#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 3.29 -1.89 1.61 7.64 -1.26 -4.88 113.62 118.14 2rpp n SER 8 Ca 0.00 -2.99 -0.13 0.00 1.01 0.00 0.00 58.87 56.75 2rpp n SER 8 Cb 0.00 -0.42 -0.00 0.00 -1.01 0.00 0.00 64.21 62.77 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 -0.58 6.08 0.00 6.43 7.64 -1.26 -4.76 113.62 127.18 2rpp n SER 9 Ca 0.26 -2.87 0.00 0.00 1.01 0.00 0.00 58.87 57.27 2rpp n SER 9 Cb 0.86 -1.13 0.00 0.00 -1.01 0.00 0.00 64.21 62.92 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 0.90 3.29 3.82 0.23 0.00 -1.26 -4.89 105.19 107.29 2rpp n GLY 10 Ca 0.26 -0.83 -0.29 0.00 0.00 0.00 0.00 46.02 45.16 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 0.00 4.11 -1.38 1.61 0.01 -1.26 -2.61 113.70 114.18 2rpp s SER 11 Ca 0.00 1.03 -0.09 0.00 1.31 0.00 0.00 55.95 58.21 2rpp s SER 11 Cb 0.00 -1.65 0.02 0.00 0.21 0.00 0.00 66.02 64.60 2rpp s SER 11 CO 0.00 -2.18 1.10 -1.20 0.41 0.00 0.00 173.24 171.37 2rpp n SER 12 N -3.53 -5.29 0.00 2.44 7.64 -1.26 -4.60 113.62 109.01 2rpp n SER 12 Ca 0.07 -0.61 0.00 0.00 1.01 0.00 0.00 58.87 59.33 2rpp n SER 12 Cb 0.59 -4.75 0.00 0.00 -1.01 0.00 0.00 64.21 59.03 2rpp n SER 12 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2rpp n GLY 13 N -1.82 0.41 0.20 0.23 0.00 -1.26 -5.05 105.19 97.90 2rpp n GLY 13 Ca -0.03 -0.54 -0.04 0.00 0.00 0.00 0.00 46.02 45.40 2rpp n GLY 13 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2rpp h PRO 14 N 0.00 0.34 -4.20 1.61 0.13 -1.75 -3.40 132.00 124.72 2rpp h PRO 14 Ca 0.00 -0.18 -0.75 0.00 -0.87 0.00 0.00 66.00 64.20 2rpp h PRO 14 Cb 0.00 0.01 -0.23 0.00 0.13 0.00 0.00 31.00 30.90 2rpp h PRO 14 CO 0.00 0.73 -0.19 0.08 -0.23 0.00 0.00 178.00 178.39 2rpp s VAL 15 N -4.08 5.16 -0.21 1.56 1.01 -1.26 -4.78 120.40 117.79 2rpp s VAL 15 Ca -0.05 -1.37 -0.16 0.00 0.00 0.00 0.00 61.98 60.40 2rpp s VAL 15 Cb 0.13 -4.33 -0.12 0.00 0.00 0.00 0.00 36.38 32.06 2rpp s VAL 15 CO 0.79 -0.86 -0.14 0.54 0.00 0.00 0.00 175.10 175.43 2rpp n ARG 16 N 5.39 0.55 -4.18 2.72 1.74 -1.26 -4.91 116.66 116.70 2rpp n ARG 16 Ca -0.13 0.40 -0.35 0.00 -0.77 0.00 0.00 57.85 57.00 2rpp n ARG 16 Cb 0.41 -1.60 -0.08 0.00 -1.02 0.00 0.00 32.46 30.17 2rpp n ARG 16 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 2rpp n ASP 17 N -4.41 -0.95 -4.11 0.55 5.75 -1.26 0.11 116.55 112.23 2rpp n ASP 17 Ca -0.32 -1.12 -0.30 0.00 -0.01 0.00 0.00 54.79 53.04 2rpp n ASP 17 Cb 0.64 -1.42 -0.03 0.00 -1.03 0.00 0.00 41.12 39.28 2rpp n ASP 17 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 2rpp n THR 18 N -3.81 -2.02 -0.04 2.12 -2.24 -1.26 -4.86 114.28 102.17 2rpp n THR 18 Ca -0.00 -0.32 -0.21 0.00 -2.27 0.00 0.00 64.05 61.25 2rpp n THR 18 Cb 0.46 -2.06 -0.13 0.00 -2.10 0.00 0.00 70.33 66.50 2rpp n THR 18 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 2rpp n LYS 19 N -4.42 0.71 0.00 -0.78 4.81 0.30 -4.17 118.16 114.61 2rpp n LYS 19 Ca -0.17 0.25 0.14 0.00 -0.87 0.00 0.00 58.31 57.66 2rpp n LYS 19 Cb 0.61 -1.65 0.57 0.00 0.02 0.00 0.00 35.03 34.58 2rpp n LYS 19 CO 0.00 0.00 0.00 -2.67 1.17 0.00 0.00 177.40 175.90 2rpp n TRP 20 N -3.51 0.00 -1.46 5.64 4.27 -1.26 -3.80 117.44 117.31 2rpp n TRP 20 Ca -0.37 0.00 -0.23 0.00 -3.89 0.00 0.00 57.50 53.01 2rpp n TRP 20 Cb 1.00 -0.08 0.12 0.00 -1.36 0.00 0.00 31.31 30.99 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 -0.50 6.16 -4.71 5.67 4.77 -1.26 -4.80 117.00 122.33 2rpp n LEU 21 Ca 0.17 -4.10 -0.25 0.00 -0.03 0.00 0.00 56.01 51.80 2rpp n LEU 21 Cb 0.30 -0.75 -0.07 0.00 -2.33 0.00 0.00 43.42 40.57 2rpp n LEU 21 CO 0.21 1.44 -0.28 0.42 -1.33 0.00 0.00 177.39 177.85 2rpp s THR 22 N -4.06 3.92 -0.08 -5.08 -4.23 -1.25 -0.74 115.64 104.12 2rpp s THR 22 Ca 0.56 -1.48 -0.12 0.00 -1.18 0.00 0.00 61.69 59.47 2rpp s THR 22 Cb 0.46 -3.04 0.03 0.00 1.34 0.00 0.00 72.50 71.29 2rpp s THR 22 CO 0.03 -0.22 0.30 -0.76 -0.54 0.00 0.00 174.62 173.42 2rpp s LEU 23 N -3.32 0.89 0.19 4.79 1.43 -0.89 -4.89 118.68 116.88 2rpp s LEU 23 Ca 0.30 0.40 -0.31 0.00 -1.03 0.00 0.00 54.13 53.49 2rpp s LEU 23 Cb -0.08 1.09 -0.09 0.00 0.03 0.00 0.00 46.19 47.13 2rpp s LEU 23 CO 0.21 -0.23 1.41 -1.61 0.23 0.00 0.00 176.35 176.36 2rpp s GLU 24 N -0.41 4.30 -0.11 1.70 2.02 -1.26 -2.69 118.70 122.25 2rpp s GLU 24 Ca -0.05 2.19 -0.23 0.00 0.02 0.00 0.00 54.97 56.90 2rpp s GLU 24 Cb -0.03 -3.17 -0.03 0.00 0.10 0.00 0.00 34.13 30.99 2rpp s GLU 24 CO 0.02 -0.41 0.68 0.08 0.02 0.00 0.00 175.26 175.65 2rpp s VAL 25 N 0.46 5.03 -0.44 2.63 1.01 -1.26 -3.81 120.40 124.03 2rpp s VAL 25 Ca 0.61 1.37 -0.30 0.00 0.00 0.00 0.00 61.98 63.67 2rpp s VAL 25 Cb -0.40 -4.01 -0.10 0.00 0.00 0.00 0.00 36.38 31.88 2rpp s VAL 25 CO 0.37 0.20 2.33 0.00 0.00 0.00 0.00 175.10 178.00 2rpp h ARG 27 N 15.50 -0.10 0.01 0.00 2.43 -1.94 -0.99 114.38 129.29 2rpp h ARG 27 Ca -0.27 0.01 0.03 0.00 -0.81 0.00 0.00 59.98 58.94 2rpp h ARG 27 Cb 1.28 0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 30.80 2rpp h ARG 27 CO 1.09 -0.07 -0.40 1.96 -1.51 0.00 0.00 179.97 181.05 2rpp h GLN 28 N -0.11 -0.54 -0.92 0.20 4.20 -1.91 -2.40 115.11 113.63 2rpp h GLN 28 Ca 0.27 0.04 0.14 0.00 0.06 0.00 0.00 58.65 59.16 2rpp h GLN 28 Cb 0.56 0.12 -0.15 0.00 0.30 0.00 0.00 27.48 28.32 2rpp h GLN 28 CO -0.77 -0.36 -0.37 0.34 -0.67 0.00 0.00 178.83 177.00 2rpp n PHE 29 N -5.44 0.01 -0.23 2.96 7.35 -0.41 0.64 117.46 122.34 2rpp n PHE 29 Ca -0.06 1.13 -0.01 0.00 -0.76 0.00 0.00 57.45 57.75 2rpp n PHE 29 Cb 0.36 -0.83 0.05 0.00 0.35 0.00 0.00 39.48 39.42 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 -0.05 0.00 -4.13 1.08 -1.11 0.44 115.11 111.34 2rpp h GLN 30 Ca 0.31 0.00 -0.06 0.00 -1.45 0.00 0.00 58.65 57.46 2rpp h GLN 30 Cb 0.54 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.97 2rpp h GLN 30 CO -0.91 -0.04 -0.27 0.00 -0.95 0.00 0.00 178.83 176.67 2rpp h ARG 31 N -0.06 0.00 -0.08 1.46 3.08 -0.05 -3.47 114.38 115.27 2rpp h ARG 31 Ca 0.30 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.35 2rpp h ARG 31 Cb 0.53 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.58 2rpp h ARG 31 CO -0.72 0.27 0.00 0.41 -1.07 0.00 0.00 179.97 178.86 2rpp n GLY 32 N 0.59 1.17 1.03 0.04 0.00 0.21 -4.99 105.19 103.22 2rpp n GLY 32 Ca 0.01 -0.42 -0.03 0.00 0.00 0.00 0.00 46.02 45.59 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 -2.26 2.38 -3.54 2.61 -2.24 -1.02 -4.95 114.28 105.26 2rpp n THR 33 Ca 0.00 -3.30 -0.41 0.00 -2.27 0.00 0.00 64.05 58.06 2rpp n THR 33 Cb 0.24 -0.44 -0.08 0.00 -2.10 0.00 0.00 70.33 67.95 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 4.86 2.89 -4.52 0.00 2.88 -1.26 -4.82 113.62 113.65 2rpp n SER 35 Ca -0.07 -2.35 -0.34 0.00 -1.33 0.00 0.00 58.87 54.77 2rpp n SER 35 Cb 0.41 -0.57 -0.12 0.00 -0.75 0.00 0.00 64.21 63.18 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 -1.02 3.72 1.21 -1.46 1.81 -1.26 -5.08 118.95 116.87 2rpp s ARG 36 Ca 0.14 -0.49 -0.18 0.00 -1.72 0.00 0.00 55.73 53.49 2rpp s ARG 36 Cb 0.12 -2.98 0.25 0.00 -0.45 0.00 0.00 34.95 31.88 2rpp s ARG 36 CO 0.03 0.23 0.54 0.43 -0.68 0.00 0.00 175.30 175.85 2rpp n SER 37 N 3.60 -3.08 0.09 0.23 7.64 -1.26 -4.56 113.62 116.28 2rpp n SER 37 Ca -0.17 -0.46 -0.08 0.00 1.01 0.00 0.00 58.87 59.17 2rpp n SER 37 Cb 0.52 -0.96 0.02 0.00 -1.01 0.00 0.00 64.21 62.79 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 -2.89 0.24 -0.02 6.43 1.82 -1.96 -2.01 116.42 118.04 2rpp h ASP 38 Ca -0.42 -0.18 0.00 0.00 -0.39 0.00 0.00 57.03 56.04 2rpp h ASP 38 Cb 1.16 -0.07 0.00 0.00 0.68 0.00 0.00 39.33 41.09 2rpp h ASP 38 CO 0.28 0.96 -0.03 -0.62 -1.61 0.00 0.00 179.24 178.22 2rpp n GLU 39 N -3.70 2.07 -0.13 0.28 -0.58 -1.26 -4.34 120.64 112.98 2rpp n GLU 39 Ca -0.03 -1.60 -0.26 0.00 -0.42 0.00 0.00 57.16 54.85 2rpp n GLU 39 Cb 0.77 -1.47 -0.10 0.00 -0.57 0.00 0.00 31.44 30.06 2rpp n GLU 39 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 2rpp n GLU 40 N 0.94 0.60 -2.11 3.49 -0.58 -1.18 -4.97 120.64 116.82 2rpp n GLU 40 Ca 0.15 0.22 -0.39 0.00 -0.42 0.00 0.00 57.16 56.73 2rpp n GLU 40 Cb 0.52 -1.49 -0.00 0.00 -0.57 0.00 0.00 31.44 29.90 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 -0.11 1.90 -4.15 0.00 0.00 -1.26 -4.87 118.16 109.67 2rpp n LYS 42 Ca 0.05 -1.54 -0.10 0.00 -0.00 0.00 0.00 58.31 56.73 2rpp n LYS 42 Cb 0.45 -1.65 -0.10 0.00 -0.00 0.00 0.00 35.03 33.73 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 -1.71 0.84 -0.04 5.58 0.08 -1.26 -5.04 117.98 116.43 2rpp s PHE 43 Ca 0.29 -1.23 -0.07 0.00 0.12 0.00 0.00 56.93 56.04 2rpp s PHE 43 Cb 0.24 -0.48 -0.04 0.00 -0.57 0.00 0.00 43.02 42.17 2rpp s PHE 43 CO 0.06 -0.51 0.22 0.00 -0.10 0.00 0.00 175.22 174.89 2rpp s ALA 44 N -4.04 3.86 -0.47 5.36 0.00 -1.25 -4.90 121.76 120.32 2rpp s ALA 44 Ca 0.23 -0.59 0.04 0.00 0.00 0.00 0.00 51.96 51.64 2rpp s ALA 44 Cb 0.07 -2.04 0.12 0.00 0.00 0.00 0.00 23.12 21.28 2rpp s ALA 44 CO 0.01 0.64 0.21 -1.01 0.00 0.00 0.00 175.76 175.60 2rpp s HIS 45 N -1.18 3.34 -0.04 0.00 0.09 -1.26 -3.00 115.29 113.23 2rpp s HIS 45 Ca 0.22 -3.13 -0.30 0.00 -0.00 0.00 0.00 55.06 51.85 2rpp s HIS 45 Cb -0.13 -2.85 -0.05 0.00 -0.00 0.00 0.00 32.58 29.55 2rpp s HIS 45 CO 0.12 -0.80 1.48 -1.25 -0.00 0.00 0.00 174.74 174.30 2rpp s PRO 46 N 0.02 4.23 0.67 8.40 0.04 -1.26 -5.00 135.00 142.10 2rpp s PRO 46 Ca 0.15 2.02 -0.15 0.00 0.04 0.00 0.00 61.00 63.07 2rpp s PRO 46 Cb -0.24 -3.75 0.01 0.00 0.04 0.00 0.00 34.50 30.55 2rpp s PRO 46 CO -0.02 -0.70 1.11 -1.25 0.04 0.00 0.00 177.00 176.17 2rpp s PRO 47 N 3.17 2.75 0.28 0.56 0.04 -1.26 -4.88 135.00 135.66 2rpp s PRO 47 Ca 0.66 1.37 0.00 0.00 0.04 0.00 0.00 61.00 63.08 2rpp s PRO 47 Cb -0.31 -1.94 0.66 0.00 0.04 0.00 0.00 34.50 32.95 2rpp s PRO 47 CO 0.26 -1.29 1.63 0.87 0.04 0.00 0.00 177.00 178.51 2rpp h LYS 48 N -0.08 0.15 -0.88 4.56 1.79 -2.01 0.45 116.57 120.55 2rpp h LYS 48 Ca -0.46 -0.01 0.09 0.00 -2.18 0.00 0.00 60.65 58.08 2rpp h LYS 48 Cb 1.25 -0.03 -0.07 0.00 -1.58 0.00 0.00 32.23 31.79 2rpp h LYS 48 CO 0.54 0.10 0.53 0.77 -1.08 0.00 0.00 179.45 180.31 2rpp h SER 49 N 0.16 0.80 -3.67 0.86 0.02 -1.97 -3.41 113.55 106.33 2rpp h SER 49 Ca 0.53 0.04 -0.51 0.00 -0.84 0.00 0.00 61.79 61.01 2rpp h SER 49 Cb 1.06 -0.13 0.01 0.00 0.14 0.00 0.00 62.40 63.48 2rpp h SER 49 CO -0.69 0.47 0.46 0.00 -1.14 0.00 0.00 176.83 175.93 2rpp s GLN 51 N -0.86 4.35 -0.15 0.00 0.74 -1.21 -4.64 119.66 117.89 2rpp s GLN 51 Ca 0.47 2.01 -0.04 0.00 0.05 0.00 0.00 55.36 57.84 2rpp s GLN 51 Cb -0.30 -3.26 -0.03 0.00 1.10 0.00 0.00 33.01 30.51 2rpp s GLN 51 CO 0.37 -0.39 -0.01 0.08 -0.55 0.00 0.00 175.29 174.79 2rpp s VAL 52 N 1.04 4.19 0.47 1.34 1.01 -1.26 -4.59 120.40 122.60 2rpp s VAL 52 Ca 0.63 -0.26 -0.03 0.00 0.00 0.00 0.00 61.98 62.33 2rpp s VAL 52 Cb -0.35 -2.84 -0.02 0.00 0.00 0.00 0.00 36.38 33.17 2rpp s VAL 52 CO 0.30 0.50 0.73 -0.70 0.00 0.00 0.00 175.10 175.94 2rpp s GLU 53 N 0.17 3.24 -0.40 2.72 2.56 0.39 -4.96 118.70 122.42 2rpp s GLU 53 Ca 0.00 -0.15 -0.32 0.00 0.00 0.00 0.00 54.97 54.50 2rpp s GLU 53 Cb -0.13 -2.46 -0.10 0.00 2.00 0.00 0.00 34.13 33.44 2rpp s GLU 53 CO 0.02 -0.27 2.28 0.09 -0.56 0.00 0.00 175.26 176.82 2rpp n ASN 54 N -2.19 2.22 -0.91 -1.70 3.02 -1.26 -0.89 115.26 113.54 2rpp n ASN 54 Ca 0.01 0.19 -0.10 0.00 -0.03 0.00 0.00 54.58 54.65 2rpp n ASN 54 Cb 0.57 -1.35 -0.04 0.00 -0.61 0.00 0.00 39.78 38.35 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 6.31 0.96 3.66 7.41 0.00 -1.26 -4.87 105.19 117.40 2rpp n GLY 55 Ca 0.41 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.34 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 -2.69 1.57 -0.09 1.61 3.52 -0.07 -4.18 118.95 118.62 2rpp s ARG 56 Ca 0.00 -1.01 -0.09 0.00 -0.13 0.00 0.00 55.73 54.50 2rpp s ARG 56 Cb 0.00 0.54 0.02 0.00 -1.56 0.00 0.00 34.95 33.95 2rpp s ARG 56 CO 0.00 -0.68 0.24 0.54 -0.81 0.00 0.00 175.30 174.59 2rpp s VAL 57 N -3.93 0.00 0.01 7.11 0.11 -1.10 0.15 120.40 122.75 2rpp s VAL 57 Ca 0.13 -0.03 -0.23 0.00 -2.93 0.00 0.00 61.98 58.92 2rpp s VAL 57 Cb -0.03 -0.36 -0.05 0.00 -1.53 0.00 0.00 36.38 34.42 2rpp s VAL 57 CO 0.04 -0.02 0.70 -0.63 -3.33 0.00 0.00 175.10 171.86 2rpp s ILE 58 N 0.05 4.85 0.56 7.04 1.01 -1.26 -2.09 121.20 131.35 2rpp s ILE 58 Ca -0.01 1.48 -0.10 0.00 0.00 0.00 0.00 60.65 62.02 2rpp s ILE 58 Cb -0.02 -4.05 -0.04 0.00 0.01 0.00 0.00 42.46 38.36 2rpp s ILE 58 CO 0.00 0.36 0.94 0.00 0.00 0.00 0.00 174.94 176.24 2rpp s ALA 59 N 0.08 3.20 0.27 9.38 0.00 0.09 -2.87 121.76 131.90 2rpp s ALA 59 Ca 0.36 -0.18 -0.14 0.00 0.00 0.00 0.00 51.96 52.00 2rpp s ALA 59 Cb -0.19 -2.93 -0.08 0.00 0.00 0.00 0.00 23.12 19.92 2rpp s ALA 59 CO 0.20 -0.51 0.68 0.00 0.00 0.00 0.00 175.76 176.13 2rpp h PHE 61 N 2.59 -0.16 -0.43 0.00 3.57 -1.97 -3.31 116.94 117.22 2rpp h PHE 61 Ca -0.48 -0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.10 2rpp h PHE 61 Cb 1.18 0.05 -0.08 0.00 2.79 0.00 0.00 35.95 39.89 2rpp h PHE 61 CO 0.62 -0.10 -0.04 -0.44 -2.23 0.00 0.00 178.31 176.12 2rpp h ASP 62 N -0.96 -0.27 -0.98 0.41 3.32 -1.96 -1.66 116.42 114.32 2rpp h ASP 62 Ca -0.02 0.11 0.26 0.00 0.02 0.00 0.00 57.03 57.41 2rpp h ASP 62 Cb 0.13 0.22 -0.18 0.00 0.22 0.00 0.00 39.33 39.72 2rpp h ASP 62 CO 0.03 -0.09 0.00 0.77 -1.72 0.00 0.00 179.24 178.23 2rpp h SER 63 N 0.06 -0.51 -0.98 6.45 4.64 -1.81 0.81 113.55 122.21 2rpp h SER 63 Ca 0.21 0.28 0.31 0.00 -0.47 0.00 0.00 61.79 62.12 2rpp h SER 63 Cb 0.32 0.49 -0.15 0.00 -0.31 0.00 0.00 62.40 62.75 2rpp h SER 63 CO -0.40 -0.35 0.50 -0.07 -0.87 0.00 0.00 176.83 175.64 2rpp h LEU 64 N 0.01 0.40 -1.08 5.97 3.38 -1.38 1.29 115.31 123.90 2rpp h LEU 64 Ca 0.58 0.20 -0.10 0.00 0.09 0.00 0.00 57.88 58.65 2rpp h LEU 64 Cb 1.18 0.17 -0.01 0.00 0.09 0.00 0.00 40.66 42.09 2rpp h LEU 64 CO -0.92 -0.15 -0.45 0.11 0.09 0.00 0.00 178.44 177.11 2rpp h LYS 65 N 0.29 0.02 0.00 1.13 1.79 0.54 -3.47 116.57 116.87 2rpp h LYS 65 Ca 0.70 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 59.16 2rpp h LYS 65 Cb 1.58 -0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.23 2rpp h LYS 65 CO -0.63 0.47 0.00 0.41 -1.08 0.00 0.00 179.45 178.62 2rpp n GLY 66 N -0.22 1.79 2.80 3.86 0.00 0.44 -5.06 105.19 108.81 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 -1.60 0.00 0.00 0.00 173.32 171.72 2rpp s ARG 67 N -0.35 0.97 0.07 1.61 3.52 -1.26 -4.97 118.95 118.54 2rpp s ARG 67 Ca 0.00 -0.83 -0.00 0.00 -0.13 0.00 0.00 55.73 54.77 2rpp s ARG 67 Cb 0.00 -2.24 -0.04 0.00 -1.56 0.00 0.00 34.95 31.10 2rpp s ARG 67 CO 0.00 -0.74 0.23 0.00 -0.81 0.00 0.00 175.30 173.97 2rpp n SER 69 N 0.27 1.78 -3.41 0.00 2.88 -1.26 -4.97 113.62 108.92 2rpp n SER 69 Ca -0.05 0.30 -0.48 0.00 -1.33 0.00 0.00 58.87 57.30 2rpp n SER 69 Cb 0.51 -0.68 -0.08 0.00 -0.75 0.00 0.00 64.21 63.21 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 -4.27 0.00 0.26 -1.46 1.74 -1.26 -4.84 116.66 106.83 2rpp n ARG 70 Ca -0.16 0.00 -0.10 0.00 -0.77 0.00 0.00 57.85 56.82 2rpp n ARG 70 Cb 0.48 -1.14 -0.05 0.00 -1.02 0.00 0.00 32.46 30.74 2rpp n ARG 70 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 2rpp h GLU 71 N 5.35 -0.65 -0.99 5.56 4.39 -2.05 -3.07 114.58 123.12 2rpp h GLU 71 Ca -0.20 0.04 -0.17 0.00 0.34 0.00 0.00 59.36 59.37 2rpp h GLU 71 Cb 1.06 0.15 -0.10 0.00 -0.10 0.00 0.00 28.75 29.75 2rpp h GLU 71 CO 0.79 -0.43 0.22 0.27 -1.16 0.00 0.00 179.01 178.69 2rpp n ASN 72 N -4.09 3.23 -3.48 1.42 6.94 -1.26 -4.95 115.26 113.06 2rpp n ASN 72 Ca -0.08 -2.56 -0.50 0.00 -0.02 0.00 0.00 54.58 51.42 2rpp n ASN 72 Cb 0.27 -0.62 -0.09 0.00 -2.36 0.00 0.00 39.78 36.98 2rpp n ASN 72 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2rpp n LYS 74 N 4.56 1.25 -4.06 0.00 2.85 -1.26 -4.62 118.16 116.88 2rpp n LYS 74 Ca 0.34 -0.52 -0.13 0.00 -1.05 0.00 0.00 58.31 56.95 2rpp n LYS 74 Cb -0.04 -1.20 -0.12 0.00 -0.65 0.00 0.00 35.03 33.02 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 -0.59 0.52 0.29 5.58 1.51 -1.26 -3.33 117.35 120.06 2rpp s TYR 75 Ca 0.10 -0.39 -0.17 0.00 -1.01 0.00 0.00 57.07 55.61 2rpp s TYR 75 Cb 0.08 -0.32 -0.09 0.00 -0.11 0.00 0.00 41.96 41.52 2rpp s TYR 75 CO 0.00 -0.08 0.74 -1.17 -1.11 0.00 0.00 175.55 173.93 2rpp s LEU 76 N -1.16 4.16 -0.49 -1.29 2.96 -1.14 -4.73 118.68 117.00 2rpp s LEU 76 Ca -0.08 1.34 -0.09 0.00 -0.22 0.00 0.00 54.13 55.08 2rpp s LEU 76 Cb -0.08 -3.92 0.12 0.00 0.50 0.00 0.00 46.19 42.82 2rpp s LEU 76 CO 0.00 -0.13 0.36 -1.00 -1.32 0.00 0.00 176.35 174.26 2rpp s HIS 77 N -1.83 3.44 0.47 5.38 3.76 -1.26 -0.56 115.29 124.70 2rpp s HIS 77 Ca 0.50 -1.94 -0.23 0.00 -0.15 0.00 0.00 55.06 53.25 2rpp s HIS 77 Cb -0.12 -3.49 -0.07 0.00 1.11 0.00 0.00 32.58 30.01 2rpp s HIS 77 CO 0.19 -0.99 1.16 -1.25 -0.85 0.00 0.00 174.74 173.00 2rpp s PRO 78 N 1.26 3.72 1.08 8.40 0.04 -1.26 -5.00 135.00 143.24 2rpp s PRO 78 Ca 0.07 1.76 -0.15 0.00 0.04 0.00 0.00 61.00 62.72 2rpp s PRO 78 Cb -0.25 -2.37 0.23 0.00 0.04 0.00 0.00 34.50 32.14 2rpp s PRO 78 CO -0.01 -0.58 1.10 -1.25 0.04 0.00 0.00 177.00 176.30 2rpp s PRO 79 N -2.75 -0.22 0.02 0.56 0.04 -1.26 -4.76 135.00 126.63 2rpp s PRO 79 Ca 0.64 0.29 -0.25 0.00 0.04 0.00 0.00 61.00 61.73 2rpp s PRO 79 Cb -0.28 -1.68 -0.18 0.00 0.04 0.00 0.00 34.50 32.40 2rpp s PRO 79 CO 0.34 -3.12 1.42 1.15 0.04 0.00 0.00 177.00 176.83 2rpp h THR 80 N -2.17 1.08 -0.22 1.26 2.02 -1.98 0.52 112.91 113.42 2rpp h THR 80 Ca -0.52 -0.63 0.06 0.00 0.77 0.00 0.00 66.41 66.10 2rpp h THR 80 Cb 1.32 1.48 -0.01 0.00 -1.74 0.00 0.00 68.15 69.20 2rpp h THR 80 CO 0.50 0.15 0.53 1.12 0.37 0.00 0.00 175.52 178.19 2rpp h HIS 81 N -0.41 0.00 0.05 3.16 2.07 -1.97 0.80 115.15 118.85 2rpp h HIS 81 Ca -0.01 0.00 -0.38 0.00 -2.85 0.00 0.00 60.37 57.13 2rpp h HIS 81 Cb 0.34 0.00 -0.05 0.00 2.57 0.00 0.00 27.41 30.28 2rpp h HIS 81 CO 0.02 0.00 -2.25 1.28 -3.07 0.00 0.00 177.93 173.91 2rpp n LEU 82 N -3.14 2.62 -0.33 6.12 4.77 -1.00 -4.35 117.00 121.68 2rpp n LEU 82 Ca 0.03 0.03 0.23 0.00 -0.03 0.00 0.00 56.01 56.27 2rpp n LEU 82 Cb 0.63 -0.89 0.43 0.00 -2.33 0.00 0.00 43.42 41.27 2rpp n LEU 82 CO 0.17 0.86 0.92 0.29 -1.33 0.00 0.00 177.39 178.30 2rpp n LYS 83 N -3.32 -0.07 -0.16 3.23 5.02 0.27 0.34 118.16 123.46 2rpp n LYS 83 Ca -0.39 1.43 -0.04 0.00 -2.02 0.00 0.00 58.31 57.30 2rpp n LYS 83 Cb 1.02 -2.42 0.03 0.00 -0.02 0.00 0.00 35.03 33.65 2rpp n LYS 83 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 2rpp h THR 84 N 0.00 0.38 -0.67 -0.18 2.02 -1.74 -1.06 112.91 111.66 2rpp h THR 84 Ca 0.72 0.00 0.13 0.00 0.77 0.00 0.00 66.41 68.03 2rpp h THR 84 Cb 1.72 0.38 -0.13 0.00 -1.74 0.00 0.00 68.15 68.38 2rpp h THR 84 CO -0.85 0.00 -0.18 1.56 0.37 0.00 0.00 175.52 176.42 2rpp h GLN 85 N -0.08 -0.01 -0.73 6.66 4.20 -0.37 -0.30 115.11 124.49 2rpp h GLN 85 Ca 0.24 0.00 0.14 0.00 0.06 0.00 0.00 58.65 59.09 2rpp h GLN 85 Cb 0.45 0.00 -0.14 0.00 0.30 0.00 0.00 27.48 28.09 2rpp h GLN 85 CO -0.56 -0.01 -0.25 -0.07 -0.67 0.00 0.00 178.83 177.27 2rpp h LEU 86 N -0.01 -0.91 -0.07 1.46 3.38 -1.20 0.13 115.31 118.09 2rpp h LEU 86 Ca 0.32 0.23 0.04 0.00 0.09 0.00 0.00 57.88 58.56 2rpp h LEU 86 Cb 0.50 0.53 -0.06 0.00 0.09 0.00 0.00 40.66 41.72 2rpp h LEU 86 CO -0.69 -0.27 -0.30 -0.33 0.09 0.00 0.00 178.44 176.93 2rpp h GLU 87 N -0.05 -0.40 0.39 1.13 4.39 -1.01 -3.12 114.58 115.92 2rpp h GLU 87 Ca 0.32 0.03 -0.02 0.00 0.34 0.00 0.00 59.36 60.03 2rpp h GLU 87 Cb 0.56 0.09 -0.00 0.00 -0.10 0.00 0.00 28.75 29.30 2rpp h GLU 87 CO -0.77 -0.26 -0.25 0.82 -1.16 0.00 0.00 179.01 177.39 2rpp h ILE 88 N -0.41 0.00 -1.16 3.13 2.04 -0.88 -3.37 117.51 116.86 2rpp h ILE 88 Ca 0.08 0.00 -0.30 0.00 1.00 0.00 0.00 64.86 65.64 2rpp h ILE 88 Cb 0.53 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.61 2rpp h ILE 88 CO -0.30 0.00 0.99 0.21 0.00 0.00 0.00 178.15 179.04 2rpp s ASN 89 N -3.15 4.42 -0.02 1.72 3.84 0.30 -4.59 114.94 117.46 2rpp s ASN 89 Ca -0.10 0.48 -0.00 0.00 0.21 0.00 0.00 52.86 53.46 2rpp s ASN 89 Cb 0.02 -2.53 -0.01 0.00 -0.55 0.00 0.00 41.25 38.18 2rpp s ASN 89 CO 0.30 -3.14 -0.02 -1.54 -2.79 0.00 0.00 177.10 169.91 2rpp n SER 90 N 16.27 2.10 -2.70 -4.21 3.41 -1.26 -4.72 113.62 122.52 2rpp n SER 90 Ca 0.38 0.01 -0.00 0.00 -0.26 0.00 0.00 58.87 59.00 2rpp n SER 90 Cb 0.50 -0.04 0.02 0.00 -0.26 0.00 0.00 64.21 64.43 2rpp n SER 90 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2rpp s GLY 91 N -4.56 -1.75 0.42 5.00 0.00 -1.26 -4.59 107.32 100.57 2rpp s GLY 91 Ca -0.02 1.08 0.21 0.00 0.00 0.00 0.00 44.72 45.99 2rpp s GLY 91 CO 0.03 4.37 1.84 -0.56 0.00 0.00 0.00 173.10 178.78 2rpp h PRO 92 N 4.78 0.00 -6.65 2.90 0.13 -1.96 -3.44 132.00 127.77 2rpp h PRO 92 Ca -0.03 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.59 2rpp h PRO 92 Cb 1.21 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.32 2rpp h PRO 92 CO -0.10 0.29 0.36 0.45 -0.23 0.00 0.00 178.00 178.77 2rpp s SER 93 N -6.38 7.55 -0.33 1.44 0.15 -1.26 -5.00 113.70 109.86 2rpp s SER 93 Ca -0.01 1.88 -0.29 0.00 0.70 0.00 0.00 55.95 58.23 2rpp s SER 93 Cb 0.12 -2.60 0.01 0.00 -1.71 0.00 0.00 66.02 61.84 2rpp s SER 93 CO 0.66 0.02 1.18 -0.94 1.20 0.00 0.00 173.24 175.36 2rpp s SER 94 N -0.51 6.78 0.00 5.45 1.04 -1.26 -5.20 113.70 119.99 2rpp s SER 94 Ca 0.45 1.03 0.00 0.00 0.48 0.00 0.00 55.95 57.91 2rpp s SER 94 Cb -0.25 -2.54 0.00 0.00 0.10 0.00 0.00 66.02 63.33 2rpp s SER 94 CO 0.31 -1.02 0.04 0.61 0.98 0.00 0.00 173.24 174.16