#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fpe n SER 0 N 0.00 0.39 -4.03 1.61 3.41 -1.26 -4.98 113.62 108.76 2fpe n SER 0 Ca 0.00 -1.11 -0.31 0.00 -0.26 0.00 0.00 58.87 57.19 2fpe n SER 0 Cb 0.00 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 63.80 2fpe n SER 0 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2fpe s GLU 1 N -0.11 1.58 0.43 4.33 2.02 -1.26 -5.10 118.70 120.60 2fpe s GLU 1 Ca 0.00 -1.80 -0.25 0.00 0.02 0.00 0.00 54.97 52.94 2fpe s GLU 1 Cb 0.00 -3.16 -0.09 0.00 0.10 0.00 0.00 34.13 30.97 2fpe s GLU 1 CO 0.00 -0.89 1.25 0.00 0.02 0.00 0.00 175.26 175.64 2fpe n GLN 2 N 4.28 1.86 -0.05 1.61 0.00 -1.26 -4.92 117.38 118.89 2fpe n GLN 2 Ca 0.01 0.66 0.00 0.00 0.00 0.00 0.00 57.00 57.68 2fpe n GLN 2 Cb 0.42 -2.37 -0.16 0.00 0.00 0.00 0.00 30.24 28.13 2fpe n GLN 2 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.06 177.31 2fpe n THR 3 N -0.30 0.72 -4.15 -0.39 -2.24 0.48 -4.79 114.28 103.62 2fpe n THR 3 Ca 0.07 -0.68 -0.12 0.00 -2.27 0.00 0.00 64.05 61.05 2fpe n THR 3 Cb 0.40 -0.24 -0.08 0.00 -2.10 0.00 0.00 70.33 68.30 2fpe n THR 3 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2fpe s HIS 4 N -2.99 0.99 -0.03 4.78 3.76 -0.86 -0.68 115.29 120.26 2fpe s HIS 4 Ca -0.09 -1.23 -0.01 0.00 -0.15 0.00 0.00 55.06 53.58 2fpe s HIS 4 Cb 0.10 -0.34 0.03 0.00 1.11 0.00 0.00 32.58 33.47 2fpe s HIS 4 CO 0.87 -0.79 0.07 0.50 -0.85 0.00 0.00 174.74 174.54 2fpe s ARG 5 N -3.99 0.03 0.20 1.40 3.52 -0.15 -0.92 118.95 119.03 2fpe s ARG 5 Ca 0.34 0.22 -0.30 0.00 -0.13 0.00 0.00 55.73 55.86 2fpe s ARG 5 Cb 0.04 -0.15 -0.08 0.00 -1.56 0.00 0.00 34.95 33.19 2fpe s ARG 5 CO 0.13 -0.13 1.26 0.00 -0.81 0.00 0.00 175.30 175.76 2fpe s ALA 6 N 0.83 3.49 -0.34 6.12 0.00 -0.61 -1.40 121.76 129.85 2fpe s ALA 6 Ca -0.07 1.04 0.03 0.00 0.00 0.00 0.00 51.96 52.97 2fpe s ALA 6 Cb -0.09 -3.45 0.01 0.00 0.00 0.00 0.00 23.12 19.58 2fpe s ALA 6 CO -0.03 -0.47 0.45 0.44 0.00 0.00 0.00 175.76 176.15 2fpe n ILE 7 N 2.53 0.00 -4.01 0.00 -5.35 -0.20 -0.44 119.36 111.89 2fpe n ILE 7 Ca 0.05 -0.48 -0.11 0.00 -0.27 0.00 0.00 62.75 61.94 2fpe n ILE 7 Cb 0.44 1.05 -0.12 0.00 -1.74 0.00 0.00 39.64 39.27 2fpe n ILE 7 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 2fpe s PHE 8 N -0.61 0.37 0.20 4.28 0.08 -1.24 -4.87 117.98 116.18 2fpe s PHE 8 Ca 0.03 -0.41 -0.30 0.00 0.12 0.00 0.00 56.93 56.37 2fpe s PHE 8 Cb 0.03 -0.24 -0.09 0.00 -0.57 0.00 0.00 43.02 42.15 2fpe s PHE 8 CO 0.07 -0.12 1.25 0.50 -0.10 0.00 0.00 175.22 176.82 2fpe s ARG 9 N -1.19 4.44 -0.09 0.44 6.06 -1.26 -4.42 118.95 122.93 2fpe s ARG 9 Ca -0.11 1.97 -0.02 0.00 -2.50 0.00 0.00 55.73 55.07 2fpe s ARG 9 Cb -0.08 -3.21 0.04 0.00 0.06 0.00 0.00 34.95 31.76 2fpe s ARG 9 CO -0.00 -0.16 0.03 0.12 -2.50 0.00 0.00 175.30 172.79 2fpe s PHE 10 N -0.07 0.46 -0.31 5.12 5.36 -0.03 -4.96 117.98 123.54 2fpe s PHE 10 Ca 0.54 -0.13 -0.05 0.00 -0.96 0.00 0.00 56.93 56.33 2fpe s PHE 10 Cb -0.35 -0.71 0.03 0.00 -0.34 0.00 0.00 43.02 41.65 2fpe s PHE 10 CO 0.38 -0.34 0.05 0.08 -1.46 0.00 0.00 175.22 173.93 2fpe s VAL 11 N 2.04 3.51 0.45 3.12 1.01 -1.26 -0.48 120.40 128.79 2fpe s VAL 11 Ca 0.04 -1.08 -0.23 0.00 0.00 0.00 0.00 61.98 60.71 2fpe s VAL 11 Cb -0.13 -2.93 -0.10 0.00 0.00 0.00 0.00 36.38 33.22 2fpe s VAL 11 CO -0.05 -0.05 0.94 -2.65 0.00 0.00 0.00 175.10 173.28 2fpe n PRO 12 N 4.76 1.18 0.00 2.72 -0.02 -1.26 -4.91 135.00 137.47 2fpe n PRO 12 Ca -0.14 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 61.77 2fpe n PRO 12 Cb 0.45 -1.99 0.00 0.00 -0.02 0.00 0.00 33.50 31.94 2fpe n PRO 12 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2fpe n ARG 13 N 0.02 5.04 -4.31 -0.52 1.74 -1.26 -5.04 116.66 112.33 2fpe n ARG 13 Ca 0.10 0.00 -0.24 0.00 -0.77 0.00 0.00 57.85 56.94 2fpe n ARG 13 Cb 0.41 -0.55 -0.12 0.00 -1.02 0.00 0.00 32.46 31.17 2fpe n ARG 13 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 2fpe s HIS 14 N -1.08 1.85 0.61 -1.55 3.76 -1.26 -5.06 115.29 112.56 2fpe s HIS 14 Ca 0.00 -0.42 0.33 0.00 -0.15 0.00 0.00 55.06 54.81 2fpe s HIS 14 Cb 0.00 -1.00 1.92 0.00 1.11 0.00 0.00 32.58 34.62 2fpe s HIS 14 CO 0.00 0.25 2.25 0.93 -0.85 0.00 0.00 174.74 177.32 2fpe h GLU 15 N 3.90 0.00 -0.01 1.40 5.08 -2.03 -2.65 114.58 120.28 2fpe h GLU 15 Ca -0.46 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.90 2fpe h GLU 15 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 2fpe h GLU 15 CO 0.42 0.00 -0.38 -0.40 -1.00 0.00 0.00 179.01 177.65 2fpe n ASP 16 N -3.67 1.23 -4.83 1.42 5.75 -1.26 -4.96 116.55 110.23 2fpe n ASP 16 Ca -0.02 -1.00 -0.33 0.00 -0.01 0.00 0.00 54.79 53.43 2fpe n ASP 16 Cb 0.12 0.28 -0.07 0.00 -1.03 0.00 0.00 41.12 40.42 2fpe n ASP 16 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 2fpe s GLU 17 N -2.57 4.13 -0.25 0.11 2.02 -1.00 -0.39 118.70 120.76 2fpe s GLU 17 Ca 0.21 0.93 -0.09 0.00 0.02 0.00 0.00 54.97 56.03 2fpe s GLU 17 Cb 0.19 -2.28 -0.04 0.00 0.10 0.00 0.00 34.13 32.09 2fpe s GLU 17 CO 0.57 0.04 0.13 -1.17 0.02 0.00 0.00 175.26 174.85 2fpe s LEU 18 N -3.13 3.88 0.23 1.80 2.96 0.70 -4.55 118.68 120.58 2fpe s LEU 18 Ca 0.59 -0.00 -0.30 0.00 -0.22 0.00 0.00 54.13 54.20 2fpe s LEU 18 Cb -0.09 -2.05 -0.09 0.00 0.50 0.00 0.00 46.19 44.46 2fpe s LEU 18 CO 0.15 0.02 1.27 -0.70 -1.32 0.00 0.00 176.35 175.77 2fpe s GLU 19 N 1.29 4.43 0.02 1.98 2.12 -1.26 -4.76 118.70 122.51 2fpe s GLU 19 Ca 0.06 2.03 0.05 0.00 0.36 0.00 0.00 54.97 57.47 2fpe s GLU 19 Cb -0.14 -3.17 -0.02 0.00 0.26 0.00 0.00 34.13 31.05 2fpe s GLU 19 CO 0.06 -0.16 -0.14 -0.51 -0.54 0.00 0.00 175.26 173.97 2fpe s LEU 20 N -0.64 2.11 0.02 2.70 1.43 0.37 -4.97 118.68 119.70 2fpe s LEU 20 Ca 0.53 -0.37 0.06 0.00 -1.03 0.00 0.00 54.13 53.32 2fpe s LEU 20 Cb -0.36 -0.66 -0.02 0.00 0.03 0.00 0.00 46.19 45.18 2fpe s LEU 20 CO 0.41 0.09 -0.17 -1.61 0.23 0.00 0.00 176.35 175.30 2fpe s GLU 21 N -0.79 1.24 0.16 1.70 2.02 -1.26 -0.85 118.70 120.92 2fpe s GLU 21 Ca 0.03 -0.78 -0.33 0.00 0.02 0.00 0.00 54.97 53.91 2fpe s GLU 21 Cb -0.07 -1.27 -0.16 0.00 0.10 0.00 0.00 34.13 32.73 2fpe s GLU 21 CO 0.00 0.33 1.25 0.28 0.02 0.00 0.00 175.26 177.15 2fpe n VAL 22 N 2.13 0.66 -0.96 2.63 0.31 -1.26 -1.56 118.33 120.28 2fpe n VAL 22 Ca -0.17 -0.17 0.00 0.00 -0.01 0.00 0.00 64.34 64.00 2fpe n VAL 22 Cb 0.54 -0.95 0.00 0.00 -0.91 0.00 0.00 33.84 32.52 2fpe n VAL 22 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 2fpe n ASP 23 N 2.21 -1.76 -4.71 4.52 2.03 0.41 -5.01 116.55 114.25 2fpe n ASP 23 Ca 0.15 0.00 -0.42 0.00 0.52 0.00 0.00 54.79 55.04 2fpe n ASP 23 Cb 0.24 -0.29 -0.03 0.00 -0.72 0.00 0.00 41.12 40.32 2fpe n ASP 23 CO 0.00 0.00 0.00 -1.81 -1.92 0.00 0.00 177.20 173.47 2fpe s ASP 24 N -2.39 6.63 0.03 1.67 1.01 -0.60 -4.73 116.67 118.29 2fpe s ASP 24 Ca 0.00 2.54 -0.30 0.00 0.71 0.00 0.00 52.55 55.50 2fpe s ASP 24 Cb 0.00 -2.59 -0.05 0.00 1.01 0.00 0.00 42.92 41.30 2fpe s ASP 24 CO 0.00 -0.80 1.16 -2.84 0.21 0.00 0.00 175.17 172.90 2fpe s PRO 25 N 1.33 4.44 0.14 8.23 0.02 -1.26 -1.58 135.00 146.32 2fpe s PRO 25 Ca 0.69 1.69 0.08 0.00 0.02 0.00 0.00 61.00 63.48 2fpe s PRO 25 Cb -0.42 -3.41 -0.04 0.00 0.02 0.00 0.00 34.50 30.65 2fpe s PRO 25 CO 0.31 -0.26 -0.17 -0.51 -0.33 0.00 0.00 177.00 176.04 2fpe s LEU 26 N 1.29 2.40 -0.33 -5.54 1.43 -0.10 -4.24 118.68 113.59 2fpe s LEU 26 Ca 0.57 -0.82 0.04 0.00 -1.03 0.00 0.00 54.13 52.89 2fpe s LEU 26 Cb -0.27 -0.75 0.10 0.00 0.03 0.00 0.00 46.19 45.29 2fpe s LEU 26 CO 0.27 -0.05 0.03 -0.76 0.23 0.00 0.00 176.35 176.08 2fpe s LEU 27 N -2.47 4.62 -0.30 1.79 1.43 -0.66 -0.39 118.68 122.71 2fpe s LEU 27 Ca 0.12 -2.07 -0.26 0.00 -1.03 0.00 0.00 54.13 50.89 2fpe s LEU 27 Cb -0.06 -1.62 0.01 0.00 0.03 0.00 0.00 46.19 44.54 2fpe s LEU 27 CO 0.05 -0.36 0.92 -0.69 0.23 0.00 0.00 176.35 176.50 2fpe s VAL 28 N 0.93 4.69 -0.13 -1.59 1.01 -1.26 -1.58 120.40 122.46 2fpe s VAL 28 Ca 0.09 1.50 0.18 0.00 0.00 0.00 0.00 61.98 63.75 2fpe s VAL 28 Cb -0.19 -4.26 -0.17 0.00 0.00 0.00 0.00 36.38 31.77 2fpe s VAL 28 CO -0.08 -0.31 0.69 -0.62 0.00 0.00 0.00 175.10 174.79 2fpe n GLU 29 N 6.43 0.63 -3.68 2.72 1.02 -0.45 -4.91 120.64 122.40 2fpe n GLU 29 Ca 0.08 0.12 -0.10 0.00 -0.02 0.00 0.00 57.16 57.23 2fpe n GLU 29 Cb 0.47 -1.73 -0.11 0.00 -0.02 0.00 0.00 31.44 30.06 2fpe n GLU 29 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 2fpe s LEU 30 N -5.51 -0.24 -0.56 -4.62 2.96 -1.04 -5.01 118.68 104.66 2fpe s LEU 30 Ca -0.04 0.84 -0.09 0.00 -0.22 0.00 0.00 54.13 54.62 2fpe s LEU 30 Cb 0.09 1.19 0.14 0.00 0.50 0.00 0.00 46.19 48.11 2fpe s LEU 30 CO 0.83 -0.21 0.43 -1.10 -1.32 0.00 0.00 176.35 174.98 2fpe s GLN 31 N 1.91 2.68 0.68 1.98 -0.21 -1.26 -0.26 119.66 125.17 2fpe s GLN 31 Ca -0.06 -2.02 -0.14 0.00 0.02 0.00 0.00 55.36 53.16 2fpe s GLN 31 Cb -0.10 -3.97 0.01 0.00 1.00 0.00 0.00 33.01 29.94 2fpe s GLN 31 CO -0.12 -1.21 1.11 0.00 -2.12 0.00 0.00 175.29 172.96 2fpe s ALA 32 N 0.91 2.42 0.39 6.09 0.00 -0.85 -4.95 121.76 125.77 2fpe s ALA 32 Ca 0.10 0.53 0.26 0.00 0.00 0.00 0.00 51.96 52.85 2fpe s ALA 32 Cb -0.23 -3.32 1.35 0.00 0.00 0.00 0.00 23.12 20.92 2fpe s ALA 32 CO -0.02 -1.38 2.04 1.05 0.00 0.00 0.00 175.76 177.44 2fpe h GLU 33 N -0.14 0.00 -0.65 0.00 -0.00 -1.98 -2.42 114.58 109.39 2fpe h GLU 33 Ca -0.46 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 58.90 2fpe h GLU 33 Cb 1.25 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 30.00 2fpe h GLU 33 CO 0.53 0.14 0.00 -0.40 -0.00 0.00 0.00 179.01 179.28 2fpe n ASP 34 N -3.68 2.20 -2.38 3.06 5.75 -1.26 -4.89 116.55 115.35 2fpe n ASP 34 Ca -0.02 -2.21 -0.17 0.00 -0.01 0.00 0.00 54.79 52.39 2fpe n ASP 34 Cb 0.26 -0.43 0.03 0.00 -1.03 0.00 0.00 41.12 39.95 2fpe n ASP 34 CO 0.00 0.00 0.00 -1.22 -0.11 0.00 0.00 177.20 175.87 2fpe n TYR 35 N 0.23 -1.59 -5.04 2.11 0.53 -0.91 -5.00 117.16 107.49 2fpe n TYR 35 Ca 0.09 0.46 -0.30 0.00 -1.02 0.00 0.00 57.90 57.14 2fpe n TYR 35 Cb 0.45 -3.66 -0.17 0.00 -1.03 0.00 0.00 39.34 34.93 2fpe n TYR 35 CO 0.00 0.00 0.00 -1.58 -1.02 0.00 0.00 176.86 174.26 2fpe s TRP 36 N -3.06 2.20 -0.01 -0.72 0.52 -1.26 -1.39 118.94 115.22 2fpe s TRP 36 Ca 0.27 -0.83 -0.06 0.00 0.02 0.00 0.00 56.10 55.50 2fpe s TRP 36 Cb -0.12 -1.49 -0.04 0.00 -1.15 0.00 0.00 33.47 30.67 2fpe s TRP 36 CO 0.33 -0.33 0.23 0.71 0.02 0.00 0.00 176.95 177.91 2fpe s TYR 37 N 0.32 3.57 -0.18 -1.98 1.51 0.48 -2.00 117.35 119.07 2fpe s TYR 37 Ca -0.14 0.51 -0.04 0.00 -1.01 0.00 0.00 57.07 56.39 2fpe s TYR 37 Cb -0.16 -1.94 -0.02 0.00 -0.11 0.00 0.00 41.96 39.72 2fpe s TYR 37 CO 0.06 0.64 -0.03 -1.21 -1.11 0.00 0.00 175.55 173.90 2fpe s GLU 38 N -1.72 3.59 0.30 -0.62 2.02 0.64 -0.63 118.70 122.27 2fpe s GLU 38 Ca 0.26 -0.54 -0.10 0.00 0.02 0.00 0.00 54.97 54.60 2fpe s GLU 38 Cb -0.13 -2.99 0.01 0.00 0.10 0.00 0.00 34.13 31.12 2fpe s GLU 38 CO 0.15 0.07 0.53 0.00 0.02 0.00 0.00 175.26 176.03 2fpe s ALA 39 N 0.81 -0.02 -0.19 5.21 0.00 0.79 -1.35 121.76 127.02 2fpe s ALA 39 Ca -0.01 -1.05 -0.03 0.00 0.00 0.00 0.00 51.96 50.88 2fpe s ALA 39 Cb -0.14 1.04 -0.01 0.00 0.00 0.00 0.00 23.12 24.00 2fpe s ALA 39 CO 0.02 -0.86 -0.07 -0.47 0.00 0.00 0.00 175.76 174.38 2fpe s TYR 40 N -3.48 2.92 0.16 0.00 5.04 -0.62 -1.40 117.35 119.98 2fpe s TYR 40 Ca 0.24 -0.83 -0.01 0.00 -2.44 0.00 0.00 57.07 54.02 2fpe s TYR 40 Cb -0.01 -2.01 0.04 0.00 0.35 0.00 0.00 41.96 40.32 2fpe s TYR 40 CO 0.13 -0.42 0.22 -1.71 -1.34 0.00 0.00 175.55 172.43 2fpe n ASN 41 N 4.32 0.15 0.00 4.32 2.85 0.42 -1.65 115.26 125.67 2fpe n ASN 41 Ca -0.18 -1.16 0.00 0.00 -0.11 0.00 0.00 54.58 53.12 2fpe n ASN 41 Cb 0.51 -0.16 0.00 0.00 1.24 0.00 0.00 39.78 41.38 2fpe n ASN 41 CO 0.00 0.00 0.00 -1.14 -2.11 0.00 0.00 177.26 174.01 2fpe n ARG 43 N -1.45 0.00 0.01 1.20 0.63 -1.26 0.87 116.66 116.67 2fpe n ARG 43 Ca 0.03 0.00 -0.05 0.00 -0.92 0.00 0.00 57.85 56.91 2fpe n ARG 43 Cb 0.11 0.00 -0.11 0.00 0.45 0.00 0.00 32.46 32.91 2fpe n ARG 43 CO 0.00 0.00 0.00 1.79 -2.51 0.00 0.00 177.63 176.91 2fpe h THR 44 N 0.00 0.88 0.00 5.15 1.35 -1.96 -3.48 112.91 114.85 2fpe h THR 44 Ca 0.00 -2.59 0.00 0.00 -0.55 0.00 0.00 66.41 63.27 2fpe h THR 44 Cb 0.00 2.38 0.00 0.00 -1.73 0.00 0.00 68.15 68.80 2fpe h THR 44 CO 0.00 0.50 0.00 0.61 -0.25 0.00 0.00 175.52 176.38 2fpe n GLY 45 N 1.46 0.74 3.91 5.82 0.00 0.25 -5.04 105.19 112.34 2fpe n GLY 45 Ca -0.11 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.63 2fpe n GLY 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fpe s ALA 46 N -2.67 3.39 0.09 4.61 0.00 -1.23 -4.81 121.76 121.14 2fpe s ALA 46 Ca 0.00 -0.53 0.08 0.00 0.00 0.00 0.00 51.96 51.51 2fpe s ALA 46 Cb 0.00 -2.59 -0.03 0.00 0.00 0.00 0.00 23.12 20.49 2fpe s ALA 46 CO 0.00 -0.41 -0.20 1.03 0.00 0.00 0.00 175.76 176.18 2fpe s ARG 47 N -4.78 1.11 0.00 0.00 0.52 -1.26 -0.44 118.95 114.10 2fpe s ARG 47 Ca 0.48 -1.11 0.00 0.00 -0.52 0.00 0.00 55.73 54.58 2fpe s ARG 47 Cb -0.10 -1.33 0.00 0.00 0.52 0.00 0.00 34.95 34.04 2fpe s ARG 47 CO 0.45 0.31 0.00 0.41 0.02 0.00 0.00 175.30 176.49 2fpe n GLY 48 N 1.20 -1.73 3.72 -3.53 0.00 -0.49 -4.65 105.19 99.69 2fpe n GLY 48 Ca -0.19 -1.12 -0.25 0.00 0.00 0.00 0.00 46.02 44.46 2fpe n GLY 48 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2fpe s VAL 49 N -2.51 3.98 0.16 1.61 -7.23 0.48 -0.15 120.40 116.76 2fpe s VAL 49 Ca 0.00 -1.44 -0.15 0.00 -1.81 0.00 0.00 61.98 58.59 2fpe s VAL 49 Cb 0.00 -3.06 0.02 0.00 0.56 0.00 0.00 36.38 33.90 2fpe s VAL 49 CO 0.00 -0.21 0.42 0.72 -0.31 0.00 0.00 175.10 175.72 2fpe s PHE 50 N -1.93 -0.02 0.10 2.82 -0.12 0.19 -0.22 117.98 118.82 2fpe s PHE 50 Ca 0.30 -0.33 -0.31 0.00 -0.05 0.00 0.00 56.93 56.54 2fpe s PHE 50 Cb -0.09 0.23 -0.09 0.00 -0.63 0.00 0.00 43.02 42.45 2fpe s PHE 50 CO 0.21 -0.79 1.67 -2.14 -0.05 0.00 0.00 175.22 174.11 2fpe s PRO 51 N -3.87 4.19 0.31 1.99 0.02 -1.26 -0.39 135.00 135.99 2fpe s PRO 51 Ca 0.09 2.39 0.09 0.00 0.02 0.00 0.00 61.00 63.59 2fpe s PRO 51 Cb 0.01 -3.48 0.89 0.00 0.02 0.00 0.00 34.50 31.93 2fpe s PRO 51 CO -0.05 -0.72 1.69 0.00 -0.33 0.00 0.00 177.00 177.58 2fpe h ALA 52 N 7.99 1.69 0.00 -1.55 0.00 -1.56 -0.66 119.26 125.16 2fpe h ALA 52 Ca -0.43 0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.64 2fpe h ALA 52 Cb 1.20 0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.12 2fpe h ALA 52 CO 0.93 -0.40 0.00 0.66 0.00 0.00 0.00 179.25 180.44 2fpe n TYR 53 N -5.01 0.00 1.06 0.00 4.01 -1.26 -3.16 117.16 112.79 2fpe n TYR 53 Ca 0.27 0.00 0.10 0.00 -0.16 0.00 0.00 57.90 58.11 2fpe n TYR 53 Cb 0.79 0.00 0.33 0.00 -0.31 0.00 0.00 39.34 40.15 2fpe n TYR 53 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 2fpe n TYR 54 N -0.84 0.28 -3.88 -0.72 4.02 -0.25 -4.91 117.16 110.85 2fpe n TYR 54 Ca 0.11 -0.14 -0.10 0.00 -0.01 0.00 0.00 57.90 57.76 2fpe n TYR 54 Cb 0.05 0.00 -0.09 0.00 -0.02 0.00 0.00 39.34 39.28 2fpe n TYR 54 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2fpe s ALA 55 N -1.72 -0.23 0.09 -0.72 0.00 -1.19 -1.03 121.76 116.95 2fpe s ALA 55 Ca 0.32 -0.39 0.10 0.00 0.00 0.00 0.00 51.96 51.98 2fpe s ALA 55 Cb 0.18 0.26 -0.03 0.00 0.00 0.00 0.00 23.12 23.52 2fpe s ALA 55 CO 0.26 -0.34 -0.24 0.96 0.00 0.00 0.00 175.76 176.40 2fpe s ILE 56 N -2.54 2.37 0.05 0.00 -5.25 -0.49 -4.92 121.20 110.43 2fpe s ILE 56 Ca -0.05 -1.51 -0.29 0.00 -0.99 0.00 0.00 60.65 57.80 2fpe s ILE 56 Cb -0.01 -2.01 -0.05 0.00 2.95 0.00 0.00 42.46 43.34 2fpe s ILE 56 CO -0.04 0.22 0.94 -0.70 -1.79 0.00 0.00 174.94 173.57 2fpe s GLU 57 N -1.69 4.61 0.00 0.37 2.12 -1.26 -0.98 118.70 121.87 2fpe s GLU 57 Ca 0.14 1.37 0.08 0.00 0.36 0.00 0.00 54.97 56.92 2fpe s GLU 57 Cb -0.10 -3.41 0.06 0.00 0.26 0.00 0.00 34.13 30.94 2fpe s GLU 57 CO 0.05 0.11 0.75 1.33 -0.54 0.00 0.00 175.26 176.96