#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1efi n PRO 2 N 0.00 0.95 0.00 0.00 -0.02 -1.26 -4.93 135.00 129.74 1efi n PRO 2 Ca 0.00 0.36 0.04 0.00 -2.02 0.00 0.00 63.50 61.88 1efi n PRO 2 Cb 0.00 -2.04 -0.02 0.00 -0.02 0.00 0.00 33.50 31.41 1efi n PRO 2 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1efi n GLN 3 N -0.51 3.00 -3.99 -0.52 6.02 -1.26 -4.98 117.38 115.15 1efi n GLN 3 Ca 0.12 -0.32 -0.10 0.00 -0.01 0.00 0.00 57.00 56.70 1efi n GLN 3 Cb 0.45 -1.00 -0.07 0.00 1.02 0.00 0.00 30.24 30.64 1efi n GLN 3 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 1efi s THR 4 N -1.56 0.05 0.27 5.09 -4.23 -1.26 -5.04 115.64 108.97 1efi s THR 4 Ca 0.06 -1.45 -0.02 0.00 -1.18 0.00 0.00 61.69 59.10 1efi s THR 4 Cb 0.07 -1.97 0.14 0.00 1.34 0.00 0.00 72.50 72.09 1efi s THR 4 CO 0.30 -0.22 1.80 -0.29 -0.54 0.00 0.00 174.62 175.67 1efi h ILE 5 N 2.50 1.23 -0.69 2.99 2.10 -1.95 -1.81 117.51 121.88 1efi h ILE 5 Ca -0.31 -0.88 -0.08 0.00 1.08 0.00 0.00 64.86 64.67 1efi h ILE 5 Cb 1.23 0.74 -0.03 0.00 -1.09 0.00 0.00 36.82 37.67 1efi h ILE 5 CO 0.47 0.32 0.13 0.74 -1.08 0.00 0.00 178.15 178.72 1efi h THR 6 N 0.78 1.26 -0.37 2.19 2.02 -1.98 0.80 112.91 117.62 1efi h THR 6 Ca 0.17 -1.03 -0.06 0.00 0.77 0.00 0.00 66.41 66.25 1efi h THR 6 Cb 0.35 0.60 -0.01 0.00 -1.74 0.00 0.00 68.15 67.34 1efi h THR 6 CO 0.01 0.39 -0.01 -0.08 0.37 0.00 0.00 175.52 176.20 1efi h GLU 7 N 1.06 0.65 -0.03 6.66 4.81 -1.87 0.15 114.58 126.02 1efi h GLU 7 Ca 0.21 -0.21 -0.13 0.00 -0.13 0.00 0.00 59.36 59.09 1efi h GLU 7 Cb 0.43 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.74 1efi h GLU 7 CO 0.01 0.77 -0.60 1.37 -0.73 0.00 0.00 179.01 179.83 1efi h LEU 8 N 0.47 0.12 -0.78 1.64 8.10 -1.18 -3.00 115.31 120.68 1efi h LEU 8 Ca 0.10 -0.07 -0.08 0.00 0.11 0.00 0.00 57.88 57.94 1efi h LEU 8 Cb 0.48 -0.04 -0.02 0.00 -0.44 0.00 0.00 40.66 40.64 1efi h LEU 8 CO 0.02 0.69 0.01 0.00 -4.11 0.00 0.00 178.44 175.05 1efi n SER 10 N -4.20 0.27 0.16 0.00 7.64 0.46 -1.10 113.62 116.85 1efi n SER 10 Ca 0.03 0.57 0.13 0.00 1.01 0.00 0.00 58.87 60.61 1efi n SER 10 Cb 0.32 -0.63 0.47 0.00 -1.01 0.00 0.00 64.21 63.37 1efi n SER 10 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 1efi h GLU 11 N 0.00 0.00 -6.33 1.43 5.08 -1.43 -3.45 114.58 109.88 1efi h GLU 11 Ca 0.00 0.00 -0.52 0.00 -1.00 0.00 0.00 59.36 57.84 1efi h GLU 11 Cb 0.26 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 1efi h GLU 11 CO 0.00 0.00 -0.26 0.71 -1.00 0.00 0.00 179.01 178.46 1efi s TYR 12 N -3.31 3.48 -0.27 4.33 1.51 -0.26 -5.08 117.35 117.75 1efi s TYR 12 Ca 0.06 0.42 -0.16 0.00 -1.01 0.00 0.00 57.07 56.37 1efi s TYR 12 Cb 0.10 -1.92 -0.03 0.00 -0.11 0.00 0.00 41.96 39.99 1efi s TYR 12 CO 0.51 0.29 0.44 1.03 -1.11 0.00 0.00 175.55 176.71 1efi s ARG 13 N -3.53 4.02 -0.51 -0.62 0.52 -1.26 -4.48 118.95 113.09 1efi s ARG 13 Ca 0.40 0.16 -0.02 0.00 -0.52 0.00 0.00 55.73 55.75 1efi s ARG 13 Cb -0.11 -3.66 0.00 0.00 0.52 0.00 0.00 34.95 31.70 1efi s ARG 13 CO 0.30 -0.33 0.44 0.09 0.02 0.00 0.00 175.30 175.82 1efi n ASN 14 N 5.45 -3.00 -4.40 0.23 5.03 -1.26 -4.93 115.26 112.38 1efi n ASN 14 Ca -0.06 -0.23 -0.20 0.00 0.87 0.00 0.00 54.58 54.96 1efi n ASN 14 Cb 0.50 -2.31 -0.10 0.00 -1.02 0.00 0.00 39.78 36.84 1efi n ASN 14 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 1efi s THR 15 N -3.13 1.23 0.08 3.41 -4.23 -1.26 -0.15 115.64 111.59 1efi s THR 15 Ca 0.13 -2.04 -0.26 0.00 -1.18 0.00 0.00 61.69 58.34 1efi s THR 15 Cb -0.06 -2.53 0.07 0.00 1.34 0.00 0.00 72.50 71.32 1efi s THR 15 CO 0.29 -0.20 0.62 0.00 -0.54 0.00 0.00 174.62 174.79 1efi s GLN 16 N -3.84 1.18 -0.09 3.99 -2.07 -0.16 -4.82 119.66 113.85 1efi s GLN 16 Ca 0.32 -0.19 -0.13 0.00 -1.82 0.00 0.00 55.36 53.54 1efi s GLN 16 Cb 0.06 0.55 -0.05 0.00 -1.09 0.00 0.00 33.01 32.48 1efi s GLN 16 CO 0.12 -0.46 0.32 0.42 -1.32 0.00 0.00 175.29 174.37 1efi s ILE 17 N -2.73 5.23 -0.17 3.63 -1.09 -1.26 -1.31 121.20 123.51 1efi s ILE 17 Ca -0.04 0.62 0.01 0.00 -2.23 0.00 0.00 60.65 59.02 1efi s ILE 17 Cb -0.01 -3.63 0.01 0.00 -1.58 0.00 0.00 42.46 37.25 1efi s ILE 17 CO -0.04 0.50 -0.19 -0.31 -1.23 0.00 0.00 174.94 173.67 1efi s TYR 18 N -0.38 2.76 -0.35 3.97 1.51 -0.34 -4.99 117.35 119.54 1efi s TYR 18 Ca 0.20 -1.38 -0.23 0.00 -1.01 0.00 0.00 57.07 54.64 1efi s TYR 18 Cb -0.14 -1.89 0.01 0.00 -0.11 0.00 0.00 41.96 39.82 1efi s TYR 18 CO 0.08 -0.66 0.77 0.99 -1.11 0.00 0.00 175.55 175.61 1efi s THR 19 N 1.06 4.77 -0.20 -0.71 2.01 -1.26 -1.60 115.64 119.70 1efi s THR 19 Ca -0.01 0.93 -0.16 0.00 0.31 0.00 0.00 61.69 62.76 1efi s THR 19 Cb -0.14 -4.18 -0.11 0.00 0.01 0.00 0.00 72.50 68.08 1efi s THR 19 CO -0.06 -0.37 -0.11 -0.38 -0.69 0.00 0.00 174.62 173.01 1efi n ILE 20 N 5.70 1.50 -4.06 1.82 2.08 0.15 -5.00 119.36 121.55 1efi n ILE 20 Ca 0.03 -0.02 -0.36 0.00 0.56 0.00 0.00 62.75 62.96 1efi n ILE 20 Cb 0.48 -2.15 -0.02 0.00 -0.75 0.00 0.00 39.64 37.21 1efi n ILE 20 CO 0.00 0.00 0.00 -3.20 0.56 0.00 0.00 176.55 173.91 1efi n ASN 21 N -4.44 -2.05 -3.53 4.38 4.05 0.45 -4.94 115.26 109.18 1efi n ASN 21 Ca -0.28 -1.19 -0.08 0.00 0.45 0.00 0.00 54.58 53.48 1efi n ASN 21 Cb 0.59 -2.19 -0.02 0.00 1.23 0.00 0.00 39.78 39.39 1efi n ASN 21 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 1efi s ASP 22 N -3.94 -0.31 0.61 1.20 2.15 -0.90 -4.91 116.67 110.56 1efi s ASP 22 Ca 0.25 0.04 -0.10 0.00 0.43 0.00 0.00 52.55 53.16 1efi s ASP 22 Cb -0.12 0.32 -0.03 0.00 -0.30 0.00 0.00 42.92 42.78 1efi s ASP 22 CO 0.95 -0.50 1.00 -1.59 -0.17 0.00 0.00 175.17 174.86 1efi s LYS 23 N -2.76 3.51 0.15 4.34 -2.85 -1.26 -1.03 119.74 119.85 1efi s LYS 23 Ca 0.05 0.64 -0.30 0.00 -1.00 0.00 0.00 55.97 55.36 1efi s LYS 23 Cb -0.01 -2.12 -0.07 0.00 -2.06 0.00 0.00 37.83 33.57 1efi s LYS 23 CO -0.07 -0.57 1.21 0.42 0.10 0.00 0.00 175.35 176.44 1efi s ILE 24 N -3.14 3.67 -0.11 3.79 1.01 -1.26 -4.74 121.20 120.42 1efi s ILE 24 Ca 0.54 1.34 -0.27 0.00 0.00 0.00 0.00 60.65 62.26 1efi s ILE 24 Cb -0.11 -3.85 -0.23 0.00 0.01 0.00 0.00 42.46 38.27 1efi s ILE 24 CO 0.52 0.18 0.82 0.25 0.00 0.00 0.00 174.94 176.72 1efi h LEU 25 N 5.75 -0.01 -8.10 2.97 5.85 -1.31 -3.48 115.31 116.98 1efi h LEU 25 Ca -0.44 -0.84 -0.15 0.00 0.84 0.00 0.00 57.88 57.29 1efi h LEU 25 Cb 1.21 0.00 -0.19 0.00 0.37 0.00 0.00 40.66 42.06 1efi h LEU 25 CO 0.77 0.87 -0.69 -0.94 -0.34 0.00 0.00 178.44 178.10 1efi s SER 26 N -6.07 0.38 -0.06 1.25 1.04 -1.08 -4.98 113.70 104.18 1efi s SER 26 Ca -0.17 -0.71 0.02 0.00 0.48 0.00 0.00 55.95 55.57 1efi s SER 26 Cb -0.02 0.14 0.02 0.00 0.10 0.00 0.00 66.02 66.25 1efi s SER 26 CO 0.65 -0.42 -0.10 -0.47 0.98 0.00 0.00 173.24 173.88 1efi s TYR 27 N -2.47 1.23 -0.04 5.02 6.14 -1.26 -2.03 117.35 123.94 1efi s TYR 27 Ca -0.06 -0.43 0.04 0.00 0.64 0.00 0.00 57.07 57.25 1efi s TYR 27 Cb -0.03 -0.94 -0.00 0.00 0.42 0.00 0.00 41.96 41.41 1efi s TYR 27 CO -0.05 -0.25 -0.15 0.99 0.64 0.00 0.00 175.55 176.74 1efi s THR 28 N 0.73 1.24 -0.06 4.34 2.01 0.14 -5.00 115.64 119.04 1efi s THR 28 Ca -0.14 -0.61 0.01 0.00 0.31 0.00 0.00 61.69 61.27 1efi s THR 28 Cb -0.15 -1.08 0.02 0.00 0.01 0.00 0.00 72.50 71.30 1efi s THR 28 CO 0.03 0.36 -0.06 -0.70 -0.69 0.00 0.00 174.62 173.56 1efi s GLU 29 N 0.13 1.05 -0.06 4.92 2.12 -1.26 -1.26 118.70 124.34 1efi s GLU 29 Ca -0.04 -0.15 0.06 0.00 0.36 0.00 0.00 54.97 55.19 1efi s GLU 29 Cb -0.11 -1.05 -0.01 0.00 0.26 0.00 0.00 34.13 33.22 1efi s GLU 29 CO 0.02 -0.11 -0.23 0.45 -0.54 0.00 0.00 175.26 174.84 1efi s SER 30 N 1.10 2.88 -0.06 -1.70 0.15 -0.43 -4.98 113.70 110.66 1efi s SER 30 Ca -0.08 -0.48 0.12 0.00 0.70 0.00 0.00 55.95 56.21 1efi s SER 30 Cb -0.14 -0.81 0.35 0.00 -1.71 0.00 0.00 66.02 63.70 1efi s SER 30 CO -0.01 0.22 1.28 1.15 1.20 0.00 0.00 173.24 177.08 1efi n MET 31 N 3.01 2.84 -2.19 5.44 0.00 -1.26 -2.56 117.12 122.41 1efi n MET 31 Ca -0.18 -2.27 -0.40 0.00 0.00 0.00 0.00 57.70 54.85 1efi n MET 31 Cb 0.52 -1.43 -0.02 0.00 0.00 0.00 0.00 33.22 32.29 1efi n MET 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1efi s ALA 32 N -1.64 3.41 0.07 3.17 0.00 -1.26 -4.84 121.76 120.67 1efi s ALA 32 Ca 0.27 1.16 -0.35 0.00 0.00 0.00 0.00 51.96 53.05 1efi s ALA 32 Cb 0.18 -3.44 -0.14 0.00 0.00 0.00 0.00 23.12 19.72 1efi s ALA 32 CO 0.12 -0.57 1.58 0.41 0.00 0.00 0.00 175.76 177.30 1efi n GLY 33 N 0.82 1.01 3.03 0.00 0.00 -1.26 -0.90 105.19 107.89 1efi n GLY 33 Ca 0.01 0.72 0.00 0.00 0.00 0.00 0.00 46.02 46.75 1efi n GLY 33 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1efi n LYS 34 N 3.86 -0.20 -2.57 1.61 5.02 -1.26 -4.79 118.16 119.82 1efi n LYS 34 Ca 0.19 0.05 -0.04 0.00 -2.02 0.00 0.00 58.31 56.49 1efi n LYS 34 Cb 0.26 -3.32 0.05 0.00 -0.02 0.00 0.00 35.03 31.99 1efi n LYS 34 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1efi n ARG 35 N -1.90 1.95 -2.49 1.97 5.12 -0.08 -4.99 116.66 116.24 1efi n ARG 35 Ca 0.00 -3.52 -0.40 0.00 -1.93 0.00 0.00 57.85 52.00 1efi n ARG 35 Cb 0.05 -1.62 -0.03 0.00 -1.16 0.00 0.00 32.46 29.70 1efi n ARG 35 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 1efi s GLU 36 N -3.51 3.37 0.32 5.56 8.01 -1.09 -4.28 118.70 127.07 1efi s GLU 36 Ca 0.32 -0.77 -0.10 0.00 0.01 0.00 0.00 54.97 54.42 1efi s GLU 36 Cb 0.34 -5.01 0.01 0.00 -4.31 0.00 0.00 34.13 25.17 1efi s GLU 36 CO -0.03 -2.32 0.57 0.00 0.01 0.00 0.00 175.26 173.49 1efi s MET 37 N 5.42 1.86 -0.02 1.61 0.23 -1.06 -4.11 119.30 123.24 1efi s MET 37 Ca 0.46 -1.46 0.04 0.00 -1.03 0.00 0.00 55.69 53.71 1efi s MET 37 Cb -0.03 0.51 -0.01 0.00 -1.53 0.00 0.00 34.83 33.77 1efi s MET 37 CO -0.02 -0.81 -0.15 0.08 -2.03 0.00 0.00 175.02 172.10 1efi s VAL 38 N -3.25 1.18 -0.05 5.16 1.01 -1.22 -1.31 120.40 121.92 1efi s VAL 38 Ca 0.23 -0.62 0.03 0.00 0.00 0.00 0.00 61.98 61.62 1efi s VAL 38 Cb -0.02 -1.00 0.00 0.00 0.00 0.00 0.00 36.38 35.37 1efi s VAL 38 CO 0.13 0.34 -0.14 -0.63 0.00 0.00 0.00 175.10 174.80 1efi s ILE 39 N -0.22 1.25 0.13 2.22 1.01 -0.39 -1.46 121.20 123.74 1efi s ILE 39 Ca 0.03 -0.58 0.08 0.00 0.00 0.00 0.00 60.65 60.17 1efi s ILE 39 Cb -0.07 -1.10 -0.04 0.00 0.01 0.00 0.00 42.46 41.26 1efi s ILE 39 CO 0.00 0.37 -0.18 0.27 0.00 0.00 0.00 174.94 175.40 1efi s ILE 40 N 0.31 1.62 0.11 2.92 -4.36 0.02 -0.69 121.20 121.13 1efi s ILE 40 Ca -0.08 -1.70 0.03 0.00 -0.26 0.00 0.00 60.65 58.63 1efi s ILE 40 Cb -0.13 -1.62 -0.04 0.00 1.25 0.00 0.00 42.46 41.92 1efi s ILE 40 CO 0.03 -0.24 -0.08 0.42 0.24 0.00 0.00 174.94 175.31 1efi s THR 41 N -1.70 0.81 0.23 8.37 -4.23 -0.86 -0.97 115.64 117.29 1efi s THR 41 Ca 0.10 -1.91 0.09 0.00 -1.18 0.00 0.00 61.69 58.79 1efi s THR 41 Cb -0.07 -1.65 -0.05 0.00 1.34 0.00 0.00 72.50 72.07 1efi s THR 41 CO 0.05 -0.80 -0.16 -0.36 -0.54 0.00 0.00 174.62 172.81 1efi s PHE 42 N -3.38 1.90 0.59 3.99 0.08 -0.59 -0.80 117.98 119.76 1efi s PHE 42 Ca 0.12 -0.51 0.29 0.00 0.12 0.00 0.00 56.93 56.94 1efi s PHE 42 Cb 0.03 -0.87 1.52 0.00 -0.57 0.00 0.00 43.02 43.13 1efi s PHE 42 CO -0.03 0.46 1.96 -0.22 -0.10 0.00 0.00 175.22 177.29 1efi h LYS 43 N 2.45 0.00 0.00 0.44 3.64 -1.89 0.37 116.57 121.58 1efi h LYS 43 Ca -0.39 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 58.98 1efi h LYS 43 Cb 1.23 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 33.05 1efi h LYS 43 CO 0.62 0.00 -0.06 0.66 -2.27 0.00 0.00 179.45 178.40 1efi h SER 44 N 0.00 0.00 0.00 4.20 4.64 -1.98 -3.45 113.55 116.96 1efi h SER 44 Ca 0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 1efi h SER 44 Cb 0.99 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.08 1efi h SER 44 CO -0.00 0.06 0.00 0.61 -0.87 0.00 0.00 176.83 176.62 1efi n GLY 45 N -0.56 1.85 3.78 -0.77 0.00 0.13 -5.06 105.19 104.55 1efi n GLY 45 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 1efi n GLY 45 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1efi s GLU 46 N -0.78 4.18 -0.02 1.61 2.56 -1.25 -4.75 118.70 120.25 1efi s GLU 46 Ca 0.00 2.46 0.04 0.00 0.00 0.00 0.00 54.97 57.47 1efi s GLU 46 Cb 0.00 -3.00 -0.01 0.00 2.00 0.00 0.00 34.13 33.12 1efi s GLU 46 CO 0.00 -0.43 -0.15 0.99 -0.56 0.00 0.00 175.26 175.12 1efi s THR 47 N -1.12 1.19 0.17 -1.70 2.01 -1.26 -1.55 115.64 113.38 1efi s THR 47 Ca 0.52 -0.62 0.01 0.00 0.31 0.00 0.00 61.69 61.91 1efi s THR 47 Cb -0.44 -1.01 -0.04 0.00 0.01 0.00 0.00 72.50 71.01 1efi s THR 47 CO 0.60 0.34 0.03 -0.36 -0.69 0.00 0.00 174.62 174.55 1efi s PHE 48 N -0.13 1.12 0.13 4.92 0.08 -0.14 -3.65 117.98 120.31 1efi s PHE 48 Ca 0.01 -1.12 -0.02 0.00 0.12 0.00 0.00 56.93 55.93 1efi s PHE 48 Cb -0.08 -0.64 -0.04 0.00 -0.57 0.00 0.00 43.02 41.70 1efi s PHE 48 CO 0.00 -0.34 0.08 1.14 -0.10 0.00 0.00 175.22 176.01 1efi s GLN 49 N -3.98 0.95 -0.28 0.44 -2.07 -0.58 -0.80 119.66 113.35 1efi s GLN 49 Ca 0.25 -1.41 -0.02 0.00 -1.82 0.00 0.00 55.36 52.37 1efi s GLN 49 Cb 0.07 0.26 0.04 0.00 -1.09 0.00 0.00 33.01 32.29 1efi s GLN 49 CO 0.04 -0.28 -0.03 0.08 -1.32 0.00 0.00 175.29 173.79 1efi s VAL 50 N -4.04 2.92 0.79 3.63 1.01 -0.53 -1.03 120.40 123.15 1efi s VAL 50 Ca 0.23 -1.25 -0.14 0.00 0.00 0.00 0.00 61.98 60.82 1efi s VAL 50 Cb 0.07 -2.60 0.06 0.00 0.00 0.00 0.00 36.38 33.91 1efi s VAL 50 CO 0.01 0.02 1.10 -0.62 0.00 0.00 0.00 175.10 175.62 1efi n GLU 51 N 4.63 0.25 -2.06 2.72 1.02 -1.26 -3.37 120.64 122.57 1efi n GLU 51 Ca -0.14 0.16 -0.41 0.00 -0.02 0.00 0.00 57.16 56.74 1efi n GLU 51 Cb 0.45 -2.36 -0.02 0.00 -0.02 0.00 0.00 31.44 29.49 1efi n GLU 51 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1efi s VAL 52 N -2.05 2.63 0.31 2.62 1.01 -1.26 -4.90 120.40 118.76 1efi s VAL 52 Ca 0.73 0.61 -0.29 0.00 0.00 0.00 0.00 61.98 63.02 1efi s VAL 52 Cb -0.30 -3.39 -0.12 0.00 0.00 0.00 0.00 36.38 32.57 1efi s VAL 52 CO 0.51 0.13 1.48 -2.65 0.00 0.00 0.00 175.10 174.57 1efi n PRO 53 N 1.09 2.45 -3.82 2.72 -0.02 -1.26 -4.96 135.00 131.19 1efi n PRO 53 Ca 0.02 0.87 -0.13 0.00 -2.02 0.00 0.00 63.50 62.23 1efi n PRO 53 Cb 0.41 -2.57 -0.02 0.00 -0.02 0.00 0.00 33.50 31.29 1efi n PRO 53 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1efi n GLY 54 N 1.55 2.07 0.33 -1.23 0.00 -1.26 -5.04 105.19 101.60 1efi n GLY 54 Ca 0.07 -1.57 0.18 0.00 0.00 0.00 0.00 46.02 44.70 1efi n GLY 54 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1efi h SER 55 N 1.86 0.00 1.18 1.61 4.64 -2.03 -1.49 113.55 119.33 1efi h SER 55 Ca -0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 1efi h SER 55 Cb 1.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 1efi h SER 55 CO 0.35 0.00 0.00 0.06 -0.87 0.00 0.00 176.83 176.37 1efi h GLN 56 N 0.00 0.00 -6.32 4.77 -0.00 -1.97 -3.44 115.11 108.14 1efi h GLN 56 Ca 0.03 0.00 -0.56 0.00 -0.00 0.00 0.00 58.65 58.12 1efi h GLN 56 Cb 0.26 0.00 -0.04 0.00 -0.00 0.00 0.00 27.48 27.70 1efi h GLN 56 CO -0.00 0.00 0.03 -1.01 -0.00 0.00 0.00 178.83 177.85 1efi s HIS 57 N -3.26 3.84 0.44 0.06 3.76 -0.56 -5.08 115.29 114.49 1efi s HIS 57 Ca 0.07 1.38 -0.08 0.00 -0.15 0.00 0.00 55.06 56.28 1efi s HIS 57 Cb 0.10 -2.58 -0.05 0.00 1.11 0.00 0.00 32.58 31.16 1efi s HIS 57 CO 0.52 0.57 0.78 0.96 -0.85 0.00 0.00 174.74 176.71 1efi s ILE 58 N -1.12 4.85 0.28 0.60 -4.36 -1.26 -4.92 121.20 115.27 1efi s ILE 58 Ca 0.31 0.43 0.02 0.00 -0.26 0.00 0.00 60.65 61.15 1efi s ILE 58 Cb -0.21 -3.79 0.28 0.00 1.25 0.00 0.00 42.46 39.99 1efi s ILE 58 CO 0.21 -0.68 1.70 0.44 0.24 0.00 0.00 174.94 176.86 1efi h ASP 59 N 0.77 0.33 0.24 4.36 3.32 -1.98 -0.24 116.42 123.23 1efi h ASP 59 Ca -0.47 0.14 0.00 0.00 0.02 0.00 0.00 57.03 56.72 1efi h ASP 59 Cb 1.19 0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.87 1efi h ASP 59 CO 0.63 0.03 0.00 0.77 -1.72 0.00 0.00 179.24 178.95 1efi h SER 60 N 0.42 0.00 1.56 6.45 4.64 -2.05 -1.44 113.55 123.13 1efi h SER 60 Ca 0.53 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.77 1efi h SER 60 Cb 0.96 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.04 1efi h SER 60 CO -0.50 0.00 -0.45 1.56 -0.87 0.00 0.00 176.83 176.57 1efi h GLN 61 N 0.00 0.00 -0.45 4.77 4.20 -1.41 -3.37 115.11 118.86 1efi h GLN 61 Ca 0.00 0.00 0.09 0.00 0.06 0.00 0.00 58.65 58.80 1efi h GLN 61 Cb 0.12 0.00 -0.09 0.00 0.30 0.00 0.00 27.48 27.81 1efi h GLN 61 CO 0.00 0.33 -0.23 0.87 -0.67 0.00 0.00 178.83 179.14 1efi h LYS 62 N 0.00 -0.13 -0.53 1.46 6.56 -1.35 0.20 116.57 122.77 1efi h LYS 62 Ca -0.01 0.01 -0.09 0.00 -1.06 0.00 0.00 60.65 59.49 1efi h LYS 62 Cb 1.28 0.03 -0.02 0.00 -0.57 0.00 0.00 32.23 32.95 1efi h LYS 62 CO 0.04 -0.09 -0.05 0.87 -2.06 0.00 0.00 179.45 178.17 1efi h LYS 63 N -0.14 0.93 -0.46 3.15 6.56 -1.77 -2.66 116.57 122.18 1efi h LYS 63 Ca 0.21 -0.30 -0.06 0.00 -1.06 0.00 0.00 60.65 59.44 1efi h LYS 63 Cb 0.47 -0.08 -0.02 0.00 -0.57 0.00 0.00 32.23 32.02 1efi h LYS 63 CO -0.53 0.95 0.02 0.00 -2.06 0.00 0.00 179.45 177.83 1efi h ALA 64 N 1.09 1.18 -0.35 3.86 0.00 -1.51 -0.96 119.26 122.57 1efi h ALA 64 Ca 0.15 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1efi h ALA 64 Cb 0.57 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1efi h ALA 64 CO 0.03 0.54 0.22 0.82 0.00 0.00 0.00 179.25 180.86 1efi h ILE 65 N 0.69 1.10 -0.75 0.00 2.04 -0.30 -0.14 117.51 120.16 1efi h ILE 65 Ca 0.14 -0.22 -0.05 0.00 1.00 0.00 0.00 64.86 65.73 1efi h ILE 65 Cb 0.40 0.63 -0.03 0.00 -0.74 0.00 0.00 36.82 37.08 1efi h ILE 65 CO 0.01 0.10 0.26 -0.33 0.00 0.00 0.00 178.15 178.19 1efi h GLU 66 N 0.46 1.14 -0.28 2.37 4.39 -1.22 -2.40 114.58 119.04 1efi h GLU 66 Ca 0.13 -0.23 -0.00 0.00 0.34 0.00 0.00 59.36 59.59 1efi h GLU 66 Cb -0.02 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 28.44 1efi h GLU 66 CO -0.03 0.96 0.16 -0.09 -1.16 0.00 0.00 179.01 178.85 1efi h ARG 67 N 1.10 0.39 -0.82 2.33 2.43 -0.79 -1.41 114.38 117.61 1efi h ARG 67 Ca 0.25 -0.04 0.06 0.00 -0.81 0.00 0.00 59.98 59.43 1efi h ARG 67 Cb 0.27 -0.08 -0.06 0.00 -0.42 0.00 0.00 29.97 29.68 1efi h ARG 67 CO -0.01 0.33 0.50 1.98 -1.51 0.00 0.00 179.97 181.26 1efi h MET 68 N 0.34 0.89 -0.58 0.20 4.05 -0.77 0.48 114.93 119.55 1efi h MET 68 Ca 0.10 -0.05 -0.08 0.00 -0.28 0.00 0.00 59.70 59.39 1efi h MET 68 Cb 0.06 -0.20 -0.02 0.00 -0.80 0.00 0.00 31.60 30.63 1efi h MET 68 CO -0.02 0.59 0.05 0.87 0.23 0.00 0.00 176.91 178.63 1efi h LYS 69 N 0.92 0.96 -0.42 0.39 1.57 -1.11 -1.46 116.57 117.42 1efi h LYS 69 Ca 0.36 -0.26 0.01 0.00 -1.87 0.00 0.00 60.65 58.89 1efi h LYS 69 Cb 0.17 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.35 1efi h LYS 69 CO -0.17 0.92 0.27 -0.44 -0.57 0.00 0.00 179.45 179.45 1efi h ASP 70 N 0.89 0.45 -0.55 0.86 3.32 -0.08 -2.64 116.42 118.68 1efi h ASP 70 Ca 0.17 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.22 1efi h ASP 70 Cb 0.46 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 39.88 1efi h ASP 70 CO 0.02 0.33 0.34 0.74 -1.72 0.00 0.00 179.24 178.94 1efi h THR 71 N 0.54 1.16 -0.79 0.35 2.02 -0.56 -2.63 112.91 113.01 1efi h THR 71 Ca 0.16 -0.35 -0.01 0.00 0.77 0.00 0.00 66.41 66.97 1efi h THR 71 Cb -0.04 0.41 -0.04 0.00 -1.74 0.00 0.00 68.15 66.74 1efi h THR 71 CO -0.05 0.16 0.43 -0.07 0.37 0.00 0.00 175.52 176.37 1efi h LEU 72 N 0.74 0.98 0.05 2.58 3.38 -1.12 -0.12 115.31 121.79 1efi h LEU 72 Ca 0.20 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 1efi h LEU 72 Cb -0.03 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.48 1efi h LEU 72 CO -0.04 0.78 -0.02 -0.09 0.09 0.00 0.00 178.44 179.16 1efi h ARG 73 N 1.10 -0.06 -0.24 1.13 2.43 -1.33 -0.16 114.38 117.25 1efi h ARG 73 Ca 0.28 0.00 -0.08 0.00 -0.81 0.00 0.00 59.98 59.37 1efi h ARG 73 Cb 0.02 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.57 1efi h ARG 73 CO -0.05 0.33 -0.20 0.97 -1.51 0.00 0.00 179.97 179.52 1efi h ILE 74 N -0.46 1.24 -0.52 1.20 2.10 -1.42 0.21 117.51 119.86 1efi h ILE 74 Ca -0.01 -1.12 -0.07 0.00 1.08 0.00 0.00 64.86 64.74 1efi h ILE 74 Cb 0.42 1.28 -0.02 0.00 -1.09 0.00 0.00 36.82 37.40 1efi h ILE 74 CO 0.01 0.36 0.07 0.74 -1.08 0.00 0.00 178.15 178.24 1efi h THR 75 N 0.39 1.25 -0.18 2.19 2.02 -0.99 -0.02 112.91 117.58 1efi h THR 75 Ca 0.07 -0.98 -0.03 0.00 0.77 0.00 0.00 66.41 66.23 1efi h THR 75 Cb 0.57 0.87 -0.01 0.00 -1.74 0.00 0.00 68.15 67.84 1efi h THR 75 CO 0.04 0.35 -0.01 0.22 0.37 0.00 0.00 175.52 176.48 1efi h TYR 76 N 0.76 0.36 -0.01 3.16 3.20 -0.31 -1.76 116.97 122.37 1efi h TYR 76 Ca 0.16 -0.07 -0.04 0.00 3.14 0.00 0.00 58.73 61.92 1efi h TYR 76 Cb 0.43 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.60 1efi h TYR 76 CO 0.03 0.55 -0.20 -0.07 -1.64 0.00 0.00 178.16 176.83 1efi h LEU 77 N 0.06 0.01 -1.28 2.82 3.38 -0.42 -2.61 115.31 117.27 1efi h LEU 77 Ca 0.05 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1efi h LEU 77 Cb 0.42 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.16 1efi h LEU 77 CO 0.01 0.22 -0.06 0.35 0.09 0.00 0.00 178.44 179.05 1efi n THR 78 N -4.29 0.00 -2.65 0.22 -2.24 -0.04 -4.95 114.28 100.33 1efi n THR 78 Ca -0.02 -0.33 -0.21 0.00 -2.27 0.00 0.00 64.05 61.22 1efi n THR 78 Cb 0.27 0.92 0.01 0.00 -2.10 0.00 0.00 70.33 69.43 1efi n THR 78 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 1efi n GLU 79 N 0.52 -3.02 -2.54 -0.78 2.13 -0.72 -4.93 120.64 111.31 1efi n GLU 79 Ca 0.16 0.94 -0.41 0.00 0.66 0.00 0.00 57.16 58.50 1efi n GLU 79 Cb 0.45 -5.63 -0.04 0.00 0.27 0.00 0.00 31.44 26.49 1efi n GLU 79 CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 1efi s THR 80 N -3.08 3.95 0.06 6.31 2.01 -0.88 -4.83 115.64 119.18 1efi s THR 80 Ca 0.13 1.67 -0.30 0.00 0.31 0.00 0.00 61.69 63.50 1efi s THR 80 Cb -0.06 -4.07 -0.05 0.00 0.01 0.00 0.00 72.50 68.33 1efi s THR 80 CO 0.16 0.28 1.17 -0.75 -0.69 0.00 0.00 174.62 174.79 1efi s LYS 81 N -0.31 4.45 -0.01 4.92 2.20 -1.26 -4.35 119.74 125.38 1efi s LYS 81 Ca 0.49 1.72 -0.14 0.00 -0.36 0.00 0.00 55.97 57.69 1efi s LYS 81 Cb -0.29 -3.36 -0.05 0.00 -1.51 0.00 0.00 37.83 32.62 1efi s LYS 81 CO 0.34 -0.22 0.37 0.42 -0.36 0.00 0.00 175.35 175.90 1efi s ILE 82 N 1.02 5.09 0.00 5.43 1.09 -0.19 -4.54 121.20 129.10 1efi s ILE 82 Ca 0.58 0.75 0.00 0.00 -1.10 0.00 0.00 60.65 60.87 1efi s ILE 82 Cb -0.28 -3.67 0.00 0.00 -1.06 0.00 0.00 42.46 37.45 1efi s ILE 82 CO 0.29 0.58 0.00 -0.67 -0.10 0.00 0.00 174.94 175.04 1efi n ASP 83 N 1.81 0.00 -4.34 3.58 2.03 0.28 -0.41 116.55 119.49 1efi n ASP 83 Ca -0.15 0.21 -0.18 0.00 0.52 0.00 0.00 54.79 55.19 1efi n ASP 83 Cb 0.53 -0.33 -0.10 0.00 -0.72 0.00 0.00 41.12 40.50 1efi n ASP 83 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 1efi s LYS 84 N -0.65 1.32 -0.04 -0.67 1.02 -1.13 0.32 119.74 119.91 1efi s LYS 84 Ca 0.00 -1.61 0.02 0.00 0.02 0.00 0.00 55.97 54.40 1efi s LYS 84 Cb 0.00 -0.99 0.01 0.00 -0.52 0.00 0.00 37.83 36.33 1efi s LYS 84 CO 0.00 0.11 -0.06 -0.51 -0.92 0.00 0.00 175.35 173.97 1efi s LEU 85 N -3.31 1.55 -0.23 3.17 1.43 -0.63 -1.32 118.68 119.34 1efi s LEU 85 Ca 0.23 -0.15 -0.11 0.00 -1.03 0.00 0.00 54.13 53.08 1efi s LEU 85 Cb 0.01 -0.48 -0.05 0.00 0.03 0.00 0.00 46.19 45.70 1efi s LEU 85 CO 0.07 -0.00 0.16 0.00 0.23 0.00 0.00 176.35 176.81 1efi s VAL 87 N 0.91 1.06 -0.13 0.00 -7.23 -0.43 0.35 120.40 114.94 1efi s VAL 87 Ca 0.08 -1.39 -0.27 0.00 -1.81 0.00 0.00 61.98 58.59 1efi s VAL 87 Cb -0.13 -1.13 -0.02 0.00 0.56 0.00 0.00 36.38 35.66 1efi s VAL 87 CO 0.03 -0.32 0.89 0.26 -0.31 0.00 0.00 175.10 175.65 1efi s TRP 88 N -1.59 3.48 -1.55 2.82 0.51 0.40 -0.99 118.94 122.02 1efi s TRP 88 Ca -0.00 1.40 0.11 0.00 -2.12 0.00 0.00 56.10 55.49 1efi s TRP 88 Cb -0.08 -3.06 0.39 0.00 -0.81 0.00 0.00 33.47 29.91 1efi s TRP 88 CO 0.02 -0.19 1.27 0.27 -0.51 0.00 0.00 176.95 177.81 1efi n ASN 89 N 4.92 2.64 -1.74 2.95 0.23 0.79 -2.74 115.26 122.31 1efi n ASN 89 Ca 0.05 -2.16 0.08 0.00 -0.53 0.00 0.00 54.58 52.02 1efi n ASN 89 Cb 0.49 -0.38 0.38 0.00 -2.08 0.00 0.00 39.78 38.20 1efi n ASN 89 CO 0.00 0.00 0.00 -0.46 -0.93 0.00 0.00 177.26 175.87 1efi n ASN 90 N 0.58 5.40 -4.08 0.53 6.94 -1.26 -4.93 115.26 118.44 1efi n ASN 90 Ca 0.14 -2.85 -0.14 0.00 -0.02 0.00 0.00 54.58 51.72 1efi n ASN 90 Cb 0.48 -0.65 -0.11 0.00 -2.36 0.00 0.00 39.78 37.14 1efi n ASN 90 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 1efi s LYS 91 N -2.60 0.57 -0.10 -3.83 -0.14 -1.25 -5.09 119.74 107.30 1efi s LYS 91 Ca 0.53 -0.80 -0.00 0.00 -1.36 0.00 0.00 55.97 54.34 1efi s LYS 91 Cb 0.39 -0.36 0.02 0.00 -1.68 0.00 0.00 37.83 36.21 1efi s LYS 91 CO 0.17 0.06 -0.06 0.99 -0.76 0.00 0.00 175.35 175.75 1efi s THR 92 N -1.42 0.88 0.80 2.17 2.01 -1.26 -2.24 115.64 116.59 1efi s THR 92 Ca -0.08 -0.20 -0.12 0.00 0.31 0.00 0.00 61.69 61.59 1efi s THR 92 Cb -0.10 -0.92 0.08 0.00 0.01 0.00 0.00 72.50 71.57 1efi s THR 92 CO 0.01 0.34 1.14 -2.84 -0.69 0.00 0.00 174.62 172.57 1efi s PRO 93 N 1.70 1.83 0.23 4.92 0.02 -1.26 -5.06 135.00 137.37 1efi s PRO 93 Ca 0.04 1.46 -0.31 0.00 0.02 0.00 0.00 61.00 62.20 1efi s PRO 93 Cb -0.13 -1.83 -0.14 0.00 0.02 0.00 0.00 34.50 32.43 1efi s PRO 93 CO -0.07 -2.01 1.38 0.09 -0.33 0.00 0.00 177.00 176.06 1efi n ASN 94 N -3.50 2.60 -4.65 2.53 5.03 -0.95 -4.48 115.26 111.84 1efi n ASN 94 Ca 0.11 1.14 -0.40 0.00 0.87 0.00 0.00 54.58 56.30 1efi n ASN 94 Cb 0.52 -1.41 -0.06 0.00 -1.02 0.00 0.00 39.78 37.81 1efi n ASN 94 CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 1efi s SER 95 N 0.24 6.66 -0.01 6.41 0.15 -1.11 -1.52 113.70 124.52 1efi s SER 95 Ca 0.68 0.80 -0.30 0.00 0.70 0.00 0.00 55.95 57.83 1efi s SER 95 Cb -0.67 -2.34 -0.05 0.00 -1.71 0.00 0.00 66.02 61.24 1efi s SER 95 CO 0.50 -0.29 1.43 -0.63 1.20 0.00 0.00 173.24 175.45 1efi s ILE 96 N 2.05 3.69 -0.22 6.45 1.01 -0.20 -0.46 121.20 133.53 1efi s ILE 96 Ca 0.28 1.05 0.03 0.00 0.00 0.00 0.00 60.65 62.01 1efi s ILE 96 Cb -0.16 -3.68 -0.15 0.00 0.01 0.00 0.00 42.46 38.48 1efi s ILE 96 CO 0.10 -0.01 -0.18 0.00 0.00 0.00 0.00 174.94 174.84 1efi n ALA 97 N 5.59 1.52 -3.10 9.38 0.00 0.16 -4.87 120.51 129.19 1efi n ALA 97 Ca 0.14 -0.97 -0.11 0.00 0.00 0.00 0.00 53.44 52.50 1efi n ALA 97 Cb 0.43 -0.02 -0.04 0.00 0.00 0.00 0.00 19.45 19.82 1efi n ALA 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1efi s ALA 98 N -2.45 -1.07 0.02 0.00 0.00 -0.96 -4.96 121.76 112.34 1efi s ALA 98 Ca -0.29 0.05 0.01 0.00 0.00 0.00 0.00 51.96 51.74 1efi s ALA 98 Cb 0.08 0.74 -0.02 0.00 0.00 0.00 0.00 23.12 23.92 1efi s ALA 98 CO 0.53 -0.68 -0.05 -1.50 0.00 0.00 0.00 175.76 174.06 1efi s ILE 99 N -3.80 0.37 0.05 0.00 2.07 -1.26 -0.52 121.20 118.11 1efi s ILE 99 Ca 0.03 -0.74 0.02 0.00 -1.41 0.00 0.00 60.65 58.55 1efi s ILE 99 Cb 0.01 -0.42 -0.02 0.00 0.13 0.00 0.00 42.46 42.16 1efi s ILE 99 CO -0.12 -0.25 -0.08 -0.94 -1.91 0.00 0.00 174.94 171.64 1efi s SER 100 N -1.06 0.93 -0.10 4.50 1.04 -0.43 -5.00 113.70 113.57 1efi s SER 100 Ca -0.07 -0.57 -0.09 0.00 0.48 0.00 0.00 55.95 55.70 1efi s SER 100 Cb -0.07 0.03 0.03 0.00 0.10 0.00 0.00 66.02 66.10 1efi s SER 100 CO -0.00 -0.20 0.27 -0.04 0.98 0.00 0.00 173.24 174.25 1efi s MET 101 N -1.64 0.32 0.06 4.02 -1.94 -1.26 -0.56 119.30 118.29 1efi s MET 101 Ca -0.09 0.37 0.02 0.00 -1.71 0.00 0.00 55.69 54.29 1efi s MET 101 Cb -0.10 0.16 -0.03 0.00 2.01 0.00 0.00 34.83 36.87 1efi s MET 101 CO 0.00 -0.04 -0.08 -1.59 -0.01 0.00 0.00 175.02 173.31 1efi s LYS 102 N 0.14 0.60 0.00 2.03 -2.85 -1.26 -4.91 119.74 113.49 1efi s LYS 102 Ca -0.00 -0.89 0.00 0.00 -1.00 0.00 0.00 55.97 54.08 1efi s LYS 102 Cb -0.02 -0.29 0.00 0.00 -2.06 0.00 0.00 37.83 35.46 1efi s LYS 102 CO 0.00 0.04 0.00 0.27 0.10 0.00 0.00 175.35 175.76