#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 6.63 -0.61 1.61 0.01 -1.26 -4.93 113.70 115.14 2rpp s SER 8 Ca 0.00 2.54 -0.28 0.00 1.31 0.00 0.00 55.95 59.52 2rpp s SER 8 Cb 0.00 -2.59 0.03 0.00 0.21 0.00 0.00 66.02 63.67 2rpp s SER 8 CO 0.00 -0.81 1.27 -0.44 0.41 0.00 0.00 173.24 173.66 2rpp s SER 9 N 1.42 6.30 -0.19 2.44 0.01 -1.26 -4.96 113.70 117.46 2rpp s SER 9 Ca 0.70 0.02 -0.13 0.00 1.31 0.00 0.00 55.95 57.85 2rpp s SER 9 Cb -0.42 -2.55 0.06 0.00 0.21 0.00 0.00 66.02 63.32 2rpp s SER 9 CO 0.31 -1.62 0.49 -0.83 0.41 0.00 0.00 173.24 172.00 2rpp s GLY 10 N 3.49 -0.40 0.19 3.44 0.00 -1.26 -5.13 107.32 107.66 2rpp s GLY 10 Ca 0.43 1.63 -0.30 0.00 0.00 0.00 0.00 44.72 46.48 2rpp s GLY 10 CO 0.23 1.63 0.85 1.44 0.00 0.00 0.00 173.10 177.25 2rpp n SER 11 N 3.75 0.12 -2.05 1.64 7.64 -1.26 -4.82 113.62 118.64 2rpp n SER 11 Ca -0.19 1.15 -0.22 0.00 1.01 0.00 0.00 58.87 60.62 2rpp n SER 11 Cb 0.56 -1.09 0.04 0.00 -1.01 0.00 0.00 64.21 62.71 2rpp n SER 11 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2rpp n SER 12 N 1.74 6.75 -3.29 6.43 7.64 -1.26 -4.98 113.62 126.65 2rpp n SER 12 Ca 0.15 -3.24 -0.27 0.00 1.01 0.00 0.00 58.87 56.53 2rpp n SER 12 Cb 0.25 -1.06 0.26 0.00 -1.01 0.00 0.00 64.21 62.65 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 0.12 -3.59 3.62 0.23 0.00 -1.26 -5.00 105.19 99.31 2rpp n GLY 13 Ca 0.39 -1.50 -0.30 0.00 0.00 0.00 0.00 46.02 44.61 2rpp n GLY 13 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2rpp s PRO 14 N -4.70 -0.71 0.50 1.61 0.04 -1.26 -5.00 135.00 125.48 2rpp s PRO 14 Ca 0.59 0.12 -0.21 0.00 0.04 0.00 0.00 61.00 61.54 2rpp s PRO 14 Cb -0.10 -1.64 -0.07 0.00 0.04 0.00 0.00 34.50 32.73 2rpp s PRO 14 CO 0.49 -3.41 1.14 0.14 0.04 0.00 0.00 177.00 175.41 2rpp s VAL 15 N -2.99 3.18 -0.26 -0.36 -7.23 -1.26 -4.92 120.40 106.56 2rpp s VAL 15 Ca 0.69 0.81 -0.03 0.00 -1.81 0.00 0.00 61.98 61.64 2rpp s VAL 15 Cb -0.13 -3.37 0.05 0.00 0.56 0.00 0.00 36.38 33.49 2rpp s VAL 15 CO 0.57 -0.09 2.53 -1.14 -0.31 0.00 0.00 175.10 176.66 2rpp n ARG 16 N -0.87 1.90 -1.47 4.82 0.63 -1.26 -4.46 116.66 115.95 2rpp n ARG 16 Ca 0.09 -1.47 -0.32 0.00 -0.92 0.00 0.00 57.85 55.23 2rpp n ARG 16 Cb 0.50 -1.75 0.07 0.00 0.45 0.00 0.00 32.46 31.72 2rpp n ARG 16 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 2rpp n ASP 17 N 1.06 6.93 -2.73 6.15 9.92 -1.26 -4.68 116.55 131.94 2rpp n ASP 17 Ca 0.34 -3.78 -0.34 0.00 -0.53 0.00 0.00 54.79 50.48 2rpp n ASP 17 Cb 0.62 -0.83 0.02 0.00 -0.64 0.00 0.00 41.12 40.29 2rpp n ASP 17 CO 0.00 0.00 0.00 0.41 0.13 0.00 0.00 177.20 177.74 2rpp n THR 18 N -0.88 3.07 -0.06 -3.53 -1.04 -1.26 -4.62 114.28 105.96 2rpp n THR 18 Ca 0.58 -4.62 -0.17 0.00 -2.04 0.00 0.00 64.05 57.81 2rpp n THR 18 Cb 0.76 -1.26 -0.14 0.00 -1.82 0.00 0.00 70.33 67.88 2rpp n THR 18 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 2rpp n LYS 19 N -0.51 0.69 -0.95 -2.82 3.00 -1.26 -4.24 118.16 112.08 2rpp n LYS 19 Ca 0.47 0.19 -0.10 0.00 -0.00 0.00 0.00 58.31 58.86 2rpp n LYS 19 Cb 0.42 -1.62 0.23 0.00 0.00 0.00 0.00 35.03 34.06 2rpp n LYS 19 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 177.40 174.73 2rpp n TRP 20 N -3.23 2.32 -2.56 5.64 4.27 -1.26 -4.30 117.44 118.32 2rpp n TRP 20 Ca -0.35 -1.26 -0.13 0.00 -3.89 0.00 0.00 57.50 51.87 2rpp n TRP 20 Cb 1.04 -0.70 0.03 0.00 -1.36 0.00 0.00 31.31 30.32 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 -0.35 2.80 -4.16 5.67 4.77 -1.26 -4.67 117.00 119.81 2rpp n LEU 21 Ca 0.41 -4.04 -0.13 0.00 -0.03 0.00 0.00 56.01 52.22 2rpp n LEU 21 Cb 1.34 0.11 -0.11 0.00 -2.33 0.00 0.00 43.42 42.44 2rpp n LEU 21 CO 0.43 1.67 -0.40 0.42 -1.33 0.00 0.00 177.39 178.17 2rpp s THR 22 N -4.10 0.80 -0.06 -5.08 -4.23 -1.26 -0.23 115.64 101.49 2rpp s THR 22 Ca 0.36 -1.64 -0.08 0.00 -1.18 0.00 0.00 61.69 59.14 2rpp s THR 22 Cb 0.40 -1.34 0.02 0.00 1.34 0.00 0.00 72.50 72.92 2rpp s THR 22 CO -0.03 -0.63 0.22 -0.76 -0.54 0.00 0.00 174.62 172.87 2rpp s LEU 23 N -2.50 1.19 -0.14 4.79 1.43 0.27 -4.90 118.68 118.83 2rpp s LEU 23 Ca 0.05 0.31 -0.29 0.00 -1.03 0.00 0.00 54.13 53.17 2rpp s LEU 23 Cb -0.01 0.79 -0.05 0.00 0.03 0.00 0.00 46.19 46.94 2rpp s LEU 23 CO -0.01 -0.15 1.79 -1.61 0.23 0.00 0.00 176.35 176.60 2rpp s GLU 24 N -0.23 3.83 0.16 1.70 2.02 -1.26 -1.69 118.70 123.23 2rpp s GLU 24 Ca -0.03 2.01 -0.32 0.00 0.02 0.00 0.00 54.97 56.65 2rpp s GLU 24 Cb -0.03 -4.11 -0.11 0.00 0.10 0.00 0.00 34.13 29.99 2rpp s GLU 24 CO 0.01 -1.28 1.69 0.08 0.02 0.00 0.00 175.26 175.78 2rpp s VAL 25 N 5.35 2.42 -0.38 2.63 1.01 -1.25 -4.03 120.40 126.15 2rpp s VAL 25 Ca 0.80 0.21 -0.38 0.00 0.00 0.00 0.00 61.98 62.61 2rpp s VAL 25 Cb -0.31 -3.14 -0.13 0.00 0.00 0.00 0.00 36.38 32.80 2rpp s VAL 25 CO 0.33 0.01 2.14 0.00 0.00 0.00 0.00 175.10 177.58 2rpp h ARG 27 N 11.17 -0.19 -0.25 0.00 9.65 -1.92 -0.62 114.38 132.22 2rpp h ARG 27 Ca -0.25 0.01 0.06 0.00 -1.10 0.00 0.00 59.98 58.71 2rpp h ARG 27 Cb 1.34 0.04 -0.07 0.00 -1.39 0.00 0.00 29.97 29.89 2rpp h ARG 27 CO 1.03 -0.13 -0.28 1.96 2.80 0.00 0.00 179.97 185.36 2rpp h GLN 28 N -0.19 -0.27 -0.85 0.20 4.20 -1.90 -1.91 115.11 114.38 2rpp h GLN 28 Ca 0.15 0.02 0.15 0.00 0.06 0.00 0.00 58.65 59.03 2rpp h GLN 28 Cb 0.53 0.06 -0.15 0.00 0.30 0.00 0.00 27.48 28.22 2rpp h GLN 28 CO -0.76 -0.18 -0.30 0.35 -0.67 0.00 0.00 178.83 177.27 2rpp h PHE 29 N -0.28 -0.77 -0.60 2.96 3.57 -1.44 0.68 116.94 121.06 2rpp h PHE 29 Ca 0.14 0.09 0.12 0.00 3.53 0.00 0.00 57.97 61.84 2rpp h PHE 29 Cb 0.50 0.47 -0.11 0.00 2.79 0.00 0.00 35.95 39.59 2rpp h PHE 29 CO -0.43 -0.39 -0.12 1.96 -2.23 0.00 0.00 178.31 177.10 2rpp h GLN 30 N -0.04 0.02 0.00 1.11 1.08 -0.68 0.21 115.11 116.82 2rpp h GLN 30 Ca 0.36 -0.00 -0.09 0.00 -1.45 0.00 0.00 58.65 57.47 2rpp h GLN 30 Cb 0.61 -0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.02 2rpp h GLN 30 CO -0.88 0.01 -0.41 0.00 -0.95 0.00 0.00 178.83 176.61 2rpp h ARG 31 N 0.02 0.00 0.00 1.46 3.08 -0.44 -3.47 114.38 115.03 2rpp h ARG 31 Ca 0.29 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.34 2rpp h ARG 31 Cb 0.46 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.51 2rpp h ARG 31 CO -0.60 0.41 0.00 0.41 -1.07 0.00 0.00 179.97 179.12 2rpp n GLY 32 N 0.53 0.96 2.07 0.04 0.00 0.20 -4.99 105.19 103.99 2rpp n GLY 32 Ca 0.00 -0.25 -0.27 0.00 0.00 0.00 0.00 46.02 45.51 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 -2.16 2.93 -4.00 2.61 5.66 -0.89 -4.93 114.28 113.49 2rpp n THR 33 Ca 0.00 -3.65 -0.32 0.00 -3.05 0.00 0.00 64.05 57.03 2rpp n THR 33 Cb 0.02 -1.09 -0.15 0.00 -1.55 0.00 0.00 70.33 67.57 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 4.40 4.05 -4.44 0.00 2.88 -1.26 -4.90 113.62 114.35 2rpp n SER 35 Ca -0.06 -3.53 -0.32 0.00 -1.33 0.00 0.00 58.87 53.63 2rpp n SER 35 Cb 0.42 -0.84 -0.14 0.00 -0.75 0.00 0.00 64.21 62.91 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 -3.15 2.41 0.89 -1.46 0.52 -1.26 -5.10 118.95 111.81 2rpp s ARG 36 Ca 0.54 -0.75 -0.15 0.00 -0.52 0.00 0.00 55.73 54.85 2rpp s ARG 36 Cb 0.45 -2.30 0.21 0.00 0.52 0.00 0.00 34.95 33.83 2rpp s ARG 36 CO 0.09 0.61 0.99 -1.13 0.02 0.00 0.00 175.30 175.88 2rpp n SER 37 N 2.31 -0.85 0.08 0.23 3.41 -1.26 -4.66 113.62 112.88 2rpp n SER 37 Ca -0.17 -1.23 -0.09 0.00 -0.26 0.00 0.00 58.87 57.12 2rpp n SER 37 Cb 0.52 -0.82 -0.06 0.00 -0.26 0.00 0.00 64.21 63.59 2rpp n SER 37 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2rpp h ASP 38 N -1.89 0.20 1.62 4.04 3.32 -1.90 0.19 116.42 122.01 2rpp h ASP 38 Ca -0.34 -0.18 0.00 0.00 0.02 0.00 0.00 57.03 56.52 2rpp h ASP 38 Cb 0.99 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.48 2rpp h ASP 38 CO 0.23 1.06 0.00 -0.33 -1.72 0.00 0.00 179.24 178.48 2rpp h GLU 39 N 0.06 0.00 0.00 3.56 3.07 -1.94 -3.36 114.58 115.97 2rpp h GLU 39 Ca -0.05 0.00 -0.19 0.00 -0.50 0.00 0.00 59.36 58.62 2rpp h GLU 39 Cb 1.66 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 29.54 2rpp h GLU 39 CO 0.14 0.00 -1.59 0.39 -1.40 0.00 0.00 179.01 176.55 2rpp n GLU 40 N -2.94 0.53 -2.00 2.33 -0.58 -1.20 -4.96 120.64 111.82 2rpp n GLU 40 Ca 0.03 0.22 -0.42 0.00 -0.42 0.00 0.00 57.16 56.57 2rpp n GLU 40 Cb 0.45 -1.41 -0.03 0.00 -0.57 0.00 0.00 31.44 29.88 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 3.31 1.25 -4.17 0.00 4.01 -1.26 -4.72 118.16 116.59 2rpp n LYS 42 Ca 0.11 -0.58 -0.10 0.00 -0.51 0.00 0.00 58.31 57.22 2rpp n LYS 42 Cb 0.40 -1.23 -0.10 0.00 -0.51 0.00 0.00 35.03 33.59 2rpp n LYS 42 CO 0.00 0.00 0.00 -0.06 -1.11 0.00 0.00 177.40 176.23 2rpp s PHE 43 N -0.65 0.91 -0.15 2.13 0.40 -1.26 -5.06 117.98 114.30 2rpp s PHE 43 Ca 0.11 -1.08 -0.09 0.00 -0.60 0.00 0.00 56.93 55.26 2rpp s PHE 43 Cb 0.09 -0.53 -0.05 0.00 0.51 0.00 0.00 43.02 43.04 2rpp s PHE 43 CO 0.02 -0.34 0.17 0.00 0.70 0.00 0.00 175.22 175.77 2rpp s ALA 44 N -3.83 3.76 -0.50 5.36 0.00 -1.26 -4.87 121.76 120.42 2rpp s ALA 44 Ca 0.19 -0.61 0.02 0.00 0.00 0.00 0.00 51.96 51.56 2rpp s ALA 44 Cb 0.07 -2.12 0.13 0.00 0.00 0.00 0.00 23.12 21.19 2rpp s ALA 44 CO -0.01 0.37 0.26 -1.01 0.00 0.00 0.00 175.76 175.37 2rpp s HIS 45 N -0.33 3.35 -0.05 0.00 0.09 -1.26 -2.01 115.29 115.07 2rpp s HIS 45 Ca 0.13 -3.02 -0.30 0.00 -0.00 0.00 0.00 55.06 51.87 2rpp s HIS 45 Cb -0.12 -2.93 -0.05 0.00 -0.00 0.00 0.00 32.58 29.48 2rpp s HIS 45 CO 0.02 -0.81 1.49 -1.25 -0.00 0.00 0.00 174.74 174.20 2rpp s PRO 46 N 0.02 4.23 1.16 8.40 0.04 -1.26 -4.99 135.00 142.60 2rpp s PRO 46 Ca 0.16 2.02 -0.18 0.00 0.04 0.00 0.00 61.00 63.04 2rpp s PRO 46 Cb -0.24 -3.78 0.27 0.00 0.04 0.00 0.00 34.50 30.79 2rpp s PRO 46 CO -0.02 -0.72 1.11 -1.25 0.04 0.00 0.00 177.00 176.15 2rpp s PRO 47 N 3.29 -0.88 0.11 0.56 0.04 -1.26 -4.89 135.00 131.97 2rpp s PRO 47 Ca 0.66 0.06 -0.20 0.00 0.04 0.00 0.00 61.00 61.56 2rpp s PRO 47 Cb -0.31 -1.63 -0.08 0.00 0.04 0.00 0.00 34.50 32.52 2rpp s PRO 47 CO 0.26 -3.51 1.77 0.87 0.04 0.00 0.00 177.00 176.42 2rpp h LYS 48 N -2.44 0.20 -0.86 4.56 1.79 -1.99 -2.41 116.57 115.42 2rpp h LYS 48 Ca -0.47 -0.01 0.10 0.00 -2.18 0.00 0.00 60.65 58.09 2rpp h LYS 48 Cb 1.30 -0.04 -0.06 0.00 -1.58 0.00 0.00 32.23 31.85 2rpp h LYS 48 CO 0.40 0.13 0.55 0.77 -1.08 0.00 0.00 179.45 180.22 2rpp h SER 49 N 0.20 0.72 -3.52 0.86 0.02 -1.93 -3.41 113.55 106.50 2rpp h SER 49 Ca 0.06 0.02 -0.53 0.00 -0.84 0.00 0.00 61.79 60.50 2rpp h SER 49 Cb -0.02 -0.13 -0.03 0.00 0.14 0.00 0.00 62.40 62.37 2rpp h SER 49 CO -0.02 0.42 0.22 0.00 -1.14 0.00 0.00 176.83 176.31 2rpp s GLN 51 N -0.61 2.65 -0.08 0.00 2.00 -1.17 -4.53 119.66 117.92 2rpp s GLN 51 Ca 0.39 1.33 -0.00 0.00 -2.00 0.00 0.00 55.36 55.08 2rpp s GLN 51 Cb -0.23 -1.94 0.02 0.00 0.80 0.00 0.00 33.01 31.67 2rpp s GLN 51 CO 0.26 -1.36 -0.05 0.08 -0.50 0.00 0.00 175.29 173.72 2rpp s VAL 52 N -2.49 0.74 0.56 1.34 1.01 -1.26 -4.71 120.40 115.59 2rpp s VAL 52 Ca 0.65 -0.15 -0.04 0.00 0.00 0.00 0.00 61.98 62.44 2rpp s VAL 52 Cb -0.20 -0.78 0.01 0.00 0.00 0.00 0.00 36.38 35.41 2rpp s VAL 52 CO 0.45 0.30 0.85 -1.61 0.00 0.00 0.00 175.10 175.10 2rpp s GLU 53 N 1.48 2.90 -0.41 2.72 8.01 0.23 -4.95 118.70 128.68 2rpp s GLU 53 Ca -0.01 -0.16 -0.31 0.00 0.01 0.00 0.00 54.97 54.50 2rpp s GLU 53 Cb -0.13 -2.34 -0.10 0.00 -4.31 0.00 0.00 34.13 27.25 2rpp s GLU 53 CO -0.04 -0.64 2.30 -1.71 0.01 0.00 0.00 175.26 175.18 2rpp n ASN 54 N -2.48 2.25 -1.53 -0.19 2.85 -1.26 -1.11 115.26 113.79 2rpp n ASN 54 Ca 0.04 0.14 -0.15 0.00 -0.11 0.00 0.00 54.58 54.51 2rpp n ASN 54 Cb 0.58 -1.37 -0.06 0.00 1.24 0.00 0.00 39.78 40.18 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 6.26 1.19 3.63 8.20 0.00 -1.26 -4.88 105.19 118.33 2rpp n GLY 55 Ca 0.40 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.33 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 -3.42 1.54 -0.16 1.61 3.52 -0.27 -3.88 118.95 117.89 2rpp s ARG 56 Ca 0.00 -1.03 -0.14 0.00 -0.13 0.00 0.00 55.73 54.42 2rpp s ARG 56 Cb 0.00 0.52 0.04 0.00 -1.56 0.00 0.00 34.95 33.96 2rpp s ARG 56 CO 0.00 -0.66 0.43 0.54 -0.81 0.00 0.00 175.30 174.79 2rpp s VAL 57 N -3.94 -0.00 0.02 7.11 0.11 -0.68 0.77 120.40 123.80 2rpp s VAL 57 Ca 0.14 0.01 -0.25 0.00 -2.93 0.00 0.00 61.98 58.95 2rpp s VAL 57 Cb -0.02 -0.60 -0.05 0.00 -1.53 0.00 0.00 36.38 34.18 2rpp s VAL 57 CO 0.04 0.00 0.77 -0.63 -3.33 0.00 0.00 175.10 171.95 2rpp s ILE 58 N 0.32 4.80 -0.04 7.04 1.01 -1.26 -0.56 121.20 132.51 2rpp s ILE 58 Ca -0.01 1.62 -0.24 0.00 0.00 0.00 0.00 60.65 62.02 2rpp s ILE 58 Cb -0.03 -4.11 -0.04 0.00 0.01 0.00 0.00 42.46 38.28 2rpp s ILE 58 CO -0.00 0.33 0.73 0.00 0.00 0.00 0.00 174.94 175.99 2rpp s ALA 59 N 0.17 3.34 0.37 9.38 0.00 0.69 -3.09 121.76 132.61 2rpp s ALA 59 Ca 0.39 0.19 -0.28 0.00 0.00 0.00 0.00 51.96 52.26 2rpp s ALA 59 Cb -0.20 -2.98 -0.11 0.00 0.00 0.00 0.00 23.12 19.83 2rpp s ALA 59 CO 0.22 -0.07 1.48 0.00 0.00 0.00 0.00 175.76 177.40 2rpp h PHE 61 N 3.11 -0.51 -0.45 0.00 3.57 -1.95 -3.24 116.94 117.46 2rpp h PHE 61 Ca -0.50 -0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.08 2rpp h PHE 61 Cb 1.24 0.17 -0.09 0.00 2.79 0.00 0.00 35.95 40.06 2rpp h PHE 61 CO 0.53 -0.32 -0.17 -0.44 -2.23 0.00 0.00 178.31 175.69 2rpp h ASP 62 N -1.00 -0.59 -0.99 0.41 3.32 -1.92 -1.09 116.42 114.56 2rpp h ASP 62 Ca -0.06 0.15 0.27 0.00 0.02 0.00 0.00 57.03 57.42 2rpp h ASP 62 Cb 0.42 0.34 -0.18 0.00 0.22 0.00 0.00 39.33 40.13 2rpp h ASP 62 CO 0.09 -0.20 0.01 0.77 -1.72 0.00 0.00 179.24 178.19 2rpp h SER 63 N -0.07 -0.51 -0.97 6.45 4.64 -1.81 0.93 113.55 122.21 2rpp h SER 63 Ca 0.22 0.28 0.27 0.00 -0.47 0.00 0.00 61.79 62.09 2rpp h SER 63 Cb 0.40 0.50 -0.14 0.00 -0.31 0.00 0.00 62.40 62.85 2rpp h SER 63 CO -0.50 -0.36 0.51 -0.07 -0.87 0.00 0.00 176.83 175.54 2rpp h LEU 64 N 0.01 0.48 -1.26 5.97 3.38 -1.22 0.94 115.31 123.61 2rpp h LEU 64 Ca 0.59 0.17 -0.08 0.00 0.09 0.00 0.00 57.88 58.65 2rpp h LEU 64 Cb 1.21 0.12 -0.01 0.00 0.09 0.00 0.00 40.66 42.06 2rpp h LEU 64 CO -0.93 -0.03 -0.37 0.11 0.09 0.00 0.00 178.44 177.31 2rpp h LYS 65 N 0.41 0.00 0.00 1.13 1.79 0.80 -3.47 116.57 117.24 2rpp h LYS 65 Ca 0.65 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 59.12 2rpp h LYS 65 Cb 1.36 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.01 2rpp h LYS 65 CO -0.55 0.37 0.00 0.41 -1.08 0.00 0.00 179.45 178.59 2rpp n GLY 66 N -0.44 1.83 2.81 3.86 0.00 0.33 -5.05 105.19 108.51 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 -0.39 0.99 0.12 1.61 6.06 -1.26 -4.98 118.95 121.10 2rpp s ARG 67 Ca 0.00 -0.79 0.02 0.00 -2.50 0.00 0.00 55.73 52.45 2rpp s ARG 67 Cb 0.00 -2.26 -0.04 0.00 0.06 0.00 0.00 34.95 32.71 2rpp s ARG 67 CO 0.00 -0.72 0.25 0.00 -2.50 0.00 0.00 175.30 172.33 2rpp n SER 69 N -0.22 0.82 -3.13 0.00 2.88 -1.26 -5.00 113.62 107.72 2rpp n SER 69 Ca -0.06 0.13 -0.43 0.00 -1.33 0.00 0.00 58.87 57.17 2rpp n SER 69 Cb 0.53 -0.31 -0.09 0.00 -0.75 0.00 0.00 64.21 63.59 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 -3.50 0.00 0.11 -1.46 1.74 -1.26 -4.81 116.66 107.48 2rpp n ARG 70 Ca -0.13 0.00 -0.07 0.00 -0.77 0.00 0.00 57.85 56.88 2rpp n ARG 70 Cb 0.47 -1.10 -0.04 0.00 -1.02 0.00 0.00 32.46 30.77 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 6.72 -0.39 -1.53 5.56 3.07 -2.06 -2.70 114.58 123.25 2rpp h GLU 71 Ca -0.07 0.03 -0.39 0.00 -0.50 0.00 0.00 59.36 58.43 2rpp h GLU 71 Cb 1.04 0.09 -0.16 0.00 -0.84 0.00 0.00 28.75 28.88 2rpp h GLU 71 CO 0.81 -0.26 0.47 0.27 -1.40 0.00 0.00 179.01 178.90 2rpp n ASN 72 N -3.62 6.61 -4.56 1.42 0.23 -1.26 -4.97 115.26 109.11 2rpp n ASN 72 Ca -0.05 -3.16 -0.62 0.00 -0.53 0.00 0.00 54.58 50.22 2rpp n ASN 72 Cb 0.19 -1.07 -0.10 0.00 -2.08 0.00 0.00 39.78 36.72 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 5.75 1.59 -3.83 0.00 2.85 -1.26 -4.32 118.16 118.93 2rpp n LYS 74 Ca 0.38 -1.21 -0.13 0.00 -1.05 0.00 0.00 58.31 56.31 2rpp n LYS 74 Cb 0.01 -1.47 -0.14 0.00 -0.65 0.00 0.00 35.03 32.78 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 -1.39 -0.04 0.49 5.58 2.02 -1.26 -3.05 117.35 119.70 2rpp s TYR 75 Ca 0.24 0.13 -0.19 0.00 -0.37 0.00 0.00 57.07 56.88 2rpp s TYR 75 Cb 0.19 -0.04 -0.08 0.00 -0.40 0.00 0.00 41.96 41.63 2rpp s TYR 75 CO 0.01 -0.04 1.01 -1.17 -1.57 0.00 0.00 175.55 173.79 2rpp s LEU 76 N 0.28 3.80 -0.59 -1.29 2.96 -1.18 -4.54 118.68 118.12 2rpp s LEU 76 Ca -0.02 1.81 -0.09 0.00 -0.22 0.00 0.00 54.13 55.61 2rpp s LEU 76 Cb -0.03 -4.55 0.15 0.00 0.50 0.00 0.00 46.19 42.27 2rpp s LEU 76 CO -0.01 -0.69 0.47 -1.00 -1.32 0.00 0.00 176.35 173.80 2rpp s HIS 77 N -2.16 3.49 0.58 5.38 3.76 -1.26 -0.80 115.29 124.28 2rpp s HIS 77 Ca 0.64 -2.10 -0.18 0.00 -0.15 0.00 0.00 55.06 53.27 2rpp s HIS 77 Cb -0.14 -3.51 -0.04 0.00 1.11 0.00 0.00 32.58 30.01 2rpp s HIS 77 CO 0.21 -0.96 1.12 -1.25 -0.85 0.00 0.00 174.74 173.02 2rpp s PRO 78 N 0.73 3.17 1.07 8.40 0.04 -1.26 -5.04 135.00 142.12 2rpp s PRO 78 Ca 0.11 1.54 -0.15 0.00 0.04 0.00 0.00 61.00 62.55 2rpp s PRO 78 Cb -0.21 -1.99 0.22 0.00 0.04 0.00 0.00 34.50 32.57 2rpp s PRO 78 CO -0.03 -0.98 1.10 -1.25 0.04 0.00 0.00 177.00 175.88 2rpp s PRO 79 N -3.55 -0.17 0.01 0.56 0.04 -1.26 -4.65 135.00 125.97 2rpp s PRO 79 Ca 0.71 0.32 -0.03 0.00 0.04 0.00 0.00 61.00 62.04 2rpp s PRO 79 Cb -0.23 -1.68 -0.01 0.00 0.04 0.00 0.00 34.50 32.62 2rpp s PRO 79 CO 0.32 -3.09 1.04 1.15 0.04 0.00 0.00 177.00 176.46 2rpp h THR 80 N -2.14 0.00 -0.99 1.26 2.02 -1.96 0.59 112.91 111.69 2rpp h THR 80 Ca -0.52 0.00 0.21 0.00 0.77 0.00 0.00 66.41 66.87 2rpp h THR 80 Cb 1.32 0.00 -0.19 0.00 -1.74 0.00 0.00 68.15 67.55 2rpp h THR 80 CO 0.51 0.00 -0.19 0.00 0.37 0.00 0.00 175.52 176.21 2rpp n HIS 81 N -2.68 0.41 0.19 3.16 -0.00 -1.26 0.23 115.22 115.28 2rpp n HIS 81 Ca -0.01 1.21 0.03 0.00 -0.00 0.00 0.00 57.72 58.95 2rpp n HIS 81 Cb 0.03 -1.11 0.38 0.00 -0.00 0.00 0.00 29.99 29.29 2rpp n HIS 81 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.34 176.27 2rpp h LEU 82 N 0.00 0.00 -0.25 2.39 3.38 -1.80 -2.89 115.31 116.14 2rpp h LEU 82 Ca 0.50 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 58.34 2rpp h LEU 82 Cb 0.83 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.58 2rpp h LEU 82 CO -1.00 0.35 -0.38 0.50 0.09 0.00 0.00 178.44 178.00 2rpp h LYS 83 N 0.00 0.69 -0.80 1.13 3.64 0.86 -3.15 116.57 118.95 2rpp h LYS 83 Ca -0.00 -0.41 0.02 0.00 -1.27 0.00 0.00 60.65 58.98 2rpp h LYS 83 Cb 0.62 0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 32.44 2rpp h LYS 83 CO 0.05 1.03 0.53 1.15 -2.27 0.00 0.00 179.45 179.93 2rpp h THR 84 N 0.41 1.18 0.00 1.00 2.02 -0.51 -0.63 112.91 116.39 2rpp h THR 84 Ca 0.02 -0.36 -0.00 0.00 0.77 0.00 0.00 66.41 66.84 2rpp h THR 84 Cb 0.97 0.04 -0.00 0.00 -1.74 0.00 0.00 68.15 67.42 2rpp h THR 84 CO 0.09 0.19 -0.01 1.56 0.37 0.00 0.00 175.52 177.72 2rpp h GLN 85 N 1.05 0.00 0.00 6.66 4.20 -1.47 -2.55 115.11 123.00 2rpp h GLN 85 Ca 0.30 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 59.01 2rpp h GLN 85 Cb -0.07 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.71 2rpp h GLN 85 CO -0.07 0.01 -0.00 -0.07 -0.67 0.00 0.00 178.83 178.03 2rpp h LEU 86 N 0.00 -0.00 -1.37 1.46 3.38 -1.15 -3.32 115.31 114.30 2rpp h LEU 86 Ca -0.00 -0.17 0.28 0.00 0.09 0.00 0.00 57.88 58.07 2rpp h LEU 86 Cb 0.08 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 40.73 2rpp h LEU 86 CO 0.00 0.58 0.68 1.05 0.09 0.00 0.00 178.44 180.84 2rpp h GLU 87 N -1.00 0.36 -1.00 1.13 4.11 -1.35 0.28 114.58 117.11 2rpp h GLU 87 Ca -0.00 -0.02 0.08 0.00 0.07 0.00 0.00 59.36 59.48 2rpp h GLU 87 Cb 0.18 -0.08 -0.07 0.00 0.50 0.00 0.00 28.75 29.27 2rpp h GLU 87 CO 0.00 0.24 0.65 0.82 0.07 0.00 0.00 179.01 180.79 2rpp h ILE 88 N 0.37 1.06 -5.04 -1.06 2.04 -1.57 -3.46 117.51 109.85 2rpp h ILE 88 Ca 0.61 -0.39 -0.29 0.00 1.00 0.00 0.00 64.86 65.78 2rpp h ILE 88 Cb 1.57 -0.19 0.13 0.00 -0.74 0.00 0.00 36.82 37.59 2rpp h ILE 88 CO -0.30 0.21 -0.61 0.59 0.00 0.00 0.00 178.15 178.03 2rpp n ASN 89 N -4.52 -3.27 -4.54 1.72 3.02 0.99 -5.00 115.26 103.65 2rpp n ASN 89 Ca 0.16 -0.49 -0.35 0.00 -0.03 0.00 0.00 54.58 53.87 2rpp n ASN 89 Cb 0.21 -4.33 -0.11 0.00 -0.61 0.00 0.00 39.78 34.95 2rpp n ASN 89 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2rpp s SER 90 N -3.84 5.24 0.06 6.41 1.04 -1.26 -5.10 113.70 116.25 2rpp s SER 90 Ca 0.17 -0.06 0.01 0.00 0.48 0.00 0.00 55.95 56.55 2rpp s SER 90 Cb -0.07 -1.90 -0.03 0.00 0.10 0.00 0.00 66.02 64.12 2rpp s SER 90 CO 0.61 0.12 -0.06 -0.83 0.98 0.00 0.00 173.24 174.06 2rpp s GLY 91 N 0.67 0.55 0.45 7.32 0.00 -1.26 -5.08 107.32 109.97 2rpp s GLY 91 Ca 0.02 -1.00 -0.23 0.00 0.00 0.00 0.00 44.72 43.50 2rpp s GLY 91 CO 0.02 -1.08 1.17 2.56 0.00 0.00 0.00 173.10 175.77 2rpp s PRO 92 N -2.64 3.81 0.01 2.90 0.04 -1.26 -5.05 135.00 132.81 2rpp s PRO 92 Ca -0.01 1.79 -0.28 0.00 0.04 0.00 0.00 61.00 62.54 2rpp s PRO 92 Cb -0.02 -2.46 0.07 0.00 0.04 0.00 0.00 34.50 32.13 2rpp s PRO 92 CO -0.03 -0.51 0.68 0.45 0.04 0.00 0.00 177.00 177.62 2rpp s SER 93 N -1.31 -0.61 -0.14 6.66 0.15 -1.26 -5.15 113.70 112.04 2rpp s SER 93 Ca 0.62 0.46 -0.03 0.00 0.70 0.00 0.00 55.95 57.71 2rpp s SER 93 Cb -0.29 0.54 0.05 0.00 -1.71 0.00 0.00 66.02 64.61 2rpp s SER 93 CO 0.36 -0.71 0.04 -0.55 1.20 0.00 0.00 173.24 173.58 2rpp s SER 94 N -1.70 2.29 0.00 5.45 0.15 -1.26 -5.35 113.70 113.27 2rpp s SER 94 Ca -0.06 -0.51 0.00 0.00 0.70 0.00 0.00 55.95 56.08 2rpp s SER 94 Cb -0.00 -0.44 0.00 0.00 -1.71 0.00 0.00 66.02 63.87 2rpp s SER 94 CO 0.02 -0.28 0.00 0.61 1.20 0.00 0.00 173.24 174.79