#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 1.38 -4.55 1.61 7.64 -1.26 -4.83 113.62 113.61 2rpp n SER 8 Ca 0.00 1.13 -0.40 0.00 1.01 0.00 0.00 58.87 60.61 2rpp n SER 8 Cb 0.00 -1.17 -0.03 0.00 -1.01 0.00 0.00 64.21 62.00 2rpp n SER 8 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2rpp s SER 9 N 0.28 5.92 0.00 6.43 0.15 -1.26 -4.89 113.70 120.33 2rpp s SER 9 Ca 0.81 -0.38 0.00 0.00 0.70 0.00 0.00 55.95 57.09 2rpp s SER 9 Cb -0.95 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 60.81 2rpp s SER 9 CO 0.49 -1.99 0.00 0.61 1.20 0.00 0.00 173.24 173.56 2rpp n GLY 10 N 5.71 0.32 0.38 9.45 0.00 -1.26 -4.95 105.19 114.83 2rpp n GLY 10 Ca 0.13 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.00 2rpp n GLY 10 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2rpp h SER 11 N 0.00 -0.78 -3.57 1.61 0.02 -2.03 -3.44 113.55 105.36 2rpp h SER 11 Ca 0.00 0.02 -0.52 0.00 -0.84 0.00 0.00 61.79 60.46 2rpp h SER 11 Cb 0.00 0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.71 2rpp h SER 11 CO 0.00 -0.39 0.07 -0.55 -1.14 0.00 0.00 176.83 174.82 2rpp s SER 12 N -4.50 6.95 -0.08 3.07 0.15 -1.26 -5.08 113.70 112.94 2rpp s SER 12 Ca -0.14 1.32 -0.07 0.00 0.70 0.00 0.00 55.95 57.77 2rpp s SER 12 Cb 0.01 -2.38 0.03 0.00 -1.71 0.00 0.00 66.02 61.96 2rpp s SER 12 CO 0.41 -0.02 0.21 -0.83 1.20 0.00 0.00 173.24 174.21 2rpp s GLY 13 N -1.82 -0.15 0.00 9.45 0.00 -1.26 -4.82 107.32 108.73 2rpp s GLY 13 Ca 0.45 0.65 0.11 0.00 0.00 0.00 0.00 44.72 45.93 2rpp s GLY 13 CO 0.20 0.64 1.09 -1.55 0.00 0.00 0.00 173.10 173.48 2rpp n PRO 14 N 3.23 0.49 -1.06 2.90 -0.04 -1.26 -4.89 135.00 134.37 2rpp n PRO 14 Ca -0.15 0.00 -0.35 0.00 -0.04 0.00 0.00 63.50 62.95 2rpp n PRO 14 Cb 0.57 -1.35 -0.01 0.00 -0.04 0.00 0.00 33.50 32.67 2rpp n PRO 14 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 2rpp n VAL 15 N -0.85 0.96 -1.17 0.52 3.14 -1.26 -4.67 118.33 115.00 2rpp n VAL 15 Ca 0.08 -0.40 -0.40 0.00 -2.96 0.00 0.00 64.34 60.67 2rpp n VAL 15 Cb 0.04 0.00 -0.02 0.00 -1.06 0.00 0.00 33.84 32.80 2rpp n VAL 15 CO 0.00 0.00 0.00 -1.14 -6.46 0.00 0.00 176.83 169.23 2rpp n ARG 16 N 0.95 0.00 -1.36 1.45 0.63 -1.26 -4.87 116.66 112.20 2rpp n ARG 16 Ca 0.11 0.00 -0.32 0.00 -0.92 0.00 0.00 57.85 56.72 2rpp n ARG 16 Cb 0.27 -0.86 0.09 0.00 0.45 0.00 0.00 32.46 32.41 2rpp n ARG 16 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 2rpp s ASP 17 N -0.86 4.48 -0.40 6.15 1.11 -1.26 -4.98 116.67 120.92 2rpp s ASP 17 Ca 0.54 1.96 0.05 0.00 0.18 0.00 0.00 52.55 55.28 2rpp s ASP 17 Cb -0.72 -2.54 0.44 0.00 1.07 0.00 0.00 42.92 41.17 2rpp s ASP 17 CO 0.50 -2.05 1.28 0.35 1.18 0.00 0.00 175.17 176.43 2rpp n THR 18 N -3.21 2.63 -0.03 -1.27 -2.24 -1.26 -4.78 114.28 104.12 2rpp n THR 18 Ca 0.10 -4.33 -0.13 0.00 -2.27 0.00 0.00 64.05 57.42 2rpp n THR 18 Cb 0.52 -1.19 -0.09 0.00 -2.10 0.00 0.00 70.33 67.47 2rpp n THR 18 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 2rpp h LYS 19 N 2.33 0.14 0.00 -0.78 3.11 -1.99 -3.07 116.57 116.32 2rpp h LYS 19 Ca 0.38 -0.09 0.00 0.00 -2.81 0.00 0.00 60.65 58.13 2rpp h LYS 19 Cb 1.21 0.01 0.00 0.00 -1.00 0.00 0.00 32.23 32.45 2rpp h LYS 19 CO 0.89 0.65 0.00 -2.67 -2.81 0.00 0.00 179.45 175.52 2rpp n TRP 20 N -4.70 0.05 -1.33 1.91 4.27 -1.26 -3.18 117.44 113.20 2rpp n TRP 20 Ca -0.08 0.02 -0.30 0.00 -3.89 0.00 0.00 57.50 53.25 2rpp n TRP 20 Cb 0.33 -0.53 0.11 0.00 -1.36 0.00 0.00 31.31 29.87 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 -1.54 7.14 -4.20 5.67 4.77 -1.16 -4.89 117.00 122.79 2rpp n LEU 21 Ca 0.06 -4.07 -0.27 0.00 -0.03 0.00 0.00 56.01 51.69 2rpp n LEU 21 Cb 0.28 -0.89 -0.16 0.00 -2.33 0.00 0.00 43.42 40.32 2rpp n LEU 21 CO 0.22 1.36 -0.52 -0.89 -1.33 0.00 0.00 177.39 176.22 2rpp s THR 22 N -4.27 1.63 0.33 -5.08 2.01 -1.19 -0.42 115.64 108.65 2rpp s THR 22 Ca 0.61 -0.86 0.10 0.00 0.31 0.00 0.00 61.69 61.85 2rpp s THR 22 Cb 0.49 -1.37 -0.06 0.00 0.01 0.00 0.00 72.50 71.58 2rpp s THR 22 CO 0.03 0.46 -0.10 -0.76 -0.69 0.00 0.00 174.62 173.57 2rpp s LEU 23 N -0.28 2.76 0.22 4.42 1.43 -0.12 -4.95 118.68 122.16 2rpp s LEU 23 Ca 0.03 -1.11 -0.24 0.00 -1.03 0.00 0.00 54.13 51.77 2rpp s LEU 23 Cb -0.10 -1.10 -0.09 0.00 0.03 0.00 0.00 46.19 44.94 2rpp s LEU 23 CO 0.01 -0.15 0.81 -1.61 0.23 0.00 0.00 176.35 175.63 2rpp s GLU 24 N -3.61 4.50 0.19 1.70 2.02 -1.26 -1.61 118.70 120.64 2rpp s GLU 24 Ca 0.32 1.13 -0.20 0.00 0.02 0.00 0.00 54.97 56.25 2rpp s GLU 24 Cb 0.00 -3.06 -0.08 0.00 0.10 0.00 0.00 34.13 31.09 2rpp s GLU 24 CO 0.17 0.46 0.70 0.08 0.02 0.00 0.00 175.26 176.69 2rpp s VAL 25 N -1.35 4.57 -0.47 2.63 1.01 -1.25 -3.18 120.40 122.36 2rpp s VAL 25 Ca 0.41 1.31 -0.28 0.00 0.00 0.00 0.00 61.98 63.43 2rpp s VAL 25 Cb -0.21 -3.90 -0.01 0.00 0.00 0.00 0.00 36.38 32.26 2rpp s VAL 25 CO 0.25 0.30 1.76 0.00 0.00 0.00 0.00 175.10 177.41 2rpp n ARG 27 N 8.71 -0.24 -0.06 0.00 3.00 -1.26 -0.80 116.66 126.02 2rpp n ARG 27 Ca 0.21 1.07 -0.13 0.00 -0.00 0.00 0.00 57.85 59.00 2rpp n ARG 27 Cb 0.49 -1.58 -0.09 0.00 0.00 0.00 0.00 32.46 31.28 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 -0.44 -0.79 -0.14 4.20 -1.91 -1.05 115.11 114.98 2rpp h GLN 28 Ca 0.09 0.03 0.18 0.00 0.06 0.00 0.00 58.65 59.01 2rpp h GLN 28 Cb 0.22 0.10 -0.15 0.00 0.30 0.00 0.00 27.48 27.95 2rpp h GLN 28 CO -0.51 -0.29 -0.12 0.34 -0.67 0.00 0.00 178.83 177.58 2rpp n PHE 29 N -5.13 0.37 0.13 2.96 7.35 0.02 0.33 117.46 123.50 2rpp n PHE 29 Ca -0.05 0.96 -0.17 0.00 -0.76 0.00 0.00 57.45 57.44 2rpp n PHE 29 Cb 0.33 -1.01 -0.10 0.00 0.35 0.00 0.00 39.48 39.05 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 -0.76 0.00 -4.13 4.20 -0.54 -0.95 115.11 112.93 2rpp h GLN 30 Ca 0.42 0.05 -0.03 0.00 0.06 0.00 0.00 58.65 59.15 2rpp h GLN 30 Cb 0.74 0.17 -0.00 0.00 0.30 0.00 0.00 27.48 28.68 2rpp h GLN 30 CO -0.79 -0.50 -0.13 0.00 -0.67 0.00 0.00 178.83 176.74 2rpp h ARG 31 N -0.78 0.00 -0.01 1.46 3.08 -0.24 -3.46 114.38 114.42 2rpp h ARG 31 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.04 2rpp h ARG 31 Cb 0.78 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.83 2rpp h ARG 31 CO -0.26 0.13 0.00 0.41 -1.07 0.00 0.00 179.97 179.18 2rpp n GLY 32 N -0.61 1.66 1.12 0.04 0.00 0.15 -5.00 105.19 102.54 2rpp n GLY 32 Ca -0.02 -0.16 -0.03 0.00 0.00 0.00 0.00 46.02 45.81 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 -1.49 2.53 -5.05 2.61 -2.24 -0.99 -4.96 114.28 104.68 2rpp n THR 33 Ca 0.00 -2.77 -0.32 0.00 -2.27 0.00 0.00 64.05 58.69 2rpp n THR 33 Cb 0.09 -0.31 -0.17 0.00 -2.10 0.00 0.00 70.33 67.84 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 3.69 1.75 -4.62 0.00 2.88 -1.26 -4.88 113.62 111.19 2rpp n SER 35 Ca -0.19 -3.47 -0.34 0.00 -1.33 0.00 0.00 58.87 53.53 2rpp n SER 35 Cb 0.53 -0.47 -0.10 0.00 -0.75 0.00 0.00 64.21 63.41 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 -2.76 2.78 0.65 -1.46 0.52 -1.26 -5.08 118.95 112.33 2rpp s ARG 36 Ca 0.35 -0.55 -0.10 0.00 -0.52 0.00 0.00 55.73 54.91 2rpp s ARG 36 Cb 0.34 -2.63 -0.01 0.00 0.52 0.00 0.00 34.95 33.16 2rpp s ARG 36 CO -0.05 0.66 1.04 0.45 0.02 0.00 0.00 175.30 177.42 2rpp s SER 37 N -0.99 5.82 0.58 0.23 0.15 -1.26 -4.56 113.70 113.67 2rpp s SER 37 Ca 0.14 1.20 0.28 0.00 0.70 0.00 0.00 55.95 58.28 2rpp s SER 37 Cb -0.11 -2.14 1.54 0.00 -1.71 0.00 0.00 66.02 63.59 2rpp s SER 37 CO 0.03 -1.09 1.98 0.44 1.20 0.00 0.00 173.24 175.81 2rpp h ASP 38 N -0.43 0.00 1.79 5.45 5.19 -1.88 0.70 116.42 127.23 2rpp h ASP 38 Ca -0.45 0.00 -0.03 0.00 -0.62 0.00 0.00 57.03 55.93 2rpp h ASP 38 Cb 1.23 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.73 2rpp h ASP 38 CO 0.63 0.00 -0.21 -0.08 -3.12 0.00 0.00 179.24 176.45 2rpp h GLU 39 N 0.00 0.00 0.00 3.56 4.57 -1.94 -3.38 114.58 117.39 2rpp h GLU 39 Ca 0.17 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.34 2rpp h GLU 39 Cb 0.91 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.50 2rpp h GLU 39 CO -0.00 0.14 -1.02 -1.91 -1.18 0.00 0.00 179.01 175.04 2rpp n GLU 40 N -3.11 0.53 -1.96 1.92 4.07 0.18 -4.96 120.64 117.31 2rpp n GLU 40 Ca 0.03 0.22 -0.42 0.00 -0.06 0.00 0.00 57.16 56.93 2rpp n GLU 40 Cb 0.59 -1.43 -0.02 0.00 -0.06 0.00 0.00 31.44 30.51 2rpp n GLU 40 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2rpp n LYS 42 N 2.81 1.28 -4.23 0.00 2.85 -1.26 -4.68 118.16 114.91 2rpp n LYS 42 Ca 0.09 -0.61 -0.13 0.00 -1.05 0.00 0.00 58.31 56.60 2rpp n LYS 42 Cb 0.39 -1.24 -0.10 0.00 -0.65 0.00 0.00 35.03 33.43 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 -0.69 1.23 -0.23 5.58 0.08 -1.26 -5.08 117.98 117.62 2rpp s PHE 43 Ca 0.12 -1.23 -0.10 0.00 0.12 0.00 0.00 56.93 55.83 2rpp s PHE 43 Cb 0.10 -0.67 -0.05 0.00 -0.57 0.00 0.00 43.02 41.82 2rpp s PHE 43 CO 0.01 -0.45 0.15 0.00 -0.10 0.00 0.00 175.22 174.84 2rpp s ALA 44 N -3.93 3.64 -0.59 5.36 0.00 -1.19 -4.84 121.76 120.20 2rpp s ALA 44 Ca 0.33 -0.82 -0.04 0.00 0.00 0.00 0.00 51.96 51.44 2rpp s ALA 44 Cb 0.07 -2.27 0.15 0.00 0.00 0.00 0.00 23.12 21.07 2rpp s ALA 44 CO 0.09 -0.07 0.42 -1.01 0.00 0.00 0.00 175.76 175.19 2rpp s HIS 45 N 0.82 3.46 0.10 0.00 0.09 -1.26 -2.72 115.29 115.77 2rpp s HIS 45 Ca 0.08 -2.58 -0.31 0.00 -0.00 0.00 0.00 55.06 52.25 2rpp s HIS 45 Cb -0.13 -3.26 -0.07 0.00 -0.00 0.00 0.00 32.58 29.12 2rpp s HIS 45 CO 0.02 -0.88 1.37 -1.25 -0.00 0.00 0.00 174.74 174.00 2rpp s PRO 46 N 0.23 4.33 1.09 8.40 0.04 -1.26 -5.00 135.00 142.82 2rpp s PRO 46 Ca 0.15 2.03 -0.15 0.00 0.04 0.00 0.00 61.00 63.07 2rpp s PRO 46 Cb -0.20 -3.30 0.23 0.00 0.04 0.00 0.00 34.50 31.27 2rpp s PRO 46 CO -0.04 -0.43 1.10 -1.25 0.04 0.00 0.00 177.00 176.42 2rpp s PRO 47 N 1.24 -0.27 0.14 0.56 0.04 -1.26 -4.92 135.00 130.53 2rpp s PRO 47 Ca 0.64 0.28 -0.16 0.00 0.04 0.00 0.00 61.00 61.79 2rpp s PRO 47 Cb -0.35 -1.68 -0.00 0.00 0.04 0.00 0.00 34.50 32.51 2rpp s PRO 47 CO 0.30 -3.15 1.74 -0.22 0.04 0.00 0.00 177.00 175.71 2rpp h LYS 48 N -2.19 0.55 -0.99 4.56 3.64 -2.02 -2.70 116.57 117.42 2rpp h LYS 48 Ca -0.51 -0.07 0.03 0.00 -1.27 0.00 0.00 60.65 58.83 2rpp h LYS 48 Cb 1.32 -0.11 -0.06 0.00 -0.41 0.00 0.00 32.23 32.98 2rpp h LYS 48 CO 0.49 0.45 0.65 0.66 -2.27 0.00 0.00 179.45 179.43 2rpp h SER 49 N 0.50 1.09 -3.15 4.20 4.64 -1.95 -3.41 113.55 115.47 2rpp h SER 49 Ca 0.14 -0.01 -0.54 0.00 -0.47 0.00 0.00 61.79 60.91 2rpp h SER 49 Cb 0.06 -0.25 -0.00 0.00 -0.31 0.00 0.00 62.40 61.90 2rpp h SER 49 CO -0.02 0.75 0.61 0.00 -0.87 0.00 0.00 176.83 177.29 2rpp s GLN 51 N 1.35 4.30 -0.18 0.00 -0.44 -1.22 -4.59 119.66 118.87 2rpp s GLN 51 Ca 0.59 2.10 -0.09 0.00 -2.50 0.00 0.00 55.36 55.45 2rpp s GLN 51 Cb -0.29 -3.33 -0.05 0.00 -1.64 0.00 0.00 33.01 27.71 2rpp s GLN 51 CO 0.28 -0.50 0.13 0.08 0.50 0.00 0.00 175.29 175.78 2rpp s VAL 52 N 1.45 5.39 0.58 1.34 1.01 -1.26 -4.55 120.40 124.36 2rpp s VAL 52 Ca 0.66 0.18 -0.02 0.00 0.00 0.00 0.00 61.98 62.80 2rpp s VAL 52 Cb -0.37 -3.43 0.03 0.00 0.00 0.00 0.00 36.38 32.61 2rpp s VAL 52 CO 0.30 0.48 0.84 -1.61 0.00 0.00 0.00 175.10 175.11 2rpp s GLU 53 N 0.05 2.58 -0.42 2.72 2.02 0.44 -4.96 118.70 121.13 2rpp s GLU 53 Ca 0.09 -0.49 -0.31 0.00 0.02 0.00 0.00 54.97 54.28 2rpp s GLU 53 Cb -0.11 -2.38 -0.10 0.00 0.10 0.00 0.00 34.13 31.63 2rpp s GLU 53 CO -0.01 -0.79 2.30 0.09 0.02 0.00 0.00 175.26 176.88 2rpp n ASN 54 N -2.49 2.23 -1.06 -0.19 4.13 -1.26 -1.17 115.26 115.44 2rpp n ASN 54 Ca 0.06 0.13 -0.11 0.00 1.68 0.00 0.00 54.58 56.35 2rpp n ASN 54 Cb 0.59 -1.37 -0.05 0.00 -1.54 0.00 0.00 39.78 37.42 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 6.26 1.03 3.71 7.41 0.00 -1.26 -4.86 105.19 117.48 2rpp n GLY 55 Ca 0.40 0.00 -0.08 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 -2.76 1.69 -0.13 1.61 3.52 -0.32 -3.88 118.95 118.69 2rpp s ARG 56 Ca 0.00 -1.17 -0.11 0.00 -0.13 0.00 0.00 55.73 54.32 2rpp s ARG 56 Cb 0.00 0.53 0.04 0.00 -1.56 0.00 0.00 34.95 33.96 2rpp s ARG 56 CO 0.00 -0.74 0.34 0.54 -0.81 0.00 0.00 175.30 174.63 2rpp s VAL 57 N -3.86 -0.01 0.11 7.11 0.11 -0.63 0.17 120.40 123.39 2rpp s VAL 57 Ca 0.18 0.02 -0.26 0.00 -2.93 0.00 0.00 61.98 59.00 2rpp s VAL 57 Cb -0.03 -0.49 -0.07 0.00 -1.53 0.00 0.00 36.38 34.27 2rpp s VAL 57 CO 0.09 0.01 0.79 -0.63 -3.33 0.00 0.00 175.10 172.02 2rpp s ILE 58 N 0.41 4.55 0.35 7.04 1.01 -1.26 -0.95 121.20 132.36 2rpp s ILE 58 Ca -0.02 1.70 -0.06 0.00 0.00 0.00 0.00 60.65 62.27 2rpp s ILE 58 Cb -0.04 -4.14 -0.05 0.00 0.01 0.00 0.00 42.46 38.24 2rpp s ILE 58 CO -0.02 0.43 0.65 0.00 0.00 0.00 0.00 174.94 176.01 2rpp s ALA 59 N -0.55 3.51 0.30 9.38 0.00 0.45 -2.68 121.76 132.18 2rpp s ALA 59 Ca 0.38 -0.47 -0.22 0.00 0.00 0.00 0.00 51.96 51.66 2rpp s ALA 59 Cb -0.22 -2.45 -0.09 0.00 0.00 0.00 0.00 23.12 20.36 2rpp s ALA 59 CO 0.25 0.07 0.84 0.00 0.00 0.00 0.00 175.76 176.92 2rpp h PHE 61 N 2.97 -0.36 -0.10 0.00 3.04 -1.97 -3.30 116.94 117.22 2rpp h PHE 61 Ca -0.48 -0.01 0.04 0.00 3.98 0.00 0.00 57.97 61.51 2rpp h PHE 61 Cb 1.19 0.12 -0.05 0.00 2.56 0.00 0.00 35.95 39.77 2rpp h PHE 61 CO 0.62 -0.11 -0.21 -0.44 -2.02 0.00 0.00 178.31 176.15 2rpp h ASP 62 N -1.05 -0.63 -1.50 0.41 3.32 -1.95 -1.16 116.42 113.86 2rpp h ASP 62 Ca -0.04 0.10 0.49 0.00 0.02 0.00 0.00 57.03 57.61 2rpp h ASP 62 Cb 0.41 0.28 -0.12 0.00 0.22 0.00 0.00 39.33 40.12 2rpp h ASP 62 CO 0.07 -0.26 1.00 -1.54 -1.72 0.00 0.00 179.24 176.78 2rpp n SER 63 N -5.34 0.16 -0.21 6.45 3.41 -1.26 0.10 113.62 116.93 2rpp n SER 63 Ca -0.03 1.27 0.02 0.00 -0.26 0.00 0.00 58.87 59.86 2rpp n SER 63 Cb 0.26 -0.62 0.13 0.00 -0.26 0.00 0.00 64.21 63.71 2rpp n SER 63 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2rpp h LEU 64 N 0.00 0.11 -1.26 1.04 3.38 -1.28 0.87 115.31 118.17 2rpp h LEU 64 Ca 0.88 0.11 -0.08 0.00 0.09 0.00 0.00 57.88 58.88 2rpp h LEU 64 Cb 3.02 0.12 -0.01 0.00 0.09 0.00 0.00 40.66 43.87 2rpp h LEU 64 CO -0.35 0.05 -0.37 0.11 0.09 0.00 0.00 178.44 177.98 2rpp h LYS 65 N 0.33 0.00 0.00 1.13 1.79 0.56 -3.47 116.57 116.91 2rpp h LYS 65 Ca 0.34 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.81 2rpp h LYS 65 Cb 0.49 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.14 2rpp h LYS 65 CO -0.39 0.37 0.00 0.41 -1.08 0.00 0.00 179.45 178.76 2rpp n GLY 66 N -0.47 1.26 2.80 3.86 0.00 0.30 -5.06 105.19 107.87 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 -0.31 0.95 0.17 1.61 1.81 -1.26 -4.97 118.95 116.95 2rpp s ARG 67 Ca 0.00 -0.87 0.03 0.00 -1.72 0.00 0.00 55.73 53.17 2rpp s ARG 67 Cb 0.00 -2.23 -0.03 0.00 -0.45 0.00 0.00 34.95 32.23 2rpp s ARG 67 CO 0.00 -0.77 0.30 0.00 -0.68 0.00 0.00 175.30 174.15 2rpp n SER 69 N -0.75 1.47 -3.60 0.00 3.41 -1.26 -5.00 113.62 107.90 2rpp n SER 69 Ca -0.07 0.24 -0.50 0.00 -0.26 0.00 0.00 58.87 58.27 2rpp n SER 69 Cb 0.55 -0.56 -0.07 0.00 -0.26 0.00 0.00 64.21 63.86 2rpp n SER 69 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2rpp n ARG 70 N -3.98 0.00 0.00 4.33 5.12 -1.26 -4.87 116.66 116.00 2rpp n ARG 70 Ca -0.19 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.73 2rpp n ARG 70 Cb 0.49 -1.15 0.00 0.00 -1.16 0.00 0.00 32.46 30.64 2rpp n ARG 70 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 177.63 176.09 2rpp n GLU 71 N 2.54 0.00 -0.85 5.56 1.02 -1.26 -3.46 120.64 124.19 2rpp n GLU 71 Ca 0.21 0.28 -0.16 0.00 -0.02 0.00 0.00 57.16 57.48 2rpp n GLU 71 Cb -0.02 -1.23 0.04 0.00 -0.02 0.00 0.00 31.44 30.21 2rpp n GLU 71 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2rpp n ASN 72 N -1.34 6.12 -3.53 1.62 5.15 -1.26 -4.97 115.26 117.05 2rpp n ASN 72 Ca 0.00 -3.01 -0.50 0.00 -0.60 0.00 0.00 54.58 50.46 2rpp n ASN 72 Cb 0.00 -1.02 -0.08 0.00 -0.53 0.00 0.00 39.78 38.15 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 3.83 1.32 -4.09 0.00 2.85 -1.26 -4.53 118.16 116.28 2rpp n LYS 74 Ca 0.29 -0.66 -0.15 0.00 -1.05 0.00 0.00 58.31 56.74 2rpp n LYS 74 Cb -0.04 -1.26 -0.14 0.00 -0.65 0.00 0.00 35.03 32.94 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 -0.75 0.38 0.37 5.58 1.51 -1.26 -3.41 117.35 119.77 2rpp s TYR 75 Ca 0.13 -0.10 -0.25 0.00 -1.01 0.00 0.00 57.07 55.84 2rpp s TYR 75 Cb 0.10 -0.24 -0.09 0.00 -0.11 0.00 0.00 41.96 41.62 2rpp s TYR 75 CO 0.01 -0.01 1.01 -1.17 -1.11 0.00 0.00 175.55 174.28 2rpp s LEU 76 N -0.21 4.21 -0.54 -1.29 2.96 -1.09 -4.61 118.68 118.10 2rpp s LEU 76 Ca 0.01 1.97 -0.10 0.00 -0.22 0.00 0.00 54.13 55.78 2rpp s LEU 76 Cb -0.02 -4.12 0.14 0.00 0.50 0.00 0.00 46.19 42.68 2rpp s LEU 76 CO -0.00 -0.33 0.43 -1.00 -1.32 0.00 0.00 176.35 174.13 2rpp s HIS 77 N -1.65 3.44 0.47 5.38 3.76 -1.26 -0.70 115.29 124.72 2rpp s HIS 77 Ca 0.55 -1.87 -0.23 0.00 -0.15 0.00 0.00 55.06 53.36 2rpp s HIS 77 Cb -0.21 -3.56 -0.07 0.00 1.11 0.00 0.00 32.58 29.85 2rpp s HIS 77 CO 0.26 -0.98 1.16 -1.25 -0.85 0.00 0.00 174.74 173.08 2rpp s PRO 78 N 1.11 3.71 1.08 8.40 0.04 -1.26 -5.03 135.00 143.05 2rpp s PRO 78 Ca 0.08 1.76 -0.15 0.00 0.04 0.00 0.00 61.00 62.73 2rpp s PRO 78 Cb -0.24 -2.36 0.23 0.00 0.04 0.00 0.00 34.50 32.16 2rpp s PRO 78 CO -0.01 -0.59 1.10 -1.25 0.04 0.00 0.00 177.00 176.29 2rpp s PRO 79 N -2.76 -0.22 0.01 0.56 0.04 -1.26 -4.71 135.00 126.66 2rpp s PRO 79 Ca 0.65 0.29 -0.06 0.00 0.04 0.00 0.00 61.00 61.92 2rpp s PRO 79 Cb -0.28 -1.68 -0.03 0.00 0.04 0.00 0.00 34.50 32.55 2rpp s PRO 79 CO 0.34 -3.12 1.09 1.15 0.04 0.00 0.00 177.00 176.49 2rpp h THR 80 N -2.17 0.00 -0.88 1.26 2.02 -1.96 0.28 112.91 111.47 2rpp h THR 80 Ca -0.52 0.00 0.35 0.00 0.77 0.00 0.00 66.41 67.01 2rpp h THR 80 Cb 1.32 0.00 -0.14 0.00 -1.74 0.00 0.00 68.15 67.59 2rpp h THR 80 CO 0.50 0.00 0.50 0.00 0.37 0.00 0.00 175.52 176.89 2rpp n HIS 81 N -2.58 0.86 -0.01 3.16 1.44 -1.26 0.15 115.22 116.99 2rpp n HIS 81 Ca -0.02 0.87 -0.17 0.00 -2.01 0.00 0.00 57.72 56.39 2rpp n HIS 81 Cb 0.08 -1.29 -0.12 0.00 0.12 0.00 0.00 29.99 28.78 2rpp n HIS 81 CO 0.00 0.00 0.00 -0.07 -2.81 0.00 0.00 176.34 173.46 2rpp h LEU 82 N 0.00 0.34 -0.90 2.39 3.38 -1.87 -3.32 115.31 115.33 2rpp h LEU 82 Ca 0.69 -0.82 0.18 0.00 0.09 0.00 0.00 57.88 58.02 2rpp h LEU 82 Cb 1.93 -0.11 -0.17 0.00 0.09 0.00 0.00 40.66 42.40 2rpp h LEU 82 CO -0.57 1.12 -0.23 0.11 0.09 0.00 0.00 178.44 178.97 2rpp h LYS 83 N -0.40 -0.00 -0.80 1.13 1.57 0.51 1.06 116.57 119.64 2rpp h LYS 83 Ca -0.06 0.00 0.15 0.00 -1.87 0.00 0.00 60.65 58.87 2rpp h LYS 83 Cb 1.21 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 33.46 2rpp h LYS 83 CO 0.08 -0.00 0.53 1.15 -0.57 0.00 0.00 179.45 180.65 2rpp h THR 84 N -0.00 0.79 -0.90 -0.16 2.02 -1.54 -0.07 112.91 113.06 2rpp h THR 84 Ca 0.43 -0.17 0.06 0.00 0.77 0.00 0.00 66.41 67.50 2rpp h THR 84 Cb 0.66 0.27 -0.06 0.00 -1.74 0.00 0.00 68.15 67.28 2rpp h THR 84 CO -0.93 0.09 0.59 -0.61 0.37 0.00 0.00 175.52 175.02 2rpp h GLN 85 N 0.48 1.02 -0.98 6.66 4.15 0.11 -1.56 115.11 124.99 2rpp h GLN 85 Ca 0.40 -0.06 0.08 0.00 0.77 0.00 0.00 58.65 59.84 2rpp h GLN 85 Cb 0.85 -0.23 -0.07 0.00 0.21 0.00 0.00 27.48 28.24 2rpp h GLN 85 CO -0.15 0.67 0.63 -0.07 -1.93 0.00 0.00 178.83 177.98 2rpp h LEU 86 N 1.05 0.98 -0.20 -2.39 3.38 -0.89 -2.32 115.31 114.92 2rpp h LEU 86 Ca 0.38 0.02 -0.08 0.00 0.09 0.00 0.00 57.88 58.29 2rpp h LEU 86 Cb 0.15 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 2rpp h LEU 86 CO -0.13 0.60 -0.17 -0.33 0.09 0.00 0.00 178.44 178.50 2rpp h GLU 87 N 1.10 0.46 -0.99 1.13 5.08 -1.34 -3.17 114.58 116.86 2rpp h GLU 87 Ca 0.44 -0.23 0.33 0.00 -1.00 0.00 0.00 59.36 58.90 2rpp h GLU 87 Cb 0.25 0.00 -0.18 0.00 0.50 0.00 0.00 28.75 29.32 2rpp h GLU 87 CO -0.20 0.80 0.28 0.82 -1.00 0.00 0.00 179.01 179.72 2rpp h ILE 88 N 0.14 0.04 -0.85 3.13 2.04 -0.85 0.26 117.51 121.43 2rpp h ILE 88 Ca 0.03 -0.01 0.27 0.00 1.00 0.00 0.00 64.86 66.15 2rpp h ILE 88 Cb 0.70 0.01 -0.16 0.00 -0.74 0.00 0.00 36.82 36.63 2rpp h ILE 88 CO 0.04 0.01 0.15 -0.46 0.00 0.00 0.00 178.15 177.89 2rpp n ASN 89 N -5.36 0.02 -4.80 1.72 6.94 -1.18 -4.16 115.26 108.45 2rpp n ASN 89 Ca 0.30 1.43 -0.39 0.00 -0.02 0.00 0.00 54.58 55.90 2rpp n ASN 89 Cb 0.99 -0.57 -0.06 0.00 -2.36 0.00 0.00 39.78 37.78 2rpp n ASN 89 CO 0.00 0.00 0.00 -0.44 -1.03 0.00 0.00 177.26 175.79 2rpp s SER 90 N -4.88 7.02 0.00 0.53 0.01 0.91 -4.96 113.70 112.33 2rpp s SER 90 Ca -0.10 1.21 0.00 0.00 1.31 0.00 0.00 55.95 58.38 2rpp s SER 90 Cb 0.26 -2.35 0.00 0.00 0.21 0.00 0.00 66.02 64.14 2rpp s SER 90 CO 0.66 0.24 0.00 0.61 0.41 0.00 0.00 173.24 175.16 2rpp n GLY 91 N 1.91 0.78 3.77 3.44 0.00 -1.26 -5.01 105.19 108.82 2rpp n GLY 91 Ca -0.10 -2.03 -0.36 0.00 0.00 0.00 0.00 46.02 43.54 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 -1.40 3.57 0.68 1.61 0.04 -1.26 -4.99 135.00 133.26 2rpp s PRO 92 Ca 0.00 1.70 -0.17 0.00 0.04 0.00 0.00 61.00 62.57 2rpp s PRO 92 Cb 0.00 -2.22 -0.00 0.00 0.04 0.00 0.00 34.50 32.32 2rpp s PRO 92 CO 0.00 -0.69 1.12 0.43 0.04 0.00 0.00 177.00 177.90 2rpp n SER 93 N -0.86 1.20 -4.03 6.66 7.64 -1.26 -2.60 113.62 120.36 2rpp n SER 93 Ca 0.09 0.75 -0.31 0.00 1.01 0.00 0.00 58.87 60.40 2rpp n SER 93 Cb 0.49 -1.47 -0.00 0.00 -1.01 0.00 0.00 64.21 62.22 2rpp n SER 93 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2rpp n SER 94 N -1.77 -3.26 0.00 6.43 2.88 -1.26 -5.28 113.62 111.36 2rpp n SER 94 Ca 0.14 -0.91 0.00 0.00 -1.33 0.00 0.00 58.87 56.77 2rpp n SER 94 Cb 0.49 -3.31 0.00 0.00 -0.75 0.00 0.00 64.21 60.64 2rpp n SER 94 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42