#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rpp s SER 8 N 0.00 2.35 -0.30 1.61 1.04 -1.26 -5.10 113.70 112.03 2rpp s SER 8 Ca 0.00 -0.51 -0.11 0.00 0.48 0.00 0.00 55.95 55.80 2rpp s SER 8 Cb 0.00 -0.51 0.15 0.00 0.10 0.00 0.00 66.02 65.76 2rpp s SER 8 CO 0.00 -0.26 0.79 -0.44 0.98 0.00 0.00 173.24 174.31 2rpp s SER 9 N 1.92 -0.92 0.00 7.02 0.01 -1.26 -5.17 113.70 115.31 2rpp s SER 9 Ca 0.02 1.15 0.00 0.00 1.31 0.00 0.00 55.95 58.43 2rpp s SER 9 Cb -0.15 2.00 0.00 0.00 0.21 0.00 0.00 66.02 68.08 2rpp s SER 9 CO -0.07 -0.18 0.00 0.61 0.41 0.00 0.00 173.24 174.01 2rpp n GLY 10 N 5.27 3.34 2.51 3.44 0.00 -1.26 -5.00 105.19 113.49 2rpp n GLY 10 Ca -0.10 -0.67 -0.36 0.00 0.00 0.00 0.00 46.02 44.90 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 7.36 0.14 1.61 3.41 -1.26 -4.68 113.62 120.20 2rpp n SER 11 Ca 0.00 -3.80 -0.14 0.00 -0.26 0.00 0.00 58.87 54.67 2rpp n SER 11 Cb 0.00 -0.95 -0.08 0.00 -0.26 0.00 0.00 64.21 62.92 2rpp n SER 11 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2rpp h SER 12 N 2.36 -0.29 -4.33 4.04 0.02 -2.06 -3.44 113.55 109.84 2rpp h SER 12 Ca 0.57 -0.15 -0.70 0.00 -0.84 0.00 0.00 61.79 60.67 2rpp h SER 12 Cb 0.61 0.08 -0.27 0.00 0.14 0.00 0.00 62.40 62.96 2rpp h SER 12 CO 1.46 -0.00 -0.84 -0.83 -1.14 0.00 0.00 176.83 175.48 2rpp s GLY 13 N -2.58 1.40 -0.01 -3.77 0.00 -1.26 -5.10 107.32 96.00 2rpp s GLY 13 Ca -0.15 -1.10 -0.30 0.00 0.00 0.00 0.00 44.72 43.17 2rpp s GLY 13 CO 0.60 -0.92 1.46 2.56 0.00 0.00 0.00 173.10 176.79 2rpp s PRO 14 N -0.80 4.26 -0.08 2.90 0.04 -1.26 -5.02 135.00 135.03 2rpp s PRO 14 Ca 0.11 2.03 0.01 0.00 0.04 0.00 0.00 61.00 63.19 2rpp s PRO 14 Cb -0.10 -3.64 -0.02 0.00 0.04 0.00 0.00 34.50 30.78 2rpp s PRO 14 CO 0.00 -0.64 -0.11 0.08 0.04 0.00 0.00 177.00 176.38 2rpp s VAL 15 N 2.69 3.30 -0.47 -0.36 1.01 -1.26 -5.08 120.40 120.23 2rpp s VAL 15 Ca 0.66 -0.61 0.03 0.00 0.00 0.00 0.00 61.98 62.05 2rpp s VAL 15 Cb -0.32 -2.34 0.14 0.00 0.00 0.00 0.00 36.38 33.86 2rpp s VAL 15 CO 0.27 0.57 0.28 -0.13 0.00 0.00 0.00 175.10 176.09 2rpp s ARG 16 N -0.44 1.43 0.64 2.72 0.52 -1.26 -5.11 118.95 117.45 2rpp s ARG 16 Ca 0.06 -2.20 -0.17 0.00 -0.52 0.00 0.00 55.73 52.89 2rpp s ARG 16 Cb -0.12 -2.44 -0.04 0.00 0.52 0.00 0.00 34.95 32.87 2rpp s ARG 16 CO 0.02 -1.19 0.82 -0.40 0.02 0.00 0.00 175.30 174.57 2rpp n ASP 17 N 3.28 0.07 -4.15 0.23 5.68 -1.26 -4.85 116.55 115.56 2rpp n ASP 17 Ca 0.11 0.73 -0.43 0.00 -0.50 0.00 0.00 54.79 54.70 2rpp n ASP 17 Cb 0.36 -1.33 0.00 0.00 -1.14 0.00 0.00 41.12 39.01 2rpp n ASP 17 CO 0.00 0.00 0.00 0.41 -1.33 0.00 0.00 177.20 176.28 2rpp n THR 18 N -2.02 3.90 -0.12 2.12 -1.04 -1.26 -4.55 114.28 111.31 2rpp n THR 18 Ca 0.13 -3.88 -0.17 0.00 -2.04 0.00 0.00 64.05 58.08 2rpp n THR 18 Cb 0.48 -2.46 -0.12 0.00 -1.82 0.00 0.00 70.33 66.42 2rpp n THR 18 CO 0.00 0.00 0.00 2.29 -0.64 0.00 0.00 175.07 176.72 2rpp n LYS 19 N 6.39 0.62 0.05 -2.82 2.85 -1.26 -4.40 118.16 119.58 2rpp n LYS 19 Ca 0.46 0.14 0.13 0.00 -1.05 0.00 0.00 58.31 57.99 2rpp n LYS 19 Cb 0.41 -1.50 0.33 0.00 -0.65 0.00 0.00 35.03 33.63 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 -3.23 0.45 -1.31 5.58 4.27 -1.26 -3.83 117.44 118.11 2rpp n TRP 20 Ca -0.44 0.13 -0.33 0.00 -3.89 0.00 0.00 57.50 52.97 2rpp n TRP 20 Cb 0.97 -0.63 0.07 0.00 -1.36 0.00 0.00 31.31 30.36 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 -1.92 7.55 -4.45 5.67 4.77 -1.26 -4.80 117.00 122.55 2rpp n LEU 21 Ca 0.05 -4.20 -0.27 0.00 -0.03 0.00 0.00 56.01 51.55 2rpp n LEU 21 Cb 0.40 -1.00 -0.11 0.00 -2.33 0.00 0.00 43.42 40.38 2rpp n LEU 21 CO 0.33 1.46 -0.51 0.42 -1.33 0.00 0.00 177.39 177.76 2rpp s THR 22 N -4.52 2.55 0.02 -5.08 -4.23 -1.25 -1.12 115.64 102.02 2rpp s THR 22 Ca 0.60 -1.86 0.02 0.00 -1.18 0.00 0.00 61.69 59.27 2rpp s THR 22 Cb 0.47 -2.21 -0.02 0.00 1.34 0.00 0.00 72.50 72.09 2rpp s THR 22 CO -0.03 -0.06 -0.07 -0.76 -0.54 0.00 0.00 174.62 173.16 2rpp s LEU 23 N -2.55 2.16 -0.21 4.79 1.43 -0.02 -4.89 118.68 119.39 2rpp s LEU 23 Ca 0.20 -0.38 -0.29 0.00 -1.03 0.00 0.00 54.13 52.63 2rpp s LEU 23 Cb -0.09 -0.19 -0.01 0.00 0.03 0.00 0.00 46.19 45.93 2rpp s LEU 23 CO 0.10 -0.11 1.27 -0.70 0.23 0.00 0.00 176.35 177.15 2rpp s GLU 24 N -1.03 4.12 0.35 1.70 2.12 -1.26 -1.89 118.70 122.80 2rpp s GLU 24 Ca -0.06 1.51 -0.28 0.00 0.36 0.00 0.00 54.97 56.50 2rpp s GLU 24 Cb -0.07 -3.80 -0.10 0.00 0.26 0.00 0.00 34.13 30.41 2rpp s GLU 24 CO 0.00 -0.85 1.34 0.08 -0.54 0.00 0.00 175.26 175.29 2rpp s VAL 25 N 3.82 2.57 -0.38 3.70 1.01 -1.26 -3.95 120.40 125.91 2rpp s VAL 25 Ca 0.55 0.57 -0.28 0.00 0.00 0.00 0.00 61.98 62.82 2rpp s VAL 25 Cb -0.20 -3.36 -0.02 0.00 0.00 0.00 0.00 36.38 32.80 2rpp s VAL 25 CO 0.17 0.13 1.84 0.00 0.00 0.00 0.00 175.10 177.24 2rpp n ARG 27 N 8.57 -0.38 0.00 0.00 3.00 -1.26 -0.94 116.66 125.66 2rpp n ARG 27 Ca 0.23 1.40 -0.13 0.00 -0.01 0.00 0.00 57.85 59.34 2rpp n ARG 27 Cb 0.48 -2.06 -0.07 0.00 0.00 0.00 0.00 32.46 30.82 2rpp n ARG 27 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.63 179.59 2rpp h GLN 28 N 0.00 -0.49 -0.89 5.56 7.50 -1.92 -2.08 115.11 122.79 2rpp h GLN 28 Ca 0.14 0.03 0.14 0.00 0.50 0.00 0.00 58.65 59.46 2rpp h GLN 28 Cb 0.35 0.11 -0.14 0.00 0.05 0.00 0.00 27.48 27.85 2rpp h GLN 28 CO -0.81 -0.33 -0.35 0.34 -1.50 0.00 0.00 178.83 176.18 2rpp n PHE 29 N -5.44 0.02 -0.03 2.96 7.35 -0.12 0.37 117.46 122.58 2rpp n PHE 29 Ca -0.04 1.10 -0.13 0.00 -0.76 0.00 0.00 57.45 57.62 2rpp n PHE 29 Cb 0.37 -0.83 -0.07 0.00 0.35 0.00 0.00 39.48 39.29 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 -0.48 0.00 -4.13 1.08 -0.71 0.70 115.11 111.57 2rpp h GLN 30 Ca 0.31 0.03 -0.02 0.00 -1.45 0.00 0.00 58.65 57.52 2rpp h GLN 30 Cb 0.53 0.11 -0.00 0.00 -0.05 0.00 0.00 27.48 28.07 2rpp h GLN 30 CO -0.89 -0.32 -0.11 0.00 -0.95 0.00 0.00 178.83 176.56 2rpp h ARG 31 N -0.50 0.00 0.00 1.46 -0.00 -0.51 -3.46 114.38 111.37 2rpp h ARG 31 Ca 0.07 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.55 2rpp h ARG 31 Cb 0.64 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.61 2rpp h ARG 31 CO -0.45 0.11 0.00 0.41 0.00 0.00 0.00 179.97 180.04 2rpp n GLY 32 N -1.11 0.98 1.64 0.04 0.00 0.16 -4.99 105.19 101.92 2rpp n GLY 32 Ca -0.03 -0.13 -0.11 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.07 2.83 -3.99 2.61 -2.24 -0.99 -4.89 114.28 105.54 2rpp n THR 33 Ca 0.00 -2.27 -0.33 0.00 -2.27 0.00 0.00 64.05 59.18 2rpp n THR 33 Cb 0.00 -0.38 -0.14 0.00 -2.10 0.00 0.00 70.33 67.71 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 4.46 3.91 -4.48 0.00 2.88 -1.26 -4.85 113.62 114.27 2rpp n SER 35 Ca -0.09 -3.65 -0.34 0.00 -1.33 0.00 0.00 58.87 53.46 2rpp n SER 35 Cb 0.42 -0.82 -0.12 0.00 -0.75 0.00 0.00 64.21 62.94 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 -3.34 3.66 1.18 -1.46 0.52 -1.26 -5.09 118.95 113.16 2rpp s ARG 36 Ca 0.56 -0.51 -0.19 0.00 -0.52 0.00 0.00 55.73 55.07 2rpp s ARG 36 Cb 0.47 -3.04 0.30 0.00 0.52 0.00 0.00 34.95 33.21 2rpp s ARG 36 CO 0.09 0.11 0.67 0.45 0.02 0.00 0.00 175.30 176.64 2rpp n SER 37 N 3.96 -3.68 0.10 0.23 2.88 -1.26 -4.45 113.62 111.39 2rpp n SER 37 Ca -0.17 -0.68 -0.06 0.00 -1.33 0.00 0.00 58.87 56.63 2rpp n SER 37 Cb 0.52 -0.81 0.03 0.00 -0.75 0.00 0.00 64.21 63.20 2rpp n SER 37 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 2rpp h ASP 38 N -3.27 0.11 0.39 -3.46 5.19 -1.93 -0.78 116.42 112.67 2rpp h ASP 38 Ca -0.30 -0.09 0.00 0.00 -0.62 0.00 0.00 57.03 56.02 2rpp h ASP 38 Cb 1.03 -0.03 0.00 0.00 0.18 0.00 0.00 39.33 40.50 2rpp h ASP 38 CO 0.18 0.87 -0.14 -0.62 -3.12 0.00 0.00 179.24 176.42 2rpp n GLU 39 N -3.64 0.64 -0.10 3.56 -0.58 -1.26 -4.11 120.64 115.15 2rpp n GLU 39 Ca -0.02 -0.24 -0.20 0.00 -0.42 0.00 0.00 57.16 56.28 2rpp n GLU 39 Cb 0.77 -1.50 -0.07 0.00 -0.57 0.00 0.00 31.44 30.08 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 -0.97 0.44 -2.45 3.49 1.02 -1.14 -4.98 120.64 116.05 2rpp n GLU 40 Ca 0.13 0.19 -0.41 0.00 -0.02 0.00 0.00 57.16 57.05 2rpp n GLU 40 Cb 0.29 -1.24 -0.04 0.00 -0.02 0.00 0.00 31.44 30.43 2rpp n GLU 40 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2rpp n LYS 42 N 2.41 1.40 -4.17 0.00 2.85 -1.26 -4.81 118.16 114.57 2rpp n LYS 42 Ca 0.03 -0.87 -0.11 0.00 -1.05 0.00 0.00 58.31 56.31 2rpp n LYS 42 Cb 0.45 -1.34 -0.10 0.00 -0.65 0.00 0.00 35.03 33.39 2rpp n LYS 42 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 177.40 177.29 2rpp s PHE 43 N -0.98 1.00 -0.20 5.58 0.40 -1.26 -5.07 117.98 117.44 2rpp s PHE 43 Ca 0.17 -1.30 -0.10 0.00 -0.60 0.00 0.00 56.93 55.10 2rpp s PHE 43 Cb 0.14 -0.52 -0.05 0.00 0.51 0.00 0.00 43.02 43.10 2rpp s PHE 43 CO 0.02 -0.57 0.13 0.00 0.70 0.00 0.00 175.22 175.50 2rpp s ALA 44 N -4.09 3.68 -0.53 5.36 0.00 -1.25 -4.92 121.76 120.00 2rpp s ALA 44 Ca 0.31 -0.71 0.00 0.00 0.00 0.00 0.00 51.96 51.56 2rpp s ALA 44 Cb 0.07 -2.17 0.14 0.00 0.00 0.00 0.00 23.12 21.16 2rpp s ALA 44 CO 0.06 0.14 0.31 -1.01 0.00 0.00 0.00 175.76 175.26 2rpp s HIS 45 N 0.41 3.39 0.21 0.00 0.09 -1.26 -3.08 115.29 115.05 2rpp s HIS 45 Ca 0.08 -2.87 -0.30 0.00 -0.00 0.00 0.00 55.06 51.97 2rpp s HIS 45 Cb -0.11 -3.05 -0.09 0.00 -0.00 0.00 0.00 32.58 29.33 2rpp s HIS 45 CO -0.02 -0.84 1.29 -1.25 -0.00 0.00 0.00 174.74 173.93 2rpp s PRO 46 N 0.11 4.40 1.14 8.40 0.04 -1.26 -4.96 135.00 142.87 2rpp s PRO 46 Ca 0.15 2.04 -0.17 0.00 0.04 0.00 0.00 61.00 63.07 2rpp s PRO 46 Cb -0.22 -3.19 0.26 0.00 0.04 0.00 0.00 34.50 31.38 2rpp s PRO 46 CO -0.03 -0.22 1.10 -1.25 0.04 0.00 0.00 177.00 176.65 2rpp s PRO 47 N -0.31 -0.70 0.04 0.56 0.04 -1.26 -4.93 135.00 128.45 2rpp s PRO 47 Ca 0.55 0.12 -0.24 0.00 0.04 0.00 0.00 61.00 61.47 2rpp s PRO 47 Cb -0.36 -1.64 -0.17 0.00 0.04 0.00 0.00 34.50 32.37 2rpp s PRO 47 CO 0.39 -3.40 1.54 -0.22 0.04 0.00 0.00 177.00 175.35 2rpp h LYS 48 N -2.36 -0.03 -0.93 4.56 3.11 -2.00 -2.79 116.57 116.13 2rpp h LYS 48 Ca -0.48 0.00 0.22 0.00 -2.81 0.00 0.00 60.65 57.58 2rpp h LYS 48 Cb 1.31 0.01 -0.07 0.00 -1.00 0.00 0.00 32.23 32.47 2rpp h LYS 48 CO 0.42 0.18 0.62 0.66 -2.81 0.00 0.00 179.45 178.52 2rpp h SER 49 N -0.23 0.39 -3.43 4.20 4.64 -1.94 -3.39 113.55 113.78 2rpp h SER 49 Ca -0.00 0.05 -0.54 0.00 -0.47 0.00 0.00 61.79 60.82 2rpp h SER 49 Cb 0.22 -0.02 -0.04 0.00 -0.31 0.00 0.00 62.40 62.25 2rpp h SER 49 CO 0.00 0.14 0.19 0.00 -0.87 0.00 0.00 176.83 176.29 2rpp s GLN 51 N 0.12 3.60 -0.10 0.00 0.74 -1.19 -4.64 119.66 118.20 2rpp s GLN 51 Ca 0.40 1.47 0.03 0.00 0.05 0.00 0.00 55.36 57.31 2rpp s GLN 51 Cb -0.20 -2.06 0.01 0.00 1.10 0.00 0.00 33.01 31.86 2rpp s GLN 51 CO 0.23 -0.61 -0.20 0.08 -0.55 0.00 0.00 175.29 174.24 2rpp s VAL 52 N -1.90 1.77 0.65 1.34 1.01 -1.26 -4.65 120.40 117.36 2rpp s VAL 52 Ca 0.70 -0.84 -0.08 0.00 0.00 0.00 0.00 61.98 61.75 2rpp s VAL 52 Cb -0.20 -1.56 0.02 0.00 0.00 0.00 0.00 36.38 34.65 2rpp s VAL 52 CO 0.23 0.50 0.98 -1.61 0.00 0.00 0.00 175.10 175.20 2rpp s GLU 53 N 0.53 2.75 -0.44 2.72 2.02 0.18 -4.93 118.70 121.53 2rpp s GLU 53 Ca -0.16 0.09 -0.32 0.00 0.02 0.00 0.00 54.97 54.60 2rpp s GLU 53 Cb -0.17 -2.17 -0.11 0.00 0.10 0.00 0.00 34.13 31.78 2rpp s GLU 53 CO 0.06 -0.91 2.30 0.27 0.02 0.00 0.00 175.26 176.99 2rpp n ASN 54 N -2.78 2.06 -1.75 -0.19 6.94 -1.26 -0.85 115.26 117.42 2rpp n ASN 54 Ca 0.06 0.17 -0.15 0.00 -0.02 0.00 0.00 54.58 54.64 2rpp n ASN 54 Cb 0.58 -1.32 -0.04 0.00 -2.36 0.00 0.00 39.78 36.64 2rpp n ASN 54 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2rpp n GLY 55 N 6.36 0.77 3.72 4.83 0.00 -1.26 -4.88 105.19 114.73 2rpp n GLY 55 Ca 0.42 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.35 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 -3.83 1.89 -0.07 1.61 3.52 -0.03 -4.11 118.95 117.93 2rpp s ARG 56 Ca 0.00 -1.31 -0.26 0.00 -0.13 0.00 0.00 55.73 54.03 2rpp s ARG 56 Cb 0.00 0.56 0.06 0.00 -1.56 0.00 0.00 34.95 34.00 2rpp s ARG 56 CO 0.00 -0.84 0.58 0.54 -0.81 0.00 0.00 175.30 174.77 2rpp s VAL 57 N -3.31 0.01 -0.04 7.11 0.11 -0.79 0.50 120.40 123.99 2rpp s VAL 57 Ca 0.18 -0.11 -0.20 0.00 -2.93 0.00 0.00 61.98 58.92 2rpp s VAL 57 Cb -0.04 -0.89 -0.05 0.00 -1.53 0.00 0.00 36.38 33.88 2rpp s VAL 57 CO 0.11 -0.06 0.57 -0.63 -3.33 0.00 0.00 175.10 171.76 2rpp s ILE 58 N -1.02 5.01 -0.10 7.04 1.01 -1.26 -0.84 121.20 131.04 2rpp s ILE 58 Ca -0.10 1.18 -0.19 0.00 0.00 0.00 0.00 60.65 61.54 2rpp s ILE 58 Cb -0.02 -3.91 -0.04 0.00 0.01 0.00 0.00 42.46 38.50 2rpp s ILE 58 CO 0.07 0.38 0.51 0.00 0.00 0.00 0.00 174.94 175.91 2rpp s ALA 59 N 0.12 3.46 0.55 9.38 0.00 -0.27 -2.87 121.76 132.13 2rpp s ALA 59 Ca 0.30 -0.13 -0.22 0.00 0.00 0.00 0.00 51.96 51.92 2rpp s ALA 59 Cb -0.17 -2.69 -0.05 0.00 0.00 0.00 0.00 23.12 20.21 2rpp s ALA 59 CO 0.15 0.01 1.33 0.00 0.00 0.00 0.00 175.76 177.26 2rpp h PHE 61 N 1.39 0.00 -0.34 0.00 3.04 -1.96 -3.35 116.94 115.71 2rpp h PHE 61 Ca -0.51 0.00 0.05 0.00 3.98 0.00 0.00 57.97 61.50 2rpp h PHE 61 Cb 1.31 0.00 -0.05 0.00 2.56 0.00 0.00 35.95 39.77 2rpp h PHE 61 CO 0.45 0.64 0.04 -0.44 -2.02 0.00 0.00 178.31 176.98 2rpp h ASP 62 N -1.00 -0.05 -1.24 0.41 5.19 -1.93 -1.36 116.42 116.44 2rpp h ASP 62 Ca -0.08 0.07 0.39 0.00 -0.62 0.00 0.00 57.03 56.78 2rpp h ASP 62 Cb 0.70 0.10 -0.12 0.00 0.18 0.00 0.00 39.33 40.19 2rpp h ASP 62 CO -0.05 0.01 0.80 0.77 -3.12 0.00 0.00 179.24 177.65 2rpp h SER 63 N 0.14 0.29 -0.86 6.45 4.64 -1.78 0.47 113.55 122.91 2rpp h SER 63 Ca 0.16 0.12 0.18 0.00 -0.47 0.00 0.00 61.79 61.79 2rpp h SER 63 Cb 0.20 0.10 -0.11 0.00 -0.31 0.00 0.00 62.40 62.28 2rpp h SER 63 CO -0.24 -0.11 0.40 -0.07 -0.87 0.00 0.00 176.83 175.94 2rpp h LEU 64 N 0.16 0.41 -1.15 5.97 3.38 -1.38 0.51 115.31 123.21 2rpp h LEU 64 Ca 0.76 0.12 -0.05 0.00 0.09 0.00 0.00 57.88 58.80 2rpp h LEU 64 Cb 2.28 0.08 -0.01 0.00 0.09 0.00 0.00 40.66 43.10 2rpp h LEU 64 CO -0.39 0.11 -0.22 0.11 0.09 0.00 0.00 178.44 178.14 2rpp h LYS 65 N 0.50 0.00 0.00 1.13 1.79 -0.18 -3.47 116.57 116.34 2rpp h LYS 65 Ca 0.50 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.97 2rpp h LYS 65 Cb 0.84 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.49 2rpp h LYS 65 CO -0.44 0.22 0.00 0.41 -1.08 0.00 0.00 179.45 178.55 2rpp n GLY 66 N 0.11 0.80 2.81 3.86 0.00 0.18 -5.06 105.19 107.90 2rpp n GLY 66 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.52 1.01 0.16 1.61 3.00 -1.25 -4.97 118.95 117.98 2rpp s ARG 67 Ca 0.00 -0.71 -0.01 0.00 -1.00 0.00 0.00 55.73 54.00 2rpp s ARG 67 Cb 0.00 -2.28 -0.04 0.00 0.00 0.00 0.00 34.95 32.63 2rpp s ARG 67 CO 0.00 -0.67 0.34 0.00 0.00 0.00 0.00 175.30 174.97 2rpp n SER 69 N -0.31 1.06 -3.02 0.00 7.64 -1.26 -5.01 113.62 112.72 2rpp n SER 69 Ca -0.04 0.17 -0.43 0.00 1.01 0.00 0.00 58.87 59.57 2rpp n SER 69 Cb 0.53 -0.39 -0.07 0.00 -1.01 0.00 0.00 64.21 63.26 2rpp n SER 69 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2rpp n ARG 70 N -3.65 0.00 0.00 1.43 1.74 -1.26 -4.84 116.66 110.07 2rpp n ARG 70 Ca -0.13 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.95 2rpp n ARG 70 Cb 0.43 -0.99 0.00 0.00 -1.02 0.00 0.00 32.46 30.88 2rpp n ARG 70 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2rpp n GLU 71 N 3.49 0.00 -0.55 5.56 1.02 -1.26 -2.78 120.64 126.12 2rpp n GLU 71 Ca 0.26 0.47 -0.10 0.00 -0.02 0.00 0.00 57.16 57.77 2rpp n GLU 71 Cb -0.03 -1.38 0.05 0.00 -0.02 0.00 0.00 31.44 30.06 2rpp n GLU 71 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2rpp n ASN 72 N -1.79 4.19 -3.09 1.62 3.02 -1.26 -4.95 115.26 112.99 2rpp n ASN 72 Ca 0.00 -2.67 -0.44 0.00 -0.03 0.00 0.00 54.58 51.44 2rpp n ASN 72 Cb 0.00 -0.76 -0.08 0.00 -0.61 0.00 0.00 39.78 38.32 2rpp n ASN 72 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2rpp n LYS 74 N 4.85 1.61 -4.43 0.00 2.85 -1.26 -4.50 118.16 117.28 2rpp n LYS 74 Ca 0.36 -1.34 -0.22 0.00 -1.05 0.00 0.00 58.31 56.06 2rpp n LYS 74 Cb -0.03 -1.53 -0.16 0.00 -0.65 0.00 0.00 35.03 32.66 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 -1.51 1.08 0.53 5.58 2.02 -1.26 -3.16 117.35 120.63 2rpp s TYR 75 Ca 0.26 -0.31 -0.19 0.00 -0.37 0.00 0.00 57.07 56.46 2rpp s TYR 75 Cb 0.21 -0.79 -0.06 0.00 -0.40 0.00 0.00 41.96 40.91 2rpp s TYR 75 CO 0.03 -0.16 1.06 -1.17 -1.57 0.00 0.00 175.55 173.74 2rpp s LEU 76 N 0.40 3.72 -0.53 -1.29 2.96 -1.14 -4.49 118.68 118.32 2rpp s LEU 76 Ca -0.07 1.94 -0.08 0.00 -0.22 0.00 0.00 54.13 55.70 2rpp s LEU 76 Cb -0.11 -4.56 0.14 0.00 0.50 0.00 0.00 46.19 42.16 2rpp s LEU 76 CO 0.01 -0.98 0.39 -1.00 -1.32 0.00 0.00 176.35 173.45 2rpp s HIS 77 N -2.09 3.48 0.49 5.38 3.76 -1.26 -0.85 115.29 124.19 2rpp s HIS 77 Ca 0.67 -2.09 -0.22 0.00 -0.15 0.00 0.00 55.06 53.27 2rpp s HIS 77 Cb -0.18 -3.45 -0.07 0.00 1.11 0.00 0.00 32.58 29.99 2rpp s HIS 77 CO 0.26 -0.97 1.15 -1.25 -0.85 0.00 0.00 174.74 173.09 2rpp s PRO 78 N 0.97 3.61 1.06 8.40 0.04 -1.26 -5.02 135.00 142.80 2rpp s PRO 78 Ca 0.09 1.71 -0.14 0.00 0.04 0.00 0.00 61.00 62.70 2rpp s PRO 78 Cb -0.23 -2.26 0.22 0.00 0.04 0.00 0.00 34.50 32.27 2rpp s PRO 78 CO -0.02 -0.66 1.10 -1.25 0.04 0.00 0.00 177.00 176.20 2rpp s PRO 79 N -2.92 -0.09 0.03 0.56 0.04 -1.26 -4.67 135.00 126.70 2rpp s PRO 79 Ca 0.67 0.34 -0.18 0.00 0.04 0.00 0.00 61.00 61.86 2rpp s PRO 79 Cb -0.27 -1.69 -0.10 0.00 0.04 0.00 0.00 34.50 32.48 2rpp s PRO 79 CO 0.32 -3.04 1.28 1.15 0.04 0.00 0.00 177.00 176.75 2rpp h THR 80 N -2.11 0.00 -1.94 1.26 2.02 -1.96 0.59 112.91 110.77 2rpp h THR 80 Ca -0.53 0.00 0.56 0.00 0.77 0.00 0.00 66.41 67.22 2rpp h THR 80 Cb 1.32 0.00 -0.08 0.00 -1.74 0.00 0.00 68.15 67.66 2rpp h THR 80 CO 0.52 0.00 1.40 1.12 0.37 0.00 0.00 175.52 178.93 2rpp h HIS 81 N -0.61 0.00 0.08 3.16 2.07 -1.97 1.51 115.15 119.38 2rpp h HIS 81 Ca -0.05 0.00 -0.33 0.00 -2.85 0.00 0.00 60.37 57.14 2rpp h HIS 81 Cb 0.48 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 30.44 2rpp h HIS 81 CO 0.01 0.00 -1.81 -0.07 -3.07 0.00 0.00 177.93 172.99 2rpp h LEU 82 N 0.00 0.25 -1.83 6.12 3.38 -1.77 -3.35 115.31 118.12 2rpp h LEU 82 Ca 0.92 -0.53 0.31 0.00 0.09 0.00 0.00 57.88 58.67 2rpp h LEU 82 Cb 3.71 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 44.33 2rpp h LEU 82 CO -0.01 1.47 0.88 0.11 0.09 0.00 0.00 178.44 180.98 2rpp h LYS 83 N 0.04 0.00 0.60 1.13 1.57 0.78 -0.26 116.57 120.43 2rpp h LYS 83 Ca -0.34 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.41 2rpp h LYS 83 Cb 2.02 0.00 0.01 0.00 0.08 0.00 0.00 32.23 34.34 2rpp h LYS 83 CO 0.10 0.00 -0.29 1.15 -0.57 0.00 0.00 179.45 179.84 2rpp h THR 84 N 0.00 0.34 -0.99 -0.16 2.02 -1.64 -2.94 112.91 109.53 2rpp h THR 84 Ca 0.50 -0.22 0.40 0.00 0.77 0.00 0.00 66.41 67.86 2rpp h THR 84 Cb 2.26 0.42 -0.18 0.00 -1.74 0.00 0.00 68.15 68.90 2rpp h THR 84 CO -0.01 0.03 0.49 0.00 0.37 0.00 0.00 175.52 176.40 2rpp n GLN 85 N -5.38 -0.06 0.30 6.66 3.00 -0.11 0.08 117.38 121.88 2rpp n GLN 85 Ca -0.12 1.38 -0.17 0.00 -0.01 0.00 0.00 57.00 58.08 2rpp n GLN 85 Cb 0.35 -2.45 -0.08 0.00 0.00 0.00 0.00 30.24 28.05 2rpp n GLN 85 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.06 176.99 2rpp h LEU 86 N 0.00 -0.76 -1.84 1.08 3.38 -1.55 -0.24 115.31 115.38 2rpp h LEU 86 Ca 0.82 0.04 -0.03 0.00 0.09 0.00 0.00 57.88 58.81 2rpp h LEU 86 Cb 2.14 0.22 -0.00 0.00 0.09 0.00 0.00 40.66 43.11 2rpp h LEU 86 CO -0.78 -0.49 -0.12 1.05 0.09 0.00 0.00 178.44 178.19 2rpp h GLU 87 N -0.79 0.00 -0.24 1.13 4.11 -0.32 -2.64 114.58 115.83 2rpp h GLU 87 Ca -0.07 0.00 -0.20 0.00 0.07 0.00 0.00 59.36 59.16 2rpp h GLU 87 Cb 0.64 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.89 2rpp h GLU 87 CO 0.08 0.12 -0.64 0.82 0.07 0.00 0.00 179.01 179.46 2rpp h ILE 88 N 0.00 1.27 -0.12 -1.06 2.04 -0.04 -3.40 117.51 116.20 2rpp h ILE 88 Ca -0.00 -1.82 -0.76 0.00 1.00 0.00 0.00 64.86 63.28 2rpp h ILE 88 Cb 0.38 1.76 -0.03 0.00 -0.74 0.00 0.00 36.82 38.19 2rpp h ILE 88 CO 0.02 0.59 1.20 -3.20 0.00 0.00 0.00 178.15 176.76 2rpp n ASN 89 N -3.98 0.78 -4.66 1.72 5.15 -0.15 -4.72 115.26 109.40 2rpp n ASN 89 Ca -0.06 0.72 -0.46 0.00 -0.60 0.00 0.00 54.58 54.19 2rpp n ASN 89 Cb 0.68 -0.87 -0.04 0.00 -0.53 0.00 0.00 39.78 39.02 2rpp n ASN 89 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 2rpp n SER 90 N 6.83 2.89 0.00 1.20 7.64 -1.26 -4.44 113.62 126.49 2rpp n SER 90 Ca 0.50 1.10 0.00 0.00 1.01 0.00 0.00 58.87 61.49 2rpp n SER 90 Cb -0.04 -1.41 0.00 0.00 -1.01 0.00 0.00 64.21 61.75 2rpp n SER 90 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2rpp n GLY 91 N 2.96 -0.63 0.27 0.23 0.00 -1.26 -4.91 105.19 101.85 2rpp n GLY 91 Ca 0.15 0.24 0.16 0.00 0.00 0.00 0.00 46.02 46.57 2rpp n GLY 91 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2rpp h PRO 92 N 0.00 0.00 -1.47 1.61 0.13 -1.96 -3.44 132.00 126.88 2rpp h PRO 92 Ca 0.00 0.00 0.13 0.00 -0.87 0.00 0.00 66.00 65.26 2rpp h PRO 92 Cb 0.00 0.00 -0.28 0.00 0.13 0.00 0.00 31.00 30.85 2rpp h PRO 92 CO 0.00 0.05 0.44 0.45 -0.23 0.00 0.00 178.00 178.71 2rpp s SER 93 N -5.80 -0.44 -0.31 1.44 0.15 -1.26 -5.06 113.70 102.42 2rpp s SER 93 Ca 0.01 0.71 0.10 0.00 0.70 0.00 0.00 55.95 57.46 2rpp s SER 93 Cb 0.10 1.18 0.46 0.00 -1.71 0.00 0.00 66.02 66.04 2rpp s SER 93 CO 0.56 -0.11 1.15 -1.54 1.20 0.00 0.00 173.24 174.50 2rpp n SER 94 N 3.60 4.23 0.00 5.45 3.41 -1.26 -4.53 113.62 124.51 2rpp n SER 94 Ca -0.18 -3.43 0.00 0.00 -0.26 0.00 0.00 58.87 55.00 2rpp n SER 94 Cb 0.57 -0.39 0.00 0.00 -0.26 0.00 0.00 64.21 64.13 2rpp n SER 94 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49