#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 -4.45 -4.42 1.61 7.64 -1.26 -4.98 113.62 107.76 2rpp n SER 8 Ca 0.00 -0.75 -0.22 0.00 1.01 0.00 0.00 58.87 58.91 2rpp n SER 8 Cb 0.00 -4.09 -0.10 0.00 -1.01 0.00 0.00 64.21 59.01 2rpp n SER 8 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2rpp s SER 9 N -3.48 3.11 0.00 6.43 0.01 -1.26 -5.04 113.70 113.47 2rpp s SER 9 Ca 0.55 -1.04 0.00 0.00 1.31 0.00 0.00 55.95 56.76 2rpp s SER 9 Cb -0.27 -0.22 0.00 0.00 0.21 0.00 0.00 66.02 65.74 2rpp s SER 9 CO 0.81 -0.09 0.00 0.61 0.41 0.00 0.00 173.24 174.99 2rpp n GLY 10 N -0.52 -1.15 3.41 3.44 0.00 -1.26 -5.14 105.19 103.97 2rpp n GLY 10 Ca -0.06 -0.74 -0.10 0.00 0.00 0.00 0.00 46.02 45.12 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 -0.17 -0.08 1.61 0.01 -1.26 -5.18 113.70 108.63 2rpp s SER 11 Ca 0.00 -0.53 -0.30 0.00 1.31 0.00 0.00 55.95 56.42 2rpp s SER 11 Cb 0.00 0.51 0.12 0.00 0.21 0.00 0.00 66.02 66.85 2rpp s SER 11 CO 0.00 -0.95 0.98 -0.94 0.41 0.00 0.00 173.24 172.74 2rpp s SER 12 N -2.88 -0.32 0.29 2.44 1.04 -1.26 -5.19 113.70 107.83 2rpp s SER 12 Ca 0.09 0.09 -0.15 0.00 0.48 0.00 0.00 55.95 56.46 2rpp s SER 12 Cb 0.01 0.31 0.06 0.00 0.10 0.00 0.00 66.02 66.50 2rpp s SER 12 CO -0.05 -0.47 0.78 0.61 0.98 0.00 0.00 173.24 175.09 2rpp n GLY 13 N 0.02 0.95 2.96 7.32 0.00 -1.26 -5.18 105.19 110.00 2rpp n GLY 13 Ca -0.07 -1.19 -0.25 0.00 0.00 0.00 0.00 46.02 44.50 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 -0.54 -2.84 -3.66 1.61 -0.04 -1.26 -5.09 135.00 123.18 2rpp n PRO 14 Ca -0.06 -1.48 -0.08 0.00 -0.04 0.00 0.00 63.50 61.85 2rpp n PRO 14 Cb 0.53 -1.39 -0.08 0.00 -0.04 0.00 0.00 33.50 32.52 2rpp n PRO 14 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2rpp s VAL 15 N -2.67 -0.15 -0.92 0.52 0.11 -1.26 -5.10 120.40 110.93 2rpp s VAL 15 Ca 0.60 0.04 -0.16 0.00 -2.93 0.00 0.00 61.98 59.54 2rpp s VAL 15 Cb -0.06 -0.85 0.18 0.00 -1.53 0.00 0.00 36.38 34.12 2rpp s VAL 15 CO 0.46 0.02 1.00 -0.13 -3.33 0.00 0.00 175.10 173.12 2rpp s ARG 16 N 1.75 3.69 -0.70 1.54 0.52 -1.26 -4.98 118.95 119.51 2rpp s ARG 16 Ca -0.09 -2.24 -0.27 0.00 -0.52 0.00 0.00 55.73 52.62 2rpp s ARG 16 Cb -0.07 -4.70 -0.13 0.00 0.52 0.00 0.00 34.95 30.57 2rpp s ARG 16 CO -0.17 -1.53 2.50 -0.25 0.02 0.00 0.00 175.30 175.87 2rpp n ASP 17 N 5.10 1.47 -2.24 0.23 9.92 -1.26 -4.77 116.55 125.00 2rpp n ASP 17 Ca 0.21 -0.38 -0.31 0.00 -0.53 0.00 0.00 54.79 53.78 2rpp n ASP 17 Cb 0.47 -1.34 0.09 0.00 -0.64 0.00 0.00 41.12 39.70 2rpp n ASP 17 CO 0.00 0.00 0.00 0.35 0.13 0.00 0.00 177.20 177.68 2rpp n THR 18 N 7.80 3.41 0.25 -3.53 -2.24 -1.26 -4.61 114.28 114.11 2rpp n THR 18 Ca 0.48 -2.92 0.10 0.00 -2.27 0.00 0.00 64.05 59.44 2rpp n THR 18 Cb 0.36 -1.03 0.67 0.00 -2.10 0.00 0.00 70.33 68.24 2rpp n THR 18 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 2rpp h LYS 19 N 1.84 0.00 -0.00 -0.78 1.79 -2.00 -2.19 116.57 115.22 2rpp h LYS 19 Ca 0.57 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 59.04 2rpp h LYS 19 Cb 1.22 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.87 2rpp h LYS 19 CO 1.39 0.11 -0.50 -2.67 -1.08 0.00 0.00 179.45 176.70 2rpp n TRP 20 N -4.01 0.00 -1.69 -1.35 4.27 -1.26 -4.51 117.44 108.88 2rpp n TRP 20 Ca -0.02 0.00 -0.35 0.00 -3.89 0.00 0.00 57.50 53.23 2rpp n TRP 20 Cb 0.20 0.00 0.05 0.00 -1.36 0.00 0.00 31.31 30.20 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 -0.79 7.21 -4.22 5.67 4.77 -0.82 -4.68 117.00 124.14 2rpp n LEU 21 Ca 0.04 -4.60 -0.18 0.00 -0.03 0.00 0.00 56.01 51.23 2rpp n LEU 21 Cb 0.26 -0.93 -0.11 0.00 -2.33 0.00 0.00 43.42 40.31 2rpp n LEU 21 CO 0.24 1.69 -0.46 0.42 -1.33 0.00 0.00 177.39 177.95 2rpp s THR 22 N -4.96 1.28 -0.07 -5.08 -4.23 -1.23 -0.11 115.64 101.24 2rpp s THR 22 Ca 0.58 -1.56 -0.07 0.00 -1.18 0.00 0.00 61.69 59.45 2rpp s THR 22 Cb 0.47 -1.38 0.02 0.00 1.34 0.00 0.00 72.50 72.95 2rpp s THR 22 CO -0.18 -0.33 0.19 -0.76 -0.54 0.00 0.00 174.62 173.01 2rpp s LEU 23 N -2.17 1.27 -0.19 4.79 1.43 -0.16 -4.86 118.68 118.79 2rpp s LEU 23 Ca 0.05 0.35 -0.29 0.00 -1.03 0.00 0.00 54.13 53.21 2rpp s LEU 23 Cb -0.07 0.68 -0.04 0.00 0.03 0.00 0.00 46.19 46.79 2rpp s LEU 23 CO 0.03 -0.10 1.80 -0.70 0.23 0.00 0.00 176.35 177.61 2rpp s GLU 24 N -0.03 3.69 0.38 1.70 2.12 -1.26 -2.37 118.70 122.94 2rpp s GLU 24 Ca -0.01 1.86 -0.27 0.00 0.36 0.00 0.00 54.97 56.91 2rpp s GLU 24 Cb -0.02 -4.13 -0.09 0.00 0.26 0.00 0.00 34.13 30.15 2rpp s GLU 24 CO 0.00 -1.43 1.32 0.08 -0.54 0.00 0.00 175.26 174.69 2rpp s VAL 25 N 5.78 2.59 -0.27 3.70 1.01 -1.26 -4.21 120.40 127.75 2rpp s VAL 25 Ca 0.80 0.55 -0.30 0.00 0.00 0.00 0.00 61.98 63.04 2rpp s VAL 25 Cb -0.29 -3.34 -0.07 0.00 0.00 0.00 0.00 36.38 32.69 2rpp s VAL 25 CO 0.33 0.10 2.23 0.00 0.00 0.00 0.00 175.10 177.75 2rpp h ARG 27 N 14.58 0.22 0.22 0.00 -0.00 -1.94 0.15 114.38 127.61 2rpp h ARG 27 Ca -0.36 -0.01 -0.01 0.00 -0.00 0.00 0.00 59.98 59.59 2rpp h ARG 27 Cb 1.26 -0.05 0.00 0.00 -0.00 0.00 0.00 29.97 31.19 2rpp h ARG 27 CO 0.99 0.14 -0.11 1.96 -0.00 0.00 0.00 179.97 182.95 2rpp h GLN 28 N 0.22 -0.29 -0.89 0.08 1.08 -1.94 -3.27 115.11 110.11 2rpp h GLN 28 Ca 0.73 0.02 0.13 0.00 -1.45 0.00 0.00 58.65 58.08 2rpp h GLN 28 Cb 2.07 0.07 -0.14 0.00 -0.05 0.00 0.00 27.48 29.42 2rpp h GLN 28 CO -0.40 0.09 -0.42 0.35 -0.95 0.00 0.00 178.83 177.50 2rpp h PHE 29 N -0.84 -1.22 -0.71 2.96 3.57 -1.32 0.26 116.94 119.63 2rpp h PHE 29 Ca -0.03 0.10 0.13 0.00 3.53 0.00 0.00 57.97 61.70 2rpp h PHE 29 Cb 0.51 0.66 -0.13 0.00 2.79 0.00 0.00 35.95 39.78 2rpp h PHE 29 CO 0.06 -0.40 -0.29 1.96 -2.23 0.00 0.00 178.31 177.41 2rpp h GLN 30 N -0.05 -0.08 0.00 1.11 1.08 -1.53 0.76 115.11 116.40 2rpp h GLN 30 Ca 0.28 0.01 -0.05 0.00 -1.45 0.00 0.00 58.65 57.44 2rpp h GLN 30 Cb 0.56 0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 28.00 2rpp h GLN 30 CO -0.90 -0.05 -0.22 0.00 -0.95 0.00 0.00 178.83 176.70 2rpp h ARG 31 N -0.08 0.00 -0.52 1.46 3.08 -0.78 -3.47 114.38 114.07 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 0.56 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.61 2rpp h ARG 31 CO -0.76 0.22 0.00 0.41 -1.07 0.00 0.00 179.97 178.77 2rpp n GLY 32 N -0.21 0.96 1.04 0.04 0.00 0.26 -5.00 105.19 102.29 2rpp n GLY 32 Ca -0.01 -0.48 0.05 0.00 0.00 0.00 0.00 46.02 45.58 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 -1.95 1.20 -3.70 2.61 5.66 -1.11 -5.01 114.28 111.98 2rpp n THR 33 Ca 0.00 -2.23 -0.38 0.00 -3.05 0.00 0.00 64.05 58.39 2rpp n THR 33 Cb 0.33 0.33 -0.12 0.00 -1.55 0.00 0.00 70.33 69.32 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 4.92 3.60 -4.41 0.00 7.64 -1.26 -4.91 113.62 119.20 2rpp n SER 35 Ca -0.14 -3.28 -0.30 0.00 1.01 0.00 0.00 58.87 56.16 2rpp n SER 35 Cb 0.48 -0.77 -0.13 0.00 -1.01 0.00 0.00 64.21 62.78 2rpp n SER 35 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2rpp s ARG 36 N -2.62 1.85 0.67 1.43 0.52 -1.26 -5.10 118.95 114.44 2rpp s ARG 36 Ca 0.45 -1.10 -0.11 0.00 -0.52 0.00 0.00 55.73 54.45 2rpp s ARG 36 Cb 0.38 -2.07 0.16 0.00 0.52 0.00 0.00 34.95 33.94 2rpp s ARG 36 CO 0.09 0.51 0.87 0.43 0.02 0.00 0.00 175.30 177.22 2rpp n SER 37 N 1.45 -0.13 0.09 0.23 7.64 -1.26 -4.73 113.62 116.91 2rpp n SER 37 Ca -0.17 -1.28 -0.14 0.00 1.01 0.00 0.00 58.87 58.30 2rpp n SER 37 Cb 0.52 -0.68 -0.10 0.00 -1.01 0.00 0.00 64.21 62.95 2rpp n SER 37 CO 0.00 0.00 0.00 -2.24 -3.01 0.00 0.00 175.04 169.79 2rpp h ASP 38 N -1.27 0.41 0.92 6.43 3.04 -1.88 -0.11 116.42 123.95 2rpp h ASP 38 Ca -0.28 -0.39 0.00 0.00 -3.24 0.00 0.00 57.03 53.11 2rpp h ASP 38 Cb 0.79 -0.13 0.00 0.00 -1.04 0.00 0.00 39.33 38.95 2rpp h ASP 38 CO 0.20 1.26 -0.19 1.21 -2.04 0.00 0.00 179.24 179.67 2rpp n GLU 39 N -3.60 0.07 -0.12 4.15 0.00 -1.26 -4.13 120.64 115.75 2rpp n GLU 39 Ca -0.07 0.04 -0.22 0.00 0.00 0.00 0.00 57.16 56.91 2rpp n GLU 39 Cb 0.94 -1.56 -0.07 0.00 0.00 0.00 0.00 31.44 30.75 2rpp n GLU 39 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 2rpp n GLU 40 N -1.67 0.55 -1.88 5.31 0.00 -1.21 -4.99 120.64 116.75 2rpp n GLU 40 Ca 0.06 0.23 -0.37 0.00 0.00 0.00 0.00 57.16 57.09 2rpp n GLU 40 Cb 0.36 -1.43 0.05 0.00 0.00 0.00 0.00 31.44 30.42 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 -1.63 1.03 -4.56 0.00 4.76 -1.26 -4.84 118.16 111.65 2rpp n LYS 42 Ca 0.14 -0.23 -0.26 0.00 -2.87 0.00 0.00 58.31 55.09 2rpp n LYS 42 Cb 0.48 -1.50 -0.11 0.00 -1.84 0.00 0.00 35.03 32.07 2rpp n LYS 42 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 2rpp s PHE 43 N -2.13 2.40 -0.00 2.13 0.40 -1.26 -4.98 117.98 114.54 2rpp s PHE 43 Ca 0.41 -0.61 -0.03 0.00 -0.60 0.00 0.00 56.93 56.10 2rpp s PHE 43 Cb 0.21 -1.53 -0.04 0.00 0.51 0.00 0.00 43.02 42.17 2rpp s PHE 43 CO 0.39 0.48 0.19 0.00 0.70 0.00 0.00 175.22 176.98 2rpp s ALA 44 N -2.71 3.96 -0.44 5.36 0.00 -1.26 -4.84 121.76 121.82 2rpp s ALA 44 Ca 0.34 -0.76 0.03 0.00 0.00 0.00 0.00 51.96 51.57 2rpp s ALA 44 Cb 0.06 -1.89 0.12 0.00 0.00 0.00 0.00 23.12 21.41 2rpp s ALA 44 CO 0.17 0.75 0.20 -1.01 0.00 0.00 0.00 175.76 175.87 2rpp s HIS 45 N -1.34 2.73 0.17 0.00 0.09 -1.26 -2.84 115.29 112.83 2rpp s HIS 45 Ca 0.28 -2.75 -0.30 0.00 -0.00 0.00 0.00 55.06 52.29 2rpp s HIS 45 Cb -0.13 -2.41 -0.08 0.00 -0.00 0.00 0.00 32.58 29.96 2rpp s HIS 45 CO 0.19 -0.80 1.32 -1.25 -0.00 0.00 0.00 174.74 174.20 2rpp s PRO 46 N 0.33 4.38 0.71 8.40 0.04 -1.26 -5.01 135.00 142.58 2rpp s PRO 46 Ca 0.15 2.04 -0.13 0.00 0.04 0.00 0.00 61.00 63.10 2rpp s PRO 46 Cb -0.23 -3.22 0.02 0.00 0.04 0.00 0.00 34.50 31.11 2rpp s PRO 46 CO -0.04 -0.29 1.10 -1.25 0.04 0.00 0.00 177.00 176.56 2rpp s PRO 47 N 0.23 2.58 0.26 0.56 0.04 -1.26 -4.86 135.00 132.55 2rpp s PRO 47 Ca 0.58 1.30 -0.05 0.00 0.04 0.00 0.00 61.00 62.87 2rpp s PRO 47 Cb -0.36 -1.93 0.51 0.00 0.04 0.00 0.00 34.50 32.76 2rpp s PRO 47 CO 0.36 -1.41 1.61 -0.22 0.04 0.00 0.00 177.00 177.38 2rpp h LYS 48 N -0.45 0.06 -0.80 4.56 1.63 -2.00 0.72 116.57 120.29 2rpp h LYS 48 Ca -0.45 -0.00 0.10 0.00 -0.85 0.00 0.00 60.65 59.44 2rpp h LYS 48 Cb 1.24 -0.01 -0.06 0.00 -0.60 0.00 0.00 32.23 32.80 2rpp h LYS 48 CO 0.53 0.04 0.52 0.66 -3.45 0.00 0.00 179.45 177.75 2rpp h SER 49 N 0.06 0.66 -3.53 4.20 4.64 -1.94 -3.41 113.55 114.24 2rpp h SER 49 Ca 0.46 0.02 -0.52 0.00 -0.47 0.00 0.00 61.79 61.28 2rpp h SER 49 Cb 0.84 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.80 2rpp h SER 49 CO -0.77 0.39 0.42 0.00 -0.87 0.00 0.00 176.83 176.00 2rpp s GLN 51 N 0.01 3.67 -0.04 0.00 0.74 -0.68 -4.62 119.66 118.74 2rpp s GLN 51 Ca 0.49 1.31 0.01 0.00 0.05 0.00 0.00 55.36 57.22 2rpp s GLN 51 Cb -0.26 -2.08 0.02 0.00 1.10 0.00 0.00 33.01 31.79 2rpp s GLN 51 CO 0.31 -0.53 -0.06 0.08 -0.55 0.00 0.00 175.29 174.54 2rpp s VAL 52 N -2.13 0.58 0.69 1.34 1.01 -1.26 -4.56 120.40 116.07 2rpp s VAL 52 Ca 0.66 -0.18 -0.07 0.00 0.00 0.00 0.00 61.98 62.38 2rpp s VAL 52 Cb -0.16 -0.57 0.05 0.00 0.00 0.00 0.00 36.38 35.69 2rpp s VAL 52 CO 0.25 0.22 1.01 -0.70 0.00 0.00 0.00 175.10 175.88 2rpp s GLU 53 N 0.66 2.39 -0.38 2.72 2.12 0.37 -4.93 118.70 121.64 2rpp s GLU 53 Ca -0.09 -0.11 -0.34 0.00 0.36 0.00 0.00 54.97 54.79 2rpp s GLU 53 Cb -0.12 -2.16 -0.11 0.00 0.26 0.00 0.00 34.13 32.00 2rpp s GLU 53 CO 0.00 -1.13 2.24 -1.71 -0.54 0.00 0.00 175.26 174.12 2rpp n ASN 54 N -2.89 2.16 -1.73 -1.70 2.85 -1.26 -0.60 115.26 112.09 2rpp n ASN 54 Ca 0.07 0.31 -0.15 0.00 -0.11 0.00 0.00 54.58 54.70 2rpp n ASN 54 Cb 0.60 -1.30 -0.05 0.00 1.24 0.00 0.00 39.78 40.27 2rpp n ASN 54 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2rpp n GLY 55 N 6.44 0.89 3.75 8.20 0.00 -1.26 -4.88 105.19 118.33 2rpp n GLY 55 Ca 0.41 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 -3.80 1.85 -0.13 1.61 3.52 0.23 -4.18 118.95 118.05 2rpp s ARG 56 Ca 0.00 -1.22 -0.18 0.00 -0.13 0.00 0.00 55.73 54.20 2rpp s ARG 56 Cb 0.00 0.57 0.04 0.00 -1.56 0.00 0.00 34.95 34.00 2rpp s ARG 56 CO 0.00 -0.83 0.46 0.54 -0.81 0.00 0.00 175.30 174.67 2rpp s VAL 57 N -3.49 0.01 0.06 7.11 0.11 -1.00 0.14 120.40 123.33 2rpp s VAL 57 Ca 0.16 -0.10 -0.22 0.00 -2.93 0.00 0.00 61.98 58.89 2rpp s VAL 57 Cb -0.04 -0.69 -0.06 0.00 -1.53 0.00 0.00 36.38 34.05 2rpp s VAL 57 CO 0.10 -0.06 0.67 -0.63 -3.33 0.00 0.00 175.10 171.85 2rpp s ILE 58 N -0.25 4.72 0.36 7.04 1.01 -1.26 -0.99 121.20 131.83 2rpp s ILE 58 Ca -0.04 1.43 -0.11 0.00 0.00 0.00 0.00 60.65 61.93 2rpp s ILE 58 Cb -0.03 -4.01 -0.07 0.00 0.01 0.00 0.00 42.46 38.36 2rpp s ILE 58 CO 0.03 0.45 0.73 0.00 0.00 0.00 0.00 174.94 176.14 2rpp s ALA 59 N -0.53 3.39 0.57 9.38 0.00 0.84 -2.82 121.76 132.59 2rpp s ALA 59 Ca 0.33 -0.19 -0.16 0.00 0.00 0.00 0.00 51.96 51.95 2rpp s ALA 59 Cb -0.20 -2.66 -0.05 0.00 0.00 0.00 0.00 23.12 20.21 2rpp s ALA 59 CO 0.21 0.12 1.03 0.00 0.00 0.00 0.00 175.76 177.12 2rpp h PHE 61 N 0.53 0.00 -0.06 0.00 3.57 -1.94 -3.36 116.94 115.69 2rpp h PHE 61 Ca -0.47 0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.06 2rpp h PHE 61 Cb 1.20 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.92 2rpp h PHE 61 CO 0.61 0.42 -0.09 -0.44 -2.23 0.00 0.00 178.31 176.58 2rpp h ASP 62 N -1.00 -0.28 -0.95 0.41 3.32 -1.95 -2.48 116.42 113.49 2rpp h ASP 62 Ca -0.06 0.05 0.28 0.00 0.02 0.00 0.00 57.03 57.31 2rpp h ASP 62 Cb 0.57 0.13 -0.18 0.00 0.22 0.00 0.00 39.33 40.08 2rpp h ASP 62 CO -0.04 -0.13 0.07 -1.54 -1.72 0.00 0.00 179.24 175.88 2rpp n SER 63 N -5.23 -0.06 -0.31 6.45 3.41 -1.26 0.97 113.62 117.59 2rpp n SER 63 Ca -0.05 1.61 0.15 0.00 -0.26 0.00 0.00 58.87 60.33 2rpp n SER 63 Cb 0.15 -0.61 0.32 0.00 -0.26 0.00 0.00 64.21 63.81 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 -0.05 -1.30 1.04 3.38 -1.58 1.32 115.31 118.12 2rpp h LEU 64 Ca 0.60 0.22 -0.07 0.00 0.09 0.00 0.00 57.88 58.72 2rpp h LEU 64 Cb 1.30 0.30 -0.01 0.00 0.09 0.00 0.00 40.66 42.34 2rpp h LEU 64 CO -0.88 -0.22 -0.34 0.11 0.09 0.00 0.00 178.44 177.20 2rpp h LYS 65 N 0.16 0.00 0.00 1.13 1.79 0.48 -3.47 116.57 116.66 2rpp h LYS 65 Ca 0.59 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 59.06 2rpp h LYS 65 Cb 1.25 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.90 2rpp h LYS 65 CO -0.71 0.34 0.00 0.41 -1.08 0.00 0.00 179.45 178.41 2rpp n GLY 66 N -0.45 1.42 2.79 3.86 0.00 0.45 -5.06 105.19 108.21 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 1.09 0.00 0.00 0.00 173.32 174.41 2rpp s ARG 67 N -0.37 0.91 0.11 1.61 3.03 -1.26 -4.97 118.95 118.02 2rpp s ARG 67 Ca 0.00 -0.91 0.01 0.00 2.03 0.00 0.00 55.73 56.86 2rpp s ARG 67 Cb 0.00 -2.20 -0.04 0.00 -1.03 0.00 0.00 34.95 31.68 2rpp s ARG 67 CO 0.00 -0.81 0.26 0.00 -1.13 0.00 0.00 175.30 173.62 2rpp n SER 69 N -0.10 1.06 -3.52 0.00 7.64 -1.26 -4.96 113.62 112.48 2rpp n SER 69 Ca -0.06 0.18 -0.32 0.00 1.01 0.00 0.00 58.87 59.68 2rpp n SER 69 Cb 0.52 -0.43 -0.12 0.00 -1.01 0.00 0.00 64.21 63.18 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 -3.67 0.00 -0.04 1.43 5.12 -1.26 -4.77 116.66 113.46 2rpp n ARG 70 Ca -0.25 0.00 -0.06 0.00 -1.93 0.00 0.00 57.85 55.61 2rpp n ARG 70 Cb 0.64 -1.17 -0.04 0.00 -1.16 0.00 0.00 32.46 30.72 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 9.37 -0.19 -1.24 5.56 3.07 -2.05 -1.19 114.58 127.90 2rpp h GLU 71 Ca -0.04 0.01 -0.41 0.00 -0.50 0.00 0.00 59.36 58.43 2rpp h GLU 71 Cb 1.02 0.04 -0.19 0.00 -0.84 0.00 0.00 28.75 28.78 2rpp h GLU 71 CO 1.09 -0.13 0.53 0.27 -1.40 0.00 0.00 179.01 179.36 2rpp n ASN 72 N -3.83 5.84 -3.38 1.42 0.23 -1.26 -4.99 115.26 109.28 2rpp n ASN 72 Ca -0.02 -3.22 -0.44 0.00 -0.53 0.00 0.00 54.58 50.37 2rpp n ASN 72 Cb 0.15 -0.94 -0.06 0.00 -2.08 0.00 0.00 39.78 36.86 2rpp n ASN 72 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2rpp n LYS 74 N 1.10 0.23 -3.40 0.00 5.02 -1.26 -4.51 118.16 115.34 2rpp n LYS 74 Ca 0.15 0.04 -0.38 0.00 -2.02 0.00 0.00 58.31 56.09 2rpp n LYS 74 Cb 0.07 -1.61 -0.06 0.00 -0.02 0.00 0.00 35.03 33.41 2rpp n LYS 74 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 2rpp s TYR 75 N -3.14 3.68 0.44 2.13 1.51 -1.26 -1.69 117.35 119.02 2rpp s TYR 75 Ca 0.06 1.02 -0.22 0.00 -1.01 0.00 0.00 57.07 56.92 2rpp s TYR 75 Cb 0.15 -2.40 -0.09 0.00 -0.11 0.00 0.00 41.96 39.50 2rpp s TYR 75 CO 0.75 0.50 1.04 -1.17 -1.11 0.00 0.00 175.55 175.55 2rpp s LEU 76 N -0.60 3.98 -0.60 -1.29 2.96 -1.13 -4.46 118.68 117.54 2rpp s LEU 76 Ca 0.25 1.97 -0.13 0.00 -0.22 0.00 0.00 54.13 56.00 2rpp s LEU 76 Cb -0.17 -4.39 0.15 0.00 0.50 0.00 0.00 46.19 42.29 2rpp s LEU 76 CO 0.14 -0.63 0.52 -1.00 -1.32 0.00 0.00 176.35 174.06 2rpp s HIS 77 N -1.84 3.44 0.47 5.38 3.76 -1.26 -0.03 115.29 125.21 2rpp s HIS 77 Ca 0.63 -1.72 -0.22 0.00 -0.15 0.00 0.00 55.06 53.59 2rpp s HIS 77 Cb -0.18 -3.69 -0.07 0.00 1.11 0.00 0.00 32.58 29.75 2rpp s HIS 77 CO 0.23 -0.99 1.16 -1.25 -0.85 0.00 0.00 174.74 173.04 2rpp s PRO 78 N 1.05 3.70 1.07 8.40 0.04 -1.26 -5.02 135.00 142.98 2rpp s PRO 78 Ca 0.08 1.75 -0.14 0.00 0.04 0.00 0.00 61.00 62.73 2rpp s PRO 78 Cb -0.23 -2.35 0.22 0.00 0.04 0.00 0.00 34.50 32.18 2rpp s PRO 78 CO -0.01 -0.60 1.10 -1.25 0.04 0.00 0.00 177.00 176.28 2rpp s PRO 79 N -2.78 -0.13 0.00 0.56 0.04 -1.26 -4.71 135.00 126.71 2rpp s PRO 79 Ca 0.65 0.32 0.00 0.00 0.04 0.00 0.00 61.00 62.01 2rpp s PRO 79 Cb -0.28 -1.69 0.00 0.00 0.04 0.00 0.00 34.50 32.57 2rpp s PRO 79 CO 0.34 -3.07 0.98 2.41 0.04 0.00 0.00 177.00 177.70 2rpp n THR 80 N -4.38 0.00 -0.27 1.26 -1.04 -1.26 0.09 114.28 108.68 2rpp n THR 80 Ca 0.07 1.48 0.27 0.00 -2.04 0.00 0.00 64.05 63.83 2rpp n THR 80 Cb 0.58 -2.44 0.48 0.00 -1.82 0.00 0.00 70.33 67.13 2rpp n THR 80 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2rpp n HIS 81 N -2.03 0.87 0.01 -1.42 1.44 -1.26 0.21 115.22 113.04 2rpp n HIS 81 Ca 0.00 0.88 -0.18 0.00 -2.01 0.00 0.00 57.72 56.40 2rpp n HIS 81 Cb 0.00 -1.30 -0.11 0.00 0.12 0.00 0.00 29.99 28.71 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 0.62 -0.91 2.39 3.38 -1.86 -3.32 115.31 115.61 2rpp h LEU 82 Ca 0.68 -0.76 0.14 0.00 0.09 0.00 0.00 57.88 58.03 2rpp h LEU 82 Cb 1.87 -0.19 -0.15 0.00 0.09 0.00 0.00 40.66 42.28 2rpp h LEU 82 CO -0.57 1.30 -0.35 1.17 0.09 0.00 0.00 178.44 180.08 2rpp n LYS 83 N -4.13 -0.21 -0.33 1.13 4.81 0.57 0.63 118.16 120.63 2rpp n LYS 83 Ca -0.11 1.40 0.15 0.00 -0.87 0.00 0.00 58.31 58.88 2rpp n LYS 83 Cb 0.72 -2.07 0.29 0.00 0.02 0.00 0.00 35.03 33.99 2rpp n LYS 83 CO 0.00 0.00 0.00 2.41 1.17 0.00 0.00 177.40 180.98 2rpp n THR 84 N -5.34 -0.40 -0.21 3.15 -1.04 -1.12 0.80 114.28 110.11 2rpp n THR 84 Ca 0.09 2.09 0.02 0.00 -2.04 0.00 0.00 64.05 64.21 2rpp n THR 84 Cb 0.37 -3.06 0.11 0.00 -1.82 0.00 0.00 70.33 65.92 2rpp n THR 84 CO 0.00 0.00 0.00 1.56 -0.64 0.00 0.00 175.07 175.99 2rpp h GLN 85 N 0.00 0.11 -0.88 -2.82 4.20 -0.01 0.12 115.11 115.82 2rpp h GLN 85 Ca 0.58 -0.01 0.19 0.00 0.06 0.00 0.00 58.65 59.48 2rpp h GLN 85 Cb 1.21 -0.02 -0.11 0.00 0.30 0.00 0.00 27.48 28.86 2rpp h GLN 85 CO -0.89 0.07 0.42 -0.07 -0.67 0.00 0.00 178.83 177.69 2rpp h LEU 86 N 0.11 0.42 0.05 1.46 3.38 0.34 -1.90 115.31 119.17 2rpp h LEU 86 Ca 0.34 0.13 -0.00 0.00 0.09 0.00 0.00 57.88 58.43 2rpp h LEU 86 Cb 0.55 0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.38 2rpp h LEU 86 CO -0.55 0.09 -0.03 -0.33 0.09 0.00 0.00 178.44 177.71 2rpp h GLU 87 N 0.49 -0.07 -1.12 1.13 4.39 -0.83 -3.22 114.58 115.36 2rpp h GLU 87 Ca 0.52 0.00 0.42 0.00 0.34 0.00 0.00 59.36 60.65 2rpp h GLU 87 Cb 0.91 0.02 -0.15 0.00 -0.10 0.00 0.00 28.75 29.43 2rpp h GLU 87 CO -0.46 0.49 0.67 -0.89 -1.16 0.00 0.00 179.01 177.66 2rpp n ILE 88 N -4.84 -0.30 -0.27 3.13 5.41 -0.11 -0.26 119.36 122.12 2rpp n ILE 88 Ca -0.09 1.76 0.15 0.00 1.00 0.00 0.00 62.75 65.57 2rpp n ILE 88 Cb 0.30 -2.88 0.28 0.00 -0.71 0.00 0.00 39.64 36.63 2rpp n ILE 88 CO 0.00 0.00 0.00 -3.20 0.00 0.00 0.00 176.55 173.35 2rpp n ASN 89 N -4.80 -0.01 -4.65 4.38 5.15 -1.01 -4.16 115.26 110.16 2rpp n ASN 89 Ca 0.36 1.32 -0.42 0.00 -0.60 0.00 0.00 54.58 55.24 2rpp n ASN 89 Cb 1.33 -0.52 -0.03 0.00 -0.53 0.00 0.00 39.78 40.04 2rpp n ASN 89 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 2rpp s SER 90 N -4.92 6.38 0.42 1.20 1.04 0.64 -4.92 113.70 113.54 2rpp s SER 90 Ca -0.09 2.37 -0.25 0.00 0.48 0.00 0.00 55.95 58.45 2rpp s SER 90 Cb 0.24 -2.53 -0.10 0.00 0.10 0.00 0.00 66.02 63.73 2rpp s SER 90 CO 0.61 -1.15 1.24 0.61 0.98 0.00 0.00 173.24 175.53 2rpp n GLY 91 N 4.59 0.46 0.90 7.32 0.00 -1.26 -5.00 105.19 112.20 2rpp n GLY 91 Ca 0.20 0.18 -0.08 0.00 0.00 0.00 0.00 46.02 46.33 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 0.03 -1.56 -1.67 1.61 -0.04 -1.26 -4.80 135.00 127.30 2rpp n PRO 92 Ca 0.07 -0.45 -0.46 0.00 -0.04 0.00 0.00 63.50 62.62 2rpp n PRO 92 Cb 0.40 -0.42 -0.04 0.00 -0.04 0.00 0.00 33.50 33.39 2rpp n PRO 92 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2rpp n SER 93 N -3.48 3.06 -4.42 3.54 3.41 -1.26 -1.56 113.62 112.91 2rpp n SER 93 Ca 0.04 1.08 -0.39 0.00 -0.26 0.00 0.00 58.87 59.34 2rpp n SER 93 Cb 0.15 -1.42 -0.07 0.00 -0.26 0.00 0.00 64.21 62.62 2rpp n SER 93 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2rpp n SER 94 N 3.47 -1.86 -0.10 4.04 2.88 -1.26 -5.33 113.62 115.46 2rpp n SER 94 Ca 0.17 -1.18 0.01 0.00 -1.33 0.00 0.00 58.87 56.54 2rpp n SER 94 Cb 0.28 -1.95 0.01 0.00 -0.75 0.00 0.00 64.21 61.81 2rpp n SER 94 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42