#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 1.47 -4.78 1.61 2.88 -1.26 -5.00 113.62 108.54 2rpp n SER 8 Ca 0.00 0.25 -0.37 0.00 -1.33 0.00 0.00 58.87 57.43 2rpp n SER 8 Cb 0.00 -0.61 -0.03 0.00 -0.75 0.00 0.00 64.21 62.82 2rpp n SER 8 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2rpp s SER 9 N -6.76 6.58 0.00 -3.46 1.04 -1.26 -4.66 113.70 105.18 2rpp s SER 9 Ca -0.28 2.13 0.00 0.00 0.48 0.00 0.00 55.95 58.28 2rpp s SER 9 Cb 0.10 -2.59 0.00 0.00 0.10 0.00 0.00 66.02 63.63 2rpp s SER 9 CO 0.36 -0.62 0.00 0.61 0.98 0.00 0.00 173.24 174.56 2rpp n GLY 10 N 0.38 0.75 2.35 7.32 0.00 -1.26 -5.02 105.19 109.71 2rpp n GLY 10 Ca 0.06 -0.76 -0.33 0.00 0.00 0.00 0.00 46.02 44.98 2rpp n GLY 10 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2rpp n SER 11 N 0.00 7.53 -0.10 1.61 3.41 -1.26 -4.48 113.62 120.33 2rpp n SER 11 Ca 0.00 -3.70 -0.20 0.00 -0.26 0.00 0.00 58.87 54.71 2rpp n SER 11 Cb 0.00 -1.00 -0.10 0.00 -0.26 0.00 0.00 64.21 62.85 2rpp n SER 11 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2rpp n SER 12 N -0.69 1.86 -3.15 4.04 7.64 -1.26 -4.97 113.62 117.09 2rpp n SER 12 Ca 0.58 0.45 0.05 0.00 1.01 0.00 0.00 58.87 60.96 2rpp n SER 12 Cb 0.60 -0.94 -0.00 0.00 -1.01 0.00 0.00 64.21 62.86 2rpp n SER 12 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2rpp s GLY 13 N -4.82 -0.94 0.55 0.23 0.00 -1.26 -5.02 107.32 96.06 2rpp s GLY 13 Ca -0.28 1.94 0.34 0.00 0.00 0.00 0.00 44.72 46.72 2rpp s GLY 13 CO 0.53 3.95 1.99 -0.56 0.00 0.00 0.00 173.10 179.01 2rpp h PRO 14 N 7.55 0.00 -3.39 2.90 0.13 -1.93 -3.36 132.00 133.90 2rpp h PRO 14 Ca -0.08 0.00 -0.67 0.00 -0.87 0.00 0.00 66.00 64.38 2rpp h PRO 14 Cb 1.18 0.00 -0.38 0.00 0.13 0.00 0.00 31.00 31.93 2rpp h PRO 14 CO -0.03 0.00 -0.44 0.54 -0.23 0.00 0.00 178.00 177.84 2rpp s VAL 15 N -3.68 3.34 -0.45 1.56 0.11 -1.26 -5.02 120.40 115.00 2rpp s VAL 15 Ca 0.01 -3.43 0.04 0.00 -2.93 0.00 0.00 61.98 55.67 2rpp s VAL 15 Cb 0.09 -3.19 0.12 0.00 -1.53 0.00 0.00 36.38 31.87 2rpp s VAL 15 CO 0.53 -0.91 0.19 -0.60 -3.33 0.00 0.00 175.10 170.98 2rpp s ARG 16 N -0.56 1.81 -0.12 1.54 3.52 -1.26 -5.07 118.95 118.82 2rpp s ARG 16 Ca 0.20 -2.33 -0.21 0.00 -0.13 0.00 0.00 55.73 53.26 2rpp s ARG 16 Cb -0.18 -3.30 0.05 0.00 -1.56 0.00 0.00 34.95 29.97 2rpp s ARG 16 CO -0.06 -1.05 0.53 -0.51 -0.81 0.00 0.00 175.30 173.40 2rpp s ASP 17 N 0.23 -0.51 -0.28 -2.12 1.11 -1.26 -5.06 116.67 108.79 2rpp s ASP 17 Ca 0.15 0.76 0.08 0.00 0.18 0.00 0.00 52.55 53.72 2rpp s ASP 17 Cb -0.23 0.77 0.46 0.00 1.07 0.00 0.00 42.92 44.99 2rpp s ASP 17 CO -0.03 -0.37 1.19 0.35 1.18 0.00 0.00 175.17 177.49 2rpp n THR 18 N 1.92 2.41 -0.09 -1.27 -2.24 -1.26 -4.62 114.28 109.13 2rpp n THR 18 Ca -0.17 -4.02 -0.09 0.00 -2.27 0.00 0.00 64.05 57.50 2rpp n THR 18 Cb 0.56 -0.89 -0.14 0.00 -2.10 0.00 0.00 70.33 67.76 2rpp n THR 18 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 2rpp n LYS 19 N -0.74 1.08 -0.00 -0.78 2.85 -1.26 -4.48 118.16 114.82 2rpp n LYS 19 Ca 0.39 -0.01 0.09 0.00 -1.05 0.00 0.00 58.31 57.74 2rpp n LYS 19 Cb 0.93 -1.46 -0.13 0.00 -0.65 0.00 0.00 35.03 33.72 2rpp n LYS 19 CO 0.00 0.00 0.00 -2.67 -0.05 0.00 0.00 177.40 174.68 2rpp n TRP 20 N -2.67 0.00 -1.21 5.58 4.27 -1.26 -4.41 117.44 117.75 2rpp n TRP 20 Ca -0.29 0.00 -0.28 0.00 -3.89 0.00 0.00 57.50 53.04 2rpp n TRP 20 Cb 1.08 -0.25 0.05 0.00 -1.36 0.00 0.00 31.31 30.83 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 -1.85 7.17 -4.72 5.67 4.77 -1.26 -4.77 117.00 122.00 2rpp n LEU 21 Ca -0.00 -3.93 -0.23 0.00 -0.03 0.00 0.00 56.01 51.81 2rpp n LEU 21 Cb 0.42 -1.03 -0.06 0.00 -2.33 0.00 0.00 43.42 40.42 2rpp n LEU 21 CO 0.40 1.41 -0.26 0.42 -1.33 0.00 0.00 177.39 178.03 2rpp s THR 22 N -3.74 3.93 0.05 -5.08 -4.23 -1.26 -1.04 115.64 104.27 2rpp s THR 22 Ca 0.51 -1.60 -0.16 0.00 -1.18 0.00 0.00 61.69 59.27 2rpp s THR 22 Cb 0.40 -3.09 0.03 0.00 1.34 0.00 0.00 72.50 71.18 2rpp s THR 22 CO -0.04 -0.31 0.35 -0.76 -0.54 0.00 0.00 174.62 173.32 2rpp s LEU 23 N -3.59 0.65 0.26 4.79 1.43 -1.00 -4.86 118.68 116.36 2rpp s LEU 23 Ca 0.31 -0.14 -0.30 0.00 -1.03 0.00 0.00 54.13 52.98 2rpp s LEU 23 Cb -0.08 1.55 -0.09 0.00 0.03 0.00 0.00 46.19 47.60 2rpp s LEU 23 CO 0.22 -0.66 1.02 -1.61 0.23 0.00 0.00 176.35 175.54 2rpp s GLU 24 N -2.69 4.75 -0.13 1.70 2.02 -1.26 -2.79 118.70 120.31 2rpp s GLU 24 Ca -0.04 1.64 -0.20 0.00 0.02 0.00 0.00 54.97 56.39 2rpp s GLU 24 Cb -0.00 -3.24 -0.04 0.00 0.10 0.00 0.00 34.13 30.95 2rpp s GLU 24 CO -0.04 0.37 0.57 0.08 0.02 0.00 0.00 175.26 176.26 2rpp s VAL 25 N -1.15 5.11 -0.26 2.63 1.01 -1.26 -3.30 120.40 123.18 2rpp s VAL 25 Ca 0.43 1.14 -0.35 0.00 0.00 0.00 0.00 61.98 63.19 2rpp s VAL 25 Cb -0.29 -3.91 -0.12 0.00 0.00 0.00 0.00 36.38 32.07 2rpp s VAL 25 CO 0.36 0.25 2.03 0.00 0.00 0.00 0.00 175.10 177.75 2rpp h ARG 27 N 10.84 -0.01 -0.03 0.00 1.12 -1.94 -1.92 114.38 122.44 2rpp h ARG 27 Ca -0.37 0.00 0.02 0.00 -1.11 0.00 0.00 59.98 58.52 2rpp h ARG 27 Cb 1.30 0.00 -0.02 0.00 -0.01 0.00 0.00 29.97 31.24 2rpp h ARG 27 CO 0.99 -0.01 -0.08 1.96 -3.11 0.00 0.00 179.97 179.72 2rpp h GLN 28 N -0.01 -0.11 -0.77 0.20 1.08 -1.92 -2.86 115.11 110.72 2rpp h GLN 28 Ca 0.21 0.01 0.12 0.00 -1.45 0.00 0.00 58.65 57.54 2rpp h GLN 28 Cb 0.34 0.03 -0.13 0.00 -0.05 0.00 0.00 27.48 27.67 2rpp h GLN 28 CO -0.47 -0.08 -0.40 0.35 -0.95 0.00 0.00 178.83 177.29 2rpp h PHE 29 N -0.12 -1.14 -0.89 2.96 3.57 -1.68 0.50 116.94 120.14 2rpp h PHE 29 Ca 0.04 0.09 0.23 0.00 3.53 0.00 0.00 57.97 61.87 2rpp h PHE 29 Cb 0.18 0.61 -0.14 0.00 2.79 0.00 0.00 35.95 39.39 2rpp h PHE 29 CO -0.16 -0.40 0.30 1.96 -2.23 0.00 0.00 178.31 177.79 2rpp h GLN 30 N -0.11 0.27 0.01 1.11 1.08 -1.23 0.38 115.11 116.62 2rpp h GLN 30 Ca 0.26 -0.02 -0.19 0.00 -1.45 0.00 0.00 58.65 57.25 2rpp h GLN 30 Cb 0.56 -0.06 -0.02 0.00 -0.05 0.00 0.00 27.48 27.92 2rpp h GLN 30 CO -0.82 0.18 -0.88 0.00 -0.95 0.00 0.00 178.83 176.36 2rpp h ARG 31 N 0.27 0.12 0.00 1.46 3.08 -0.26 -3.48 114.38 115.58 2rpp h ARG 31 Ca 0.56 -0.14 0.00 0.00 0.07 0.00 0.00 59.98 60.47 2rpp h ARG 31 Cb 1.12 0.04 0.00 0.00 0.08 0.00 0.00 29.97 31.22 2rpp h ARG 31 CO -0.61 0.92 0.00 0.41 -1.07 0.00 0.00 179.97 179.62 2rpp n GLY 32 N 0.91 1.77 2.16 0.04 0.00 0.13 -5.02 105.19 105.18 2rpp n GLY 32 Ca -0.03 -0.11 -0.18 0.00 0.00 0.00 0.00 46.02 45.71 2rpp n GLY 32 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2rpp n THR 33 N -1.39 2.22 -3.80 2.61 5.66 -1.09 -4.98 114.28 113.52 2rpp n THR 33 Ca 0.00 -3.88 -0.35 0.00 -3.05 0.00 0.00 64.05 56.76 2rpp n THR 33 Cb 0.06 -0.56 -0.12 0.00 -1.55 0.00 0.00 70.33 68.16 2rpp n THR 33 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2rpp n SER 35 N 4.29 5.60 -4.22 0.00 3.41 -1.26 -4.85 113.62 116.58 2rpp n SER 35 Ca 0.01 -2.97 -0.32 0.00 -0.26 0.00 0.00 58.87 55.33 2rpp n SER 35 Cb 0.40 -0.95 -0.17 0.00 -0.26 0.00 0.00 64.21 63.24 2rpp n SER 35 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2rpp s ARG 36 N -1.72 3.06 0.94 4.33 0.52 -1.26 -5.08 118.95 119.74 2rpp s ARG 36 Ca 0.29 -0.87 -0.16 0.00 -0.52 0.00 0.00 55.73 54.48 2rpp s ARG 36 Cb 0.23 -2.33 0.24 0.00 0.52 0.00 0.00 34.95 33.62 2rpp s ARG 36 CO 0.01 0.16 0.64 0.43 0.02 0.00 0.00 175.30 176.57 2rpp n SER 37 N 3.58 -2.87 0.08 0.23 7.64 -1.26 -4.55 113.62 116.47 2rpp n SER 37 Ca -0.19 -0.72 -0.14 0.00 1.01 0.00 0.00 58.87 58.83 2rpp n SER 37 Cb 0.53 -0.68 -0.08 0.00 -1.01 0.00 0.00 64.21 62.97 2rpp n SER 37 CO 0.00 0.00 0.00 -0.78 -3.01 0.00 0.00 175.04 171.25 2rpp h ASP 38 N -2.79 0.47 1.00 6.43 3.58 -1.93 -0.36 116.42 122.82 2rpp h ASP 38 Ca -0.27 -0.42 0.00 0.00 0.42 0.00 0.00 57.03 56.76 2rpp h ASP 38 Cb 0.89 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 41.79 2rpp h ASP 38 CO 0.17 1.26 -0.08 -0.62 -2.88 0.00 0.00 179.24 177.08 2rpp n GLU 39 N -3.66 0.05 -0.13 0.28 1.02 -1.26 -4.02 120.64 112.92 2rpp n GLU 39 Ca -0.07 0.03 -0.26 0.00 -0.02 0.00 0.00 57.16 56.84 2rpp n GLU 39 Cb 0.90 -1.55 -0.09 0.00 -0.02 0.00 0.00 31.44 30.69 2rpp n GLU 39 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 2rpp n GLU 40 N -1.62 0.57 -2.37 3.49 0.00 -1.20 -4.95 120.64 114.56 2rpp n GLU 40 Ca 0.06 0.25 -0.42 0.00 0.00 0.00 0.00 57.16 57.06 2rpp n GLU 40 Cb 0.35 -1.47 -0.03 0.00 0.00 0.00 0.00 31.44 30.30 2rpp n GLU 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2rpp n LYS 42 N 3.42 1.38 -4.39 0.00 -0.00 -1.26 -4.79 118.16 112.52 2rpp n LYS 42 Ca 0.08 -0.32 -0.21 0.00 -0.00 0.00 0.00 58.31 57.85 2rpp n LYS 42 Cb 0.45 -1.53 -0.10 0.00 -0.00 0.00 0.00 35.03 33.85 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 -1.25 1.96 -0.15 5.58 0.08 -1.26 -5.03 117.98 117.91 2rpp s PHE 43 Ca 0.06 -0.46 -0.14 0.00 0.12 0.00 0.00 56.93 56.50 2rpp s PHE 43 Cb 0.04 -0.89 -0.05 0.00 -0.57 0.00 0.00 43.02 41.55 2rpp s PHE 43 CO 0.02 0.49 0.31 0.00 -0.10 0.00 0.00 175.22 175.94 2rpp s ALA 44 N -2.63 3.59 -0.52 5.36 0.00 -1.21 -4.85 121.76 121.51 2rpp s ALA 44 Ca 0.24 -0.42 0.01 0.00 0.00 0.00 0.00 51.96 51.79 2rpp s ALA 44 Cb -0.03 -2.40 0.13 0.00 0.00 0.00 0.00 23.12 20.82 2rpp s ALA 44 CO 0.10 0.11 0.28 -1.01 0.00 0.00 0.00 175.76 175.25 2rpp s HIS 45 N 0.37 3.39 -0.01 0.00 0.09 -1.26 -2.80 115.29 115.07 2rpp s HIS 45 Ca 0.18 -2.92 -0.30 0.00 -0.00 0.00 0.00 55.06 52.02 2rpp s HIS 45 Cb -0.13 -3.01 -0.06 0.00 -0.00 0.00 0.00 32.58 29.38 2rpp s HIS 45 CO 0.05 -0.83 1.45 -1.25 -0.00 0.00 0.00 174.74 174.16 2rpp s PRO 46 N 0.10 4.26 1.17 8.40 0.04 -1.26 -5.02 135.00 142.69 2rpp s PRO 46 Ca 0.15 2.02 -0.18 0.00 0.04 0.00 0.00 61.00 63.03 2rpp s PRO 46 Cb -0.23 -3.63 0.27 0.00 0.04 0.00 0.00 34.50 30.96 2rpp s PRO 46 CO -0.03 -0.63 1.11 -1.25 0.04 0.00 0.00 177.00 176.24 2rpp s PRO 47 N 2.65 -0.96 0.10 0.56 0.04 -1.26 -4.90 135.00 131.23 2rpp s PRO 47 Ca 0.66 0.02 -0.27 0.00 0.04 0.00 0.00 61.00 61.45 2rpp s PRO 47 Cb -0.32 -1.62 -0.11 0.00 0.04 0.00 0.00 34.50 32.49 2rpp s PRO 47 CO 0.27 -3.56 1.65 -0.22 0.04 0.00 0.00 177.00 175.18 2rpp h LYS 48 N -2.47 -0.45 -0.77 4.56 3.64 -2.00 -2.54 116.57 116.53 2rpp h LYS 48 Ca -0.47 0.03 0.15 0.00 -1.27 0.00 0.00 60.65 59.09 2rpp h LYS 48 Cb 1.30 0.10 -0.10 0.00 -0.41 0.00 0.00 32.23 33.13 2rpp h LYS 48 CO 0.38 -0.30 0.32 0.77 -2.27 0.00 0.00 179.45 178.35 2rpp h SER 49 N -0.47 0.31 -3.46 4.20 0.02 -1.95 -3.40 113.55 108.80 2rpp h SER 49 Ca 0.00 0.11 -0.52 0.00 -0.84 0.00 0.00 61.79 60.54 2rpp h SER 49 Cb 0.45 0.08 0.02 0.00 0.14 0.00 0.00 62.40 63.09 2rpp h SER 49 CO -0.07 0.12 0.58 0.00 -1.14 0.00 0.00 176.83 176.31 2rpp s GLN 51 N -0.19 3.78 -0.09 0.00 0.74 -1.19 -4.56 119.66 118.15 2rpp s GLN 51 Ca 0.54 1.27 0.04 0.00 0.05 0.00 0.00 55.36 57.26 2rpp s GLN 51 Cb -0.33 -2.10 -0.00 0.00 1.10 0.00 0.00 33.01 31.68 2rpp s GLN 51 CO 0.37 -0.44 -0.23 0.08 -0.55 0.00 0.00 175.29 174.52 2rpp s VAL 52 N -2.15 2.00 0.60 1.34 1.01 -1.26 -4.64 120.40 117.30 2rpp s VAL 52 Ca 0.65 -0.99 -0.03 0.00 0.00 0.00 0.00 61.98 61.61 2rpp s VAL 52 Cb -0.15 -1.72 0.03 0.00 0.00 0.00 0.00 36.38 34.54 2rpp s VAL 52 CO 0.23 0.55 0.88 -1.61 0.00 0.00 0.00 175.10 175.15 2rpp s GLU 53 N 0.28 2.55 -0.39 2.72 0.41 0.35 -4.95 118.70 119.65 2rpp s GLU 53 Ca -0.16 -0.40 -0.31 0.00 -0.41 0.00 0.00 54.97 53.69 2rpp s GLU 53 Cb -0.17 -2.33 -0.09 0.00 -1.78 0.00 0.00 34.13 29.75 2rpp s GLU 53 CO 0.08 -0.86 2.29 0.09 -0.49 0.00 0.00 175.26 176.38 2rpp n ASN 54 N -2.58 2.35 -1.31 -0.19 3.02 -1.26 -1.26 115.26 114.03 2rpp n ASN 54 Ca 0.07 0.12 -0.14 0.00 -0.03 0.00 0.00 54.58 54.60 2rpp n ASN 54 Cb 0.59 -1.39 -0.06 0.00 -0.61 0.00 0.00 39.78 38.31 2rpp n ASN 54 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2rpp n GLY 55 N 6.20 1.30 3.75 7.41 0.00 -1.26 -4.86 105.19 117.73 2rpp n GLY 55 Ca 0.39 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.32 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 -3.11 1.88 -0.12 1.61 3.52 -0.39 -4.37 118.95 117.97 2rpp s ARG 56 Ca 0.00 -1.25 -0.10 0.00 -0.13 0.00 0.00 55.73 54.25 2rpp s ARG 56 Cb 0.00 0.57 0.03 0.00 -1.56 0.00 0.00 34.95 33.99 2rpp s ARG 56 CO 0.00 -0.84 0.31 0.54 -0.81 0.00 0.00 175.30 174.49 2rpp s VAL 57 N -3.39 -0.00 0.01 7.11 0.11 -1.12 0.13 120.40 123.25 2rpp s VAL 57 Ca 0.17 0.02 -0.22 0.00 -2.93 0.00 0.00 61.98 59.02 2rpp s VAL 57 Cb -0.04 -0.44 -0.05 0.00 -1.53 0.00 0.00 36.38 34.32 2rpp s VAL 57 CO 0.10 0.01 0.65 -0.63 -3.33 0.00 0.00 175.10 171.89 2rpp s ILE 58 N 0.31 4.84 0.41 7.04 1.01 -1.26 -2.37 121.20 131.19 2rpp s ILE 58 Ca -0.01 1.36 -0.06 0.00 0.00 0.00 0.00 60.65 61.94 2rpp s ILE 58 Cb -0.03 -3.99 -0.05 0.00 0.01 0.00 0.00 42.46 38.40 2rpp s ILE 58 CO -0.01 0.41 0.72 0.00 0.00 0.00 0.00 174.94 176.06 2rpp s ALA 59 N -0.19 3.45 0.17 9.38 0.00 -0.21 -2.47 121.76 131.89 2rpp s ALA 59 Ca 0.33 -0.45 -0.29 0.00 0.00 0.00 0.00 51.96 51.55 2rpp s ALA 59 Cb -0.19 -2.54 -0.07 0.00 0.00 0.00 0.00 23.12 20.32 2rpp s ALA 59 CO 0.19 -0.12 0.92 0.00 0.00 0.00 0.00 175.76 176.75 2rpp h PHE 61 N 4.82 1.10 0.13 0.00 3.57 -1.96 -3.26 116.94 121.34 2rpp h PHE 61 Ca -0.44 -0.38 -0.01 0.00 3.53 0.00 0.00 57.97 60.67 2rpp h PHE 61 Cb 1.21 -0.21 0.00 0.00 2.79 0.00 0.00 35.95 39.74 2rpp h PHE 61 CO 0.63 1.21 -0.06 -0.44 -2.23 0.00 0.00 178.31 177.42 2rpp h ASP 62 N 0.67 -0.15 -1.68 0.41 3.32 -1.93 -3.06 116.42 114.00 2rpp h ASP 62 Ca 0.02 -0.32 0.51 0.00 0.02 0.00 0.00 57.03 57.26 2rpp h ASP 62 Cb 1.12 0.04 -0.10 0.00 0.22 0.00 0.00 39.33 40.61 2rpp h ASP 62 CO 0.12 0.27 1.17 0.77 -1.72 0.00 0.00 179.24 179.85 2rpp h SER 63 N -0.61 0.08 -0.70 6.45 4.64 -1.81 0.86 113.55 122.47 2rpp h SER 63 Ca -0.02 0.05 0.07 0.00 -0.47 0.00 0.00 61.79 61.42 2rpp h SER 63 Cb 0.47 0.05 -0.06 0.00 -0.31 0.00 0.00 62.40 62.55 2rpp h SER 63 CO 0.03 -0.08 0.38 -0.07 -0.87 0.00 0.00 176.83 176.22 2rpp h LEU 64 N 0.02 0.55 -1.25 5.97 3.38 -1.57 -0.71 115.31 121.70 2rpp h LEU 64 Ca 0.87 0.04 -0.07 0.00 0.09 0.00 0.00 57.88 58.80 2rpp h LEU 64 Cb 3.24 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 43.91 2rpp h LEU 64 CO -0.16 0.34 -0.36 0.11 0.09 0.00 0.00 178.44 178.46 2rpp h LYS 65 N 0.68 0.00 0.00 1.13 1.79 0.62 -3.47 116.57 117.32 2rpp h LYS 65 Ca 0.32 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.79 2rpp h LYS 65 Cb 0.24 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.89 2rpp h LYS 65 CO -0.21 0.36 0.00 0.41 -1.08 0.00 0.00 179.45 178.93 2rpp n GLY 66 N -0.32 1.27 2.80 3.86 0.00 -0.27 -5.06 105.19 107.47 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 -0.38 0.95 0.17 1.61 1.81 -1.26 -4.98 118.95 116.87 2rpp s ARG 67 Ca 0.00 -0.79 0.03 0.00 -1.72 0.00 0.00 55.73 53.25 2rpp s ARG 67 Cb 0.00 -2.23 -0.03 0.00 -0.45 0.00 0.00 34.95 32.24 2rpp s ARG 67 CO 0.00 -0.74 0.29 0.00 -0.68 0.00 0.00 175.30 174.18 2rpp n SER 69 N -0.72 0.39 -2.92 0.00 2.88 -1.26 -5.02 113.62 106.98 2rpp n SER 69 Ca -0.07 0.06 -0.41 0.00 -1.33 0.00 0.00 58.87 57.11 2rpp n SER 69 Cb 0.55 -0.13 -0.08 0.00 -0.75 0.00 0.00 64.21 63.79 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 -3.20 0.00 0.01 -1.46 5.12 -1.26 -4.83 116.66 111.04 2rpp n ARG 70 Ca -0.03 0.00 -0.01 0.00 -1.93 0.00 0.00 57.85 55.88 2rpp n ARG 70 Cb 0.41 -1.02 -0.00 0.00 -1.16 0.00 0.00 32.46 30.69 2rpp n ARG 70 CO 0.00 0.00 0.00 1.49 -1.93 0.00 0.00 177.63 177.19 2rpp h GLU 71 N 5.83 -0.03 -1.23 5.56 4.22 -2.06 -2.81 114.58 124.06 2rpp h GLU 71 Ca -0.09 0.00 -0.15 0.00 0.08 0.00 0.00 59.36 59.20 2rpp h GLU 71 Cb 0.96 0.01 -0.08 0.00 0.50 0.00 0.00 28.75 30.14 2rpp h GLU 71 CO 0.73 -0.02 0.19 0.09 -2.18 0.00 0.00 179.01 177.82 2rpp n ASN 72 N -2.26 4.05 -3.68 1.04 4.13 -1.26 -4.95 115.26 112.33 2rpp n ASN 72 Ca -0.00 -2.52 -0.52 0.00 1.68 0.00 0.00 54.58 53.21 2rpp n ASN 72 Cb 0.01 -0.74 -0.09 0.00 -1.54 0.00 0.00 39.78 37.42 2rpp n ASN 72 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2rpp n LYS 74 N 4.90 1.68 -4.56 0.00 2.85 -1.26 -4.51 118.16 117.25 2rpp n LYS 74 Ca 0.37 -1.42 -0.22 0.00 -1.05 0.00 0.00 58.31 55.99 2rpp n LYS 74 Cb -0.04 -1.58 -0.16 0.00 -0.65 0.00 0.00 35.03 32.61 2rpp n LYS 74 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 2rpp s TYR 75 N -1.57 1.22 0.49 5.58 2.02 -1.26 -3.17 117.35 120.66 2rpp s TYR 75 Ca 0.27 -0.31 -0.20 0.00 -0.37 0.00 0.00 57.07 56.45 2rpp s TYR 75 Cb 0.22 -0.84 -0.08 0.00 -0.40 0.00 0.00 41.96 40.87 2rpp s TYR 75 CO 0.05 -0.11 1.07 -1.17 -1.57 0.00 0.00 175.55 173.82 2rpp s LEU 76 N 0.07 3.85 -0.60 -1.29 2.96 -1.03 -4.45 118.68 118.19 2rpp s LEU 76 Ca -0.02 2.01 -0.10 0.00 -0.22 0.00 0.00 54.13 55.80 2rpp s LEU 76 Cb -0.09 -4.53 0.15 0.00 0.50 0.00 0.00 46.19 42.23 2rpp s LEU 76 CO 0.01 -0.87 0.49 -1.00 -1.32 0.00 0.00 176.35 173.65 2rpp s HIS 77 N -1.89 3.49 0.45 5.38 3.76 -1.26 0.06 115.29 125.28 2rpp s HIS 77 Ca 0.68 -2.01 -0.23 0.00 -0.15 0.00 0.00 55.06 53.34 2rpp s HIS 77 Cb -0.19 -3.55 -0.08 0.00 1.11 0.00 0.00 32.58 29.87 2rpp s HIS 77 CO 0.23 -0.97 1.17 -1.25 -0.85 0.00 0.00 174.74 173.07 2rpp s PRO 78 N 0.80 3.82 1.07 8.40 0.04 -1.26 -5.03 135.00 142.83 2rpp s PRO 78 Ca 0.11 1.80 -0.15 0.00 0.04 0.00 0.00 61.00 62.80 2rpp s PRO 78 Cb -0.21 -2.46 0.23 0.00 0.04 0.00 0.00 34.50 32.09 2rpp s PRO 78 CO -0.03 -0.51 1.10 -1.25 0.04 0.00 0.00 177.00 176.35 2rpp s PRO 79 N -2.61 -0.18 0.12 0.56 0.04 -1.26 -4.72 135.00 126.94 2rpp s PRO 79 Ca 0.62 0.30 -0.14 0.00 0.04 0.00 0.00 61.00 61.83 2rpp s PRO 79 Cb -0.29 -1.68 -0.05 0.00 0.04 0.00 0.00 34.50 32.52 2rpp s PRO 79 CO 0.36 -3.09 1.49 1.15 0.04 0.00 0.00 177.00 176.94 2rpp h THR 80 N -2.15 1.28 -0.01 1.26 2.02 -1.97 0.25 112.91 113.59 2rpp h THR 80 Ca -0.52 -1.30 0.00 0.00 0.77 0.00 0.00 66.41 65.36 2rpp h THR 80 Cb 1.32 1.35 -0.00 0.00 -1.74 0.00 0.00 68.15 69.08 2rpp h THR 80 CO 0.50 0.43 0.02 1.12 0.37 0.00 0.00 175.52 177.96 2rpp h HIS 81 N 0.56 0.00 0.03 3.16 2.07 -1.98 -2.61 115.15 116.38 2rpp h HIS 81 Ca 0.08 0.00 -0.39 0.00 -2.85 0.00 0.00 60.37 57.22 2rpp h HIS 81 Cb 0.73 0.00 -0.05 0.00 2.57 0.00 0.00 27.41 30.65 2rpp h HIS 81 CO 0.06 0.00 -2.32 1.28 -3.07 0.00 0.00 177.93 173.88 2rpp n LEU 82 N -3.51 2.77 -0.32 6.12 4.77 -1.04 -4.41 117.00 121.39 2rpp n LEU 82 Ca -0.03 0.01 0.13 0.00 -0.03 0.00 0.00 56.01 56.09 2rpp n LEU 82 Cb 0.10 -0.96 0.27 0.00 -2.33 0.00 0.00 43.42 40.50 2rpp n LEU 82 CO 0.24 0.87 0.84 0.11 -1.33 0.00 0.00 177.39 178.11 2rpp h LYS 83 N -0.10 0.06 -0.84 3.23 1.57 -0.12 0.60 116.57 120.97 2rpp h LYS 83 Ca -0.54 -0.00 0.13 0.00 -1.87 0.00 0.00 60.65 58.36 2rpp h LYS 83 Cb 1.89 -0.01 -0.14 0.00 0.08 0.00 0.00 32.23 34.05 2rpp h LYS 83 CO -0.08 0.04 -0.39 1.15 -0.57 0.00 0.00 179.45 179.60 2rpp h THR 84 N 0.06 0.06 -0.87 -0.16 2.02 -1.74 0.25 112.91 112.53 2rpp h THR 84 Ca 0.56 0.00 0.21 0.00 0.77 0.00 0.00 66.41 67.95 2rpp h THR 84 Cb 1.14 0.06 -0.16 0.00 -1.74 0.00 0.00 68.15 67.45 2rpp h THR 84 CO -0.83 0.00 -0.02 1.56 0.37 0.00 0.00 175.52 176.60 2rpp h GLN 85 N -0.07 0.06 -0.71 6.66 7.50 -1.13 0.37 115.11 127.79 2rpp h GLN 85 Ca 0.29 -0.00 0.15 0.00 0.50 0.00 0.00 58.65 59.58 2rpp h GLN 85 Cb 0.57 -0.01 -0.10 0.00 0.05 0.00 0.00 27.48 27.99 2rpp h GLN 85 CO -0.87 0.04 0.18 -0.07 -1.50 0.00 0.00 178.83 176.61 2rpp h LEU 86 N 0.06 0.04 0.62 1.46 3.38 -0.55 -1.68 115.31 118.63 2rpp h LEU 86 Ca 0.48 0.14 -0.03 0.00 0.09 0.00 0.00 57.88 58.56 2rpp h LEU 86 Cb 0.89 0.17 0.01 0.00 0.09 0.00 0.00 40.66 41.82 2rpp h LEU 86 CO -0.80 -0.01 -0.30 -0.33 0.09 0.00 0.00 178.44 177.09 2rpp h GLU 87 N 0.29 -0.80 -0.94 1.13 4.39 -0.18 -2.95 114.58 115.52 2rpp h GLU 87 Ca 0.40 0.05 0.28 0.00 0.34 0.00 0.00 59.36 60.43 2rpp h GLU 87 Cb 0.65 0.18 -0.15 0.00 -0.10 0.00 0.00 28.75 29.33 2rpp h GLU 87 CO -0.48 -0.50 0.33 0.82 -1.16 0.00 0.00 179.01 178.02 2rpp h ILE 88 N -0.94 0.24 -0.68 3.13 2.04 -0.78 -3.39 117.51 117.13 2rpp h ILE 88 Ca -0.09 -0.07 -0.73 0.00 1.00 0.00 0.00 64.86 64.98 2rpp h ILE 88 Cb 0.67 0.03 -0.02 0.00 -0.74 0.00 0.00 36.82 36.76 2rpp h ILE 88 CO 0.14 0.04 1.30 -3.20 0.00 0.00 0.00 178.15 176.42 2rpp n ASN 89 N -5.22 1.55 -4.27 1.72 5.15 -0.69 -4.92 115.26 108.58 2rpp n ASN 89 Ca 0.26 0.62 -0.29 0.00 -0.60 0.00 0.00 54.58 54.57 2rpp n ASN 89 Cb 0.83 -1.09 0.17 0.00 -0.53 0.00 0.00 39.78 39.16 2rpp n ASN 89 CO 0.00 0.00 0.00 -0.44 1.40 0.00 0.00 177.26 178.22 2rpp s SER 90 N 6.22 3.42 0.00 1.20 0.01 -1.26 -5.03 113.70 118.26 2rpp s SER 90 Ca 1.13 0.20 0.00 0.00 1.31 0.00 0.00 55.95 58.59 2rpp s SER 90 Cb -1.17 -0.33 0.00 0.00 0.21 0.00 0.00 66.02 64.73 2rpp s SER 90 CO 0.59 -2.53 0.00 0.61 0.41 0.00 0.00 173.24 172.32 2rpp n GLY 91 N -3.58 0.03 0.00 3.44 0.00 -1.26 -4.85 105.19 98.97 2rpp n GLY 91 Ca 0.15 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.24 2rpp n GLY 91 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2rpp n PRO 92 N -1.52 0.27 -1.77 1.61 -0.04 -1.26 -4.80 135.00 127.49 2rpp n PRO 92 Ca 0.00 0.11 -0.42 0.00 -0.04 0.00 0.00 63.50 63.16 2rpp n PRO 92 Cb 0.00 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 31.94 2rpp n PRO 92 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2rpp s SER 93 N -2.44 6.39 -1.02 3.54 0.01 -1.26 -4.94 113.70 113.98 2rpp s SER 93 Ca 0.16 2.89 -0.07 0.00 1.31 0.00 0.00 55.95 60.24 2rpp s SER 93 Cb 0.10 -2.62 0.26 0.00 0.21 0.00 0.00 66.02 63.97 2rpp s SER 93 CO 0.21 -0.93 0.98 -0.55 0.41 0.00 0.00 173.24 173.36 2rpp s SER 94 N 0.82 6.88 0.00 2.44 0.15 -1.26 -5.10 113.70 117.63 2rpp s SER 94 Ca 0.68 -3.54 0.00 0.00 0.70 0.00 0.00 55.95 53.80 2rpp s SER 94 Cb -0.48 -2.12 0.00 0.00 -1.71 0.00 0.00 66.02 61.71 2rpp s SER 94 CO 0.40 -0.29 0.25 0.61 1.20 0.00 0.00 173.24 175.41