.54 0.41 0.00 0.00 173.24 172.44 2rpp n SER 94 N 8.00 3.94 0.00 2.44 3.41 -1.26 -5.27 113.62 124.88 2rpp n SER 94 Ca 0.42 -3.27 0.00 0.00 -0.26 0.00 0.00 58.87 55.76 2rpp n SER 94 Cb 0.47 -0.39 0.00 0.00 -0.26 0.00 0.00 64.21 64.03 2rpp n SER 94 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49