#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dnt n SER 2 N 0.00 -6.50 0.00 1.61 2.88 -1.26 -5.11 113.62 105.24 2dnt n SER 2 Ca 0.00 0.96 0.00 0.00 -1.33 0.00 0.00 58.87 58.50 2dnt n SER 2 Cb 0.00 -3.59 0.00 0.00 -0.75 0.00 0.00 64.21 59.87 2dnt n SER 2 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2dnt n SER 3 N 1.19 0.00 0.00 -3.46 2.88 -1.26 -5.13 113.62 107.84 2dnt n SER 3 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2dnt n SER 3 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2dnt n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dnt n GLY 4 N -0.18 -1.53 3.64 0.46 0.00 -1.26 -5.18 105.19 101.15 2dnt n GLY 4 Ca 0.00 0.71 -0.06 0.00 0.00 0.00 0.00 46.02 46.67 2dnt n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dnt s SER 5 N 0.00 -0.37 0.00 1.61 0.15 -1.26 -5.17 113.70 108.66 2dnt s SER 5 Ca 0.00 0.68 0.00 0.00 0.70 0.00 0.00 55.95 57.33 2dnt s SER 5 Cb 0.00 0.84 0.00 0.00 -1.71 0.00 0.00 66.02 65.15 2dnt s SER 5 CO 0.00 -0.11 0.00 -1.20 1.20 0.00 0.00 173.24 173.13 2dnt n SER 6 N 2.55 0.00 -0.47 5.45 7.64 -1.26 -5.17 113.62 122.37 2dnt n SER 6 Ca -0.14 0.00 0.06 0.00 1.01 0.00 0.00 58.87 59.80 2dnt n SER 6 Cb 0.57 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.74 2dnt n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dnt n GLY 7 N -0.14 -2.63 3.06 0.23 0.00 -1.26 -5.01 105.19 99.44 2dnt n GLY 7 Ca 0.00 -1.34 0.02 0.00 0.00 0.00 0.00 46.02 44.71 2dnt n GLY 7 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2dnt s MET 8 N -3.07 0.50 0.15 1.61 1.75 -1.26 -5.02 119.30 113.96 2dnt s MET 8 Ca 0.00 -0.02 0.00 0.00 -1.25 0.00 0.00 55.69 54.42 2dnt s MET 8 Cb 0.00 0.10 0.00 0.00 2.84 0.00 0.00 34.83 37.77 2dnt s MET 8 CO 0.00 -0.77 0.00 0.00 -0.65 0.00 0.00 175.02 173.60 2dnt n ALA 9 N 4.45 0.00 -0.67 4.11 0.00 -1.26 -5.15 120.51 122.00 2dnt n ALA 9 Ca 0.08 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.28 2dnt n ALA 9 Cb 0.58 0.00 0.12 0.00 0.00 0.00 0.00 19.45 20.16 2dnt n ALA 9 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2dnt n SER 10 N -3.09 -2.73 0.00 0.00 7.64 -1.26 -5.04 113.62 109.15 2dnt n SER 10 Ca 0.00 -0.21 0.00 0.00 1.01 0.00 0.00 58.87 59.67 2dnt n SER 10 Cb 0.00 -0.75 0.00 0.00 -1.01 0.00 0.00 64.21 62.45 2dnt n SER 10 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2dnt n GLU 11 N -0.77 0.00 -3.85 1.43 1.02 -1.26 -5.18 120.64 112.04 2dnt n GLU 11 Ca 0.02 0.00 -0.21 0.00 -0.02 0.00 0.00 57.16 56.95 2dnt n GLU 11 Cb 0.47 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 31.86 2dnt n GLU 11 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2dnt s GLU 12 N -1.51 2.85 0.09 3.49 0.41 -1.26 -5.04 118.70 117.73 2dnt s GLU 12 Ca 0.00 -1.18 -0.29 0.00 -0.41 0.00 0.00 54.97 53.09 2dnt s GLU 12 Cb 0.00 -2.56 -0.15 0.00 -1.78 0.00 0.00 34.13 29.65 2dnt s GLU 12 CO 0.00 0.18 1.66 1.37 -0.49 0.00 0.00 175.26 177.98 2dnt h LEU 13 N 1.26 -0.55 0.00 1.80 -0.00 -2.06 -3.46 115.31 112.29 2dnt h LEU 13 Ca -0.46 0.04 0.00 0.00 -0.00 0.00 0.00 57.88 57.46 2dnt h LEU 13 Cb 1.25 0.17 0.00 0.00 -0.00 0.00 0.00 40.66 42.08 2dnt h LEU 13 CO 0.58 -0.35 0.00 -1.22 -0.00 0.00 0.00 178.44 177.46 2dnt n TYR 14 N -5.35 0.00 -4.17 0.17 4.02 -1.26 -5.17 117.16 105.40 2dnt n TYR 14 Ca -0.10 0.00 -0.16 0.00 -0.01 0.00 0.00 57.90 57.63 2dnt n TYR 14 Cb 0.26 0.00 -0.14 0.00 -0.02 0.00 0.00 39.34 39.43 2dnt n TYR 14 CO 0.00 0.00 0.00 -1.83 -1.01 0.00 0.00 176.86 174.02 2dnt s GLU 15 N -0.97 0.45 0.05 -0.72 -1.05 -1.26 -5.11 118.70 110.10 2dnt s GLU 15 Ca 0.00 -0.24 -0.30 0.00 -0.15 0.00 0.00 54.97 54.28 2dnt s GLU 15 Cb 0.00 -0.42 -0.08 0.00 -0.44 0.00 0.00 34.13 33.18 2dnt s GLU 15 CO 0.00 0.11 1.80 0.08 0.95 0.00 0.00 175.26 178.21 2dnt s VAL 16 N -0.22 3.00 -0.11 1.83 1.01 -1.26 -4.89 120.40 119.76 2dnt s VAL 16 Ca 0.01 0.26 -0.28 0.00 0.00 0.00 0.00 61.98 61.98 2dnt s VAL 16 Cb -0.03 -3.17 -0.24 0.00 0.00 0.00 0.00 36.38 32.94 2dnt s VAL 16 CO -0.00 -0.01 0.86 -0.08 0.00 0.00 0.00 175.10 175.87 2dnt h GLU 17 N 9.37 -0.00 0.00 2.72 4.81 -1.95 -3.50 114.58 126.03 2dnt h GLU 17 Ca -0.45 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.78 2dnt h GLU 17 Cb 1.21 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.59 2dnt h GLU 17 CO 0.94 0.86 0.00 2.89 -0.73 0.00 0.00 179.01 182.97 2dnt n ARG 18 N -4.67 0.00 -3.55 1.92 1.85 -1.26 -5.01 116.66 105.93 2dnt n ARG 18 Ca -0.09 0.00 -0.36 0.00 -1.00 0.00 0.00 57.85 56.39 2dnt n ARG 18 Cb 0.42 0.00 -0.07 0.00 -1.05 0.00 0.00 32.46 31.75 2dnt n ARG 18 CO 0.00 0.00 0.00 0.42 -0.01 0.00 0.00 177.63 178.04 2dnt s ILE 19 N -2.00 5.31 -0.45 8.89 -1.09 -1.26 -2.97 121.20 127.64 2dnt s ILE 19 Ca 0.00 0.51 0.12 0.00 -2.23 0.00 0.00 60.65 59.05 2dnt s ILE 19 Cb 0.00 -3.62 -0.15 0.00 -1.58 0.00 0.00 42.46 37.12 2dnt s ILE 19 CO 0.00 0.38 0.46 1.33 -1.23 0.00 0.00 174.94 175.88 2dnt n VAL 20 N 3.67 0.00 -3.63 2.92 0.24 0.36 -4.94 118.33 116.94 2dnt n VAL 20 Ca -0.12 -0.23 -0.01 0.00 -2.04 0.00 0.00 64.34 61.94 2dnt n VAL 20 Cb 0.52 0.82 -0.01 0.00 -1.47 0.00 0.00 33.84 33.70 2dnt n VAL 20 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2dnt s ASP 21 N -2.44 -0.11 -0.26 -1.34 -1.08 -1.17 -4.96 116.67 105.32 2dnt s ASP 21 Ca 0.03 -0.16 -0.24 0.00 -0.52 0.00 0.00 52.55 51.66 2dnt s ASP 21 Cb 0.09 0.23 0.07 0.00 -1.46 0.00 0.00 42.92 41.85 2dnt s ASP 21 CO 0.50 -0.41 0.70 -0.75 0.52 0.00 0.00 175.17 175.73 2dnt s LYS 22 N -2.61 0.81 0.31 4.34 2.20 -1.26 0.17 119.74 123.69 2dnt s LYS 22 Ca 0.13 0.99 -0.18 0.00 -0.36 0.00 0.00 55.97 56.54 2dnt s LYS 22 Cb 0.02 0.38 0.07 0.00 -1.51 0.00 0.00 37.83 36.79 2dnt s LYS 22 CO -0.03 -0.10 0.90 1.03 -0.36 0.00 0.00 175.35 176.79 2dnt s ARG 23 N 0.46 1.89 0.30 4.03 0.52 -0.56 -4.98 118.95 120.61 2dnt s ARG 23 Ca -0.01 -1.23 0.08 0.00 -0.52 0.00 0.00 55.73 54.06 2dnt s ARG 23 Cb -0.05 0.52 -0.04 0.00 0.52 0.00 0.00 34.95 35.90 2dnt s ARG 23 CO -0.01 -0.89 0.12 0.21 0.02 0.00 0.00 175.30 174.76 2dnt s LYS 24 N -2.12 2.48 0.51 3.54 2.20 -1.26 -1.07 119.74 124.01 2dnt s LYS 24 Ca 0.19 -1.39 0.06 0.00 -0.36 0.00 0.00 55.97 54.47 2dnt s LYS 24 Cb -0.04 -2.27 0.02 0.00 -1.51 0.00 0.00 37.83 34.03 2dnt s LYS 24 CO 0.09 0.24 0.38 0.54 -0.36 0.00 0.00 175.35 176.25 2dnt s ASN 25 N -3.81 4.70 0.55 1.43 2.20 -1.09 -4.95 114.94 113.97 2dnt s ASN 25 Ca 0.35 -1.12 0.36 0.00 -0.94 0.00 0.00 52.86 51.51 2dnt s ASN 25 Cb -0.05 0.12 1.73 0.00 -2.00 0.00 0.00 41.25 41.05 2dnt s ASN 25 CO 0.23 -0.96 2.08 0.07 -2.94 0.00 0.00 177.10 175.58 2dnt h LYS 26 N 0.86 0.00 0.06 3.55 5.09 -2.01 -1.93 116.57 122.19 2dnt h LYS 26 Ca -0.38 0.00 -0.22 0.00 0.09 0.00 0.00 60.65 60.14 2dnt h LYS 26 Cb 1.29 0.00 0.02 0.00 0.10 0.00 0.00 32.23 33.64 2dnt h LYS 26 CO 0.58 0.00 -0.88 0.87 -2.09 0.00 0.00 179.45 177.93 2dnt h LYS 27 N 0.00 0.49 0.00 0.07 1.57 -2.05 -3.48 116.57 113.18 2dnt h LYS 27 Ca 0.00 -0.61 0.00 0.00 -1.87 0.00 0.00 60.65 58.17 2dnt h LYS 27 Cb 0.25 0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.76 2dnt h LYS 27 CO 0.00 1.24 0.00 0.41 -0.57 0.00 0.00 179.45 180.53 2dnt n GLY 28 N 1.27 1.00 3.77 3.86 0.00 -0.73 -5.11 105.19 109.25 2dnt n GLY 28 Ca -0.12 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.51 2dnt n GLY 28 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dnt s LYS 29 N -0.05 4.64 -0.21 1.61 3.01 -1.26 -4.78 119.74 122.70 2dnt s LYS 29 Ca 0.00 1.49 -0.24 0.00 -1.01 0.00 0.00 55.97 56.21 2dnt s LYS 29 Cb 0.00 -3.01 -0.01 0.00 -1.01 0.00 0.00 37.83 33.80 2dnt s LYS 29 CO 0.00 0.30 0.80 0.99 0.51 0.00 0.00 175.35 177.95 2dnt s THR 30 N -1.38 4.88 0.12 2.17 2.01 -1.26 -2.68 115.64 119.50 2dnt s THR 30 Ca 0.47 1.54 0.09 0.00 0.31 0.00 0.00 61.69 64.09 2dnt s THR 30 Cb -0.24 -4.10 -0.04 0.00 0.01 0.00 0.00 72.50 68.13 2dnt s THR 30 CO 0.30 -0.01 -0.17 -1.61 -0.69 0.00 0.00 174.62 172.43 2dnt s GLU 31 N 2.48 1.81 -0.07 4.92 2.02 -0.23 -0.49 118.70 129.15 2dnt s GLU 31 Ca 0.35 -1.18 0.01 0.00 0.02 0.00 0.00 54.97 54.18 2dnt s GLU 31 Cb -0.16 -2.12 0.02 0.00 0.10 0.00 0.00 34.13 31.97 2dnt s GLU 31 CO 0.09 0.48 -0.09 0.71 0.02 0.00 0.00 175.26 176.47 2dnt s TYR 32 N -1.17 1.26 -0.41 1.61 2.02 0.20 -1.49 117.35 119.36 2dnt s TYR 32 Ca 0.18 -0.48 -0.29 0.00 -0.37 0.00 0.00 57.07 56.12 2dnt s TYR 32 Cb -0.11 -0.99 0.00 0.00 -0.40 0.00 0.00 41.96 40.47 2dnt s TYR 32 CO 0.10 -0.30 1.50 -1.17 -1.57 0.00 0.00 175.55 174.11 2dnt s LEU 33 N 0.96 3.55 0.04 -1.29 2.96 0.46 -2.29 118.68 123.06 2dnt s LEU 33 Ca -0.10 0.88 0.08 0.00 -0.22 0.00 0.00 54.13 54.77 2dnt s LEU 33 Cb -0.15 -3.49 -0.02 0.00 0.50 0.00 0.00 46.19 43.03 2dnt s LEU 33 CO 0.00 -1.53 -0.22 0.54 -1.32 0.00 0.00 176.35 173.83 2dnt s VAL 34 N 5.84 1.74 0.79 1.68 0.11 -1.16 0.13 120.40 129.53 2dnt s VAL 34 Ca 0.65 -1.20 -0.07 0.00 -2.93 0.00 0.00 61.98 58.43 2dnt s VAL 34 Cb -0.15 -1.50 0.13 0.00 -1.53 0.00 0.00 36.38 33.33 2dnt s VAL 34 CO 0.32 0.26 1.10 -0.13 -3.33 0.00 0.00 175.10 173.32 2dnt s ARG 35 N -1.12 1.48 0.02 1.54 1.81 -1.16 -3.66 118.95 117.87 2dnt s ARG 35 Ca 0.08 -0.71 -0.27 0.00 -1.72 0.00 0.00 55.73 53.11 2dnt s ARG 35 Cb -0.09 -2.15 0.08 0.00 -0.45 0.00 0.00 34.95 32.35 2dnt s ARG 35 CO 0.02 -1.69 0.74 -1.58 -0.68 0.00 0.00 175.30 172.11 2dnt s TRP 36 N -3.39 -0.51 0.62 -0.53 0.52 -1.26 -3.91 118.94 110.49 2dnt s TRP 36 Ca 0.67 0.56 -0.07 0.00 0.02 0.00 0.00 56.10 57.28 2dnt s TRP 36 Cb -0.06 0.50 0.01 0.00 -1.15 0.00 0.00 33.47 32.77 2dnt s TRP 36 CO 0.47 -0.65 0.95 0.21 0.02 0.00 0.00 176.95 177.95 2dnt s LYS 37 N -2.56 2.84 0.00 4.98 2.20 -1.26 -4.07 119.74 121.87 2dnt s LYS 37 Ca -0.02 0.07 0.00 0.00 -0.36 0.00 0.00 55.97 55.66 2dnt s LYS 37 Cb -0.01 -2.21 0.00 0.00 -1.51 0.00 0.00 37.83 34.10 2dnt s LYS 37 CO -0.04 -0.82 0.00 0.41 -0.36 0.00 0.00 175.35 174.54 2dnt n GLY 38 N -2.70 2.15 3.98 5.54 0.00 -1.26 -4.97 105.19 107.92 2dnt n GLY 38 Ca 0.05 -0.26 -0.22 0.00 0.00 0.00 0.00 46.02 45.60 2dnt n GLY 38 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2dnt s TYR 39 N -0.68 2.50 0.40 1.61 2.02 -1.26 -5.11 117.35 116.83 2dnt s TYR 39 Ca 0.00 -0.09 -0.07 0.00 -0.37 0.00 0.00 57.07 56.54 2dnt s TYR 39 Cb 0.00 -2.80 0.09 0.00 -0.40 0.00 0.00 41.96 38.85 2dnt s TYR 39 CO 0.00 -1.10 0.53 -0.25 -1.57 0.00 0.00 175.55 173.16 2dnt n ASP 40 N -2.47 -0.09 0.11 2.29 8.00 -1.26 -4.97 116.55 118.17 2dnt n ASP 40 Ca 0.10 -1.16 -0.18 0.00 0.71 0.00 0.00 54.79 54.27 2dnt n ASP 40 Cb 0.60 -0.41 -0.14 0.00 -0.02 0.00 0.00 41.12 41.15 2dnt n ASP 40 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 2dnt h SER 41 N -0.79 0.53 -0.48 -2.24 0.02 -1.99 -3.20 113.55 105.40 2dnt h SER 41 Ca -0.17 -0.56 -0.19 0.00 -0.84 0.00 0.00 61.79 60.03 2dnt h SER 41 Cb 0.48 -0.17 -0.11 0.00 0.14 0.00 0.00 62.40 62.73 2dnt h SER 41 CO 0.12 1.43 0.24 -0.62 -1.14 0.00 0.00 176.83 176.86 2dnt n GLU 42 N -3.59 2.22 -0.00 3.45 1.02 -1.26 -3.56 120.64 118.91 2dnt n GLU 42 Ca -0.10 -1.71 0.07 0.00 -0.02 0.00 0.00 57.16 55.39 2dnt n GLU 42 Cb 1.03 -1.75 -0.09 0.00 -0.02 0.00 0.00 31.44 30.60 2dnt n GLU 42 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 2dnt n ASP 43 N -0.16 1.05 -4.41 1.62 -0.08 -1.21 -5.01 116.55 108.35 2dnt n ASP 43 Ca 0.27 -0.51 -0.55 0.00 -1.51 0.00 0.00 54.79 52.49 2dnt n ASP 43 Cb 1.03 1.27 -0.07 0.00 2.34 0.00 0.00 41.12 45.69 2dnt n ASP 43 CO 0.00 0.00 0.00 -0.90 0.12 0.00 0.00 177.20 176.42 2dnt n ASP 44 N -1.60 -0.33 -4.15 1.67 5.68 -1.23 -4.95 116.55 111.64 2dnt n ASP 44 Ca 0.01 1.14 -0.21 0.00 -0.50 0.00 0.00 54.79 55.22 2dnt n ASP 44 Cb 0.29 -0.92 -0.01 0.00 -1.14 0.00 0.00 41.12 39.34 2dnt n ASP 44 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 2dnt n THR 45 N 1.09 0.00 -4.08 2.12 -2.24 -1.24 -4.99 114.28 104.94 2dnt n THR 45 Ca 0.19 -1.69 -0.32 0.00 -2.27 0.00 0.00 64.05 59.95 2dnt n THR 45 Cb 0.12 -0.05 -0.15 0.00 -2.10 0.00 0.00 70.33 68.15 2dnt n THR 45 CO 0.00 0.00 0.00 0.26 -0.57 0.00 0.00 175.07 174.76 2dnt s TRP 46 N -2.13 3.13 -0.06 4.78 0.52 -1.26 -2.99 118.94 120.93 2dnt s TRP 46 Ca 0.20 -2.11 -0.00 0.00 0.02 0.00 0.00 56.10 54.20 2dnt s TRP 46 Cb -0.02 -1.93 -0.03 0.00 -1.15 0.00 0.00 33.47 30.34 2dnt s TRP 46 CO 0.13 -0.86 -0.02 -1.21 0.02 0.00 0.00 176.95 175.01 2dnt s GLU 47 N 1.16 2.87 0.16 4.98 0.41 -0.97 -4.83 118.70 122.48 2dnt s GLU 47 Ca -0.05 -0.50 -0.30 0.00 -0.41 0.00 0.00 54.97 53.71 2dnt s GLU 47 Cb -0.18 -2.71 -0.07 0.00 -1.78 0.00 0.00 34.13 29.39 2dnt s GLU 47 CO -0.07 0.67 1.12 -1.25 -0.49 0.00 0.00 175.26 175.24 2dnt s PRO 48 N -1.06 4.56 0.33 0.39 0.04 -1.26 0.60 135.00 138.60 2dnt s PRO 48 Ca 0.15 1.74 0.09 0.00 0.04 0.00 0.00 61.00 63.02 2dnt s PRO 48 Cb -0.11 -3.28 0.98 0.00 0.04 0.00 0.00 34.50 32.12 2dnt s PRO 48 CO 0.04 0.01 1.58 1.49 0.04 0.00 0.00 177.00 180.16 2dnt h GLU 49 N 5.36 0.02 -0.80 4.56 4.22 -1.12 1.59 114.58 128.40 2dnt h GLU 49 Ca -0.44 -0.00 0.14 0.00 0.08 0.00 0.00 59.36 59.14 2dnt h GLU 49 Cb 1.21 -0.00 -0.09 0.00 0.50 0.00 0.00 28.75 30.37 2dnt h GLU 49 CO 0.74 0.01 0.37 0.37 -2.18 0.00 0.00 179.01 178.32 2dnt h GLN 50 N 0.02 0.53 0.00 1.92 4.15 -1.91 0.56 115.11 120.37 2dnt h GLN 50 Ca 0.69 -0.03 -0.02 0.00 0.77 0.00 0.00 58.65 60.07 2dnt h GLN 50 Cb 1.61 -0.12 -0.00 0.00 0.21 0.00 0.00 27.48 29.18 2dnt h GLN 50 CO -0.86 0.35 -0.07 0.45 -1.93 0.00 0.00 178.83 176.77 2dnt h HIS 51 N 0.54 0.00 -1.54 3.99 3.86 0.18 -3.32 115.15 118.87 2dnt h HIS 51 Ca 0.43 0.00 -0.76 0.00 -1.16 0.00 0.00 60.37 58.88 2dnt h HIS 51 Cb 0.62 0.00 -0.17 0.00 1.06 0.00 0.00 27.41 28.92 2dnt h HIS 51 CO -0.12 0.07 1.97 1.28 0.86 0.00 0.00 177.93 181.99 2dnt n LEU 52 N -3.14 7.36 -4.76 2.43 4.77 0.19 -4.98 117.00 118.88 2dnt n LEU 52 Ca 0.02 -4.90 -0.40 0.00 -0.03 0.00 0.00 56.01 50.70 2dnt n LEU 52 Cb 0.47 -1.37 -0.04 0.00 -2.33 0.00 0.00 43.42 40.16 2dnt n LEU 52 CO 0.33 1.80 0.81 -0.69 -1.33 0.00 0.00 177.39 178.31 2dnt s VAL 53 N -1.19 3.48 -0.31 4.08 1.01 -1.24 -2.35 120.40 123.89 2dnt s VAL 53 Ca 0.45 1.45 0.00 0.00 0.00 0.00 0.00 61.98 63.88 2dnt s VAL 53 Cb 0.14 -3.92 0.00 0.00 0.00 0.00 0.00 36.38 32.60 2dnt s VAL 53 CO -0.04 0.33 0.00 -3.20 0.00 0.00 0.00 175.10 172.19 2dnt n ASN 54 N 1.37 -4.77 0.07 3.32 2.85 -1.26 -4.80 115.26 112.05 2dnt n ASN 54 Ca -0.00 0.07 0.07 0.00 -0.11 0.00 0.00 54.58 54.61 2dnt n ASN 54 Cb 0.45 -2.52 -0.04 0.00 1.24 0.00 0.00 39.78 38.90 2dnt n ASN 54 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2dnt n GLU 56 N -2.73 -0.05 0.02 0.00 1.02 -1.26 0.19 120.64 117.84 2dnt n GLU 56 Ca -0.04 1.09 -0.10 0.00 -0.02 0.00 0.00 57.16 58.09 2dnt n GLU 56 Cb 0.65 -1.99 -0.04 0.00 -0.02 0.00 0.00 31.44 30.05 2dnt n GLU 56 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 2dnt h GLU 57 N 0.00 -0.29 0.20 3.49 4.81 -1.96 0.55 114.58 121.38 2dnt h GLU 57 Ca 0.69 0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.93 2dnt h GLU 57 Cb 1.88 0.07 0.00 0.00 0.63 0.00 0.00 28.75 31.32 2dnt h GLU 57 CO -0.58 -0.19 -0.10 1.88 -0.73 0.00 0.00 179.01 179.29 2dnt h TYR 58 N -0.30 -0.25 -0.55 0.92 0.05 0.18 -2.85 116.97 114.18 2dnt h TYR 58 Ca 0.09 -0.01 0.11 0.00 0.05 0.00 0.00 58.73 58.97 2dnt h TYR 58 Cb 0.42 0.08 -0.11 0.00 1.01 0.00 0.00 36.73 38.14 2dnt h TYR 58 CO -0.30 0.07 -0.15 0.82 -1.05 0.00 0.00 178.16 177.55 2dnt h ILE 59 N -0.59 0.43 -0.24 -2.88 2.04 -0.97 0.25 117.51 115.56 2dnt h ILE 59 Ca -0.03 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.86 2dnt h ILE 59 Cb 0.43 0.43 -0.05 0.00 -0.74 0.00 0.00 36.82 36.89 2dnt h ILE 59 CO 0.04 0.00 -0.39 0.45 0.00 0.00 0.00 178.15 178.25 2dnt h HIS 60 N -0.02 -1.19 -0.47 1.37 3.86 0.16 1.47 115.15 120.34 2dnt h HIS 60 Ca 0.26 0.05 0.09 0.00 -1.16 0.00 0.00 60.37 59.62 2dnt h HIS 60 Cb 0.42 0.55 -0.09 0.00 1.06 0.00 0.00 27.41 29.35 2dnt h HIS 60 CO -0.47 -0.36 -0.11 0.22 0.86 0.00 0.00 177.93 178.08 2dnt h ASP 61 N -0.32 -0.41 -0.95 2.45 3.58 -1.05 0.31 116.42 120.03 2dnt h ASP 61 Ca 0.04 0.14 0.09 0.00 0.42 0.00 0.00 57.03 57.72 2dnt h ASP 61 Cb 0.44 0.28 -0.07 0.00 1.72 0.00 0.00 39.33 41.69 2dnt h ASP 61 CO -0.39 -0.15 0.60 0.15 -2.88 0.00 0.00 179.24 176.57 2dnt h PHE 62 N 0.01 1.09 -0.46 0.28 3.57 0.11 -0.97 116.94 120.58 2dnt h PHE 62 Ca 0.23 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.70 2dnt h PHE 62 Cb 0.34 -0.35 -0.02 0.00 2.79 0.00 0.00 35.95 38.72 2dnt h PHE 62 CO -0.39 0.51 0.07 -0.91 -2.23 0.00 0.00 178.31 175.36 2dnt h ASN 63 N 1.03 0.73 -0.15 0.41 2.35 0.45 -2.59 115.58 117.80 2dnt h ASN 63 Ca 0.44 -0.26 0.05 0.00 -0.55 0.00 0.00 56.30 55.97 2dnt h ASN 63 Cb 0.29 -0.19 -0.05 0.00 0.05 0.00 0.00 38.32 38.42 2dnt h ASN 63 CO -0.21 0.81 -0.19 0.03 -1.65 0.00 0.00 177.43 176.21 2dnt h ARG 64 N 0.62 -0.22 -0.08 0.81 2.47 0.75 0.71 114.38 119.44 2dnt h ARG 64 Ca 0.14 0.02 0.04 0.00 -1.26 0.00 0.00 59.98 58.91 2dnt h ARG 64 Cb 0.39 0.05 -0.06 0.00 -1.65 0.00 0.00 29.97 28.70 2dnt h ARG 64 CO 0.01 -0.15 -0.39 0.00 0.56 0.00 0.00 179.97 180.00 2dnt h ARG 65 N -0.23 -0.48 0.16 0.04 2.47 -1.15 -3.09 114.38 112.09 2dnt h ARG 65 Ca 0.11 0.03 -0.01 0.00 -1.26 0.00 0.00 59.98 58.85 2dnt h ARG 65 Cb 0.39 0.11 0.00 0.00 -1.65 0.00 0.00 29.97 28.82 2dnt h ARG 65 CO -0.29 -0.32 -0.08 1.25 0.56 0.00 0.00 179.97 181.09 2dnt h HIS 66 N -0.50 -0.22 -3.17 3.04 2.76 -1.05 -3.44 115.15 112.58 2dnt h HIS 66 Ca 0.07 -0.00 -0.57 0.00 -2.20 0.00 0.00 60.37 57.67 2dnt h HIS 66 Cb 0.62 0.08 0.18 0.00 1.55 0.00 0.00 27.41 29.83 2dnt h HIS 66 CO -0.44 -0.13 -0.32 2.41 -1.30 0.00 0.00 177.93 178.15 2dnt n THR 67 N -2.66 2.26 -2.43 6.26 -1.04 0.24 -4.91 114.28 112.01 2dnt n THR 67 Ca -0.03 -0.45 -0.39 0.00 -2.04 0.00 0.00 64.05 61.14 2dnt n THR 67 Cb 0.09 -0.77 -0.04 0.00 -1.82 0.00 0.00 70.33 67.79 2dnt n THR 67 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 2dnt s GLU 68 N -2.50 4.38 0.64 -2.82 2.02 -1.26 -4.76 118.70 114.39 2dnt s GLU 68 Ca 0.68 1.76 -0.05 0.00 0.02 0.00 0.00 54.97 57.39 2dnt s GLU 68 Cb -0.39 -2.91 0.04 0.00 0.10 0.00 0.00 34.13 30.97 2dnt s GLU 68 CO 0.55 -0.02 0.93 0.15 0.02 0.00 0.00 175.26 176.90 2dnt s LYS 69 N -1.92 2.50 -0.31 1.61 3.01 -1.26 -5.08 119.74 118.29 2dnt s LYS 69 Ca 0.51 -0.26 -0.10 0.00 -1.01 0.00 0.00 55.97 55.11 2dnt s LYS 69 Cb -0.30 -2.26 0.19 0.00 -1.01 0.00 0.00 37.83 34.45 2dnt s LYS 69 CO 0.38 -0.97 1.03 -1.14 0.51 0.00 0.00 175.35 175.16 2dnt s GLN 70 N -5.08 0.18 0.76 1.68 0.74 -1.26 -5.17 119.66 111.52 2dnt s GLN 70 Ca 0.57 0.04 -0.05 0.00 0.05 0.00 0.00 55.36 55.97 2dnt s GLN 70 Cb -0.11 0.05 0.12 0.00 1.10 0.00 0.00 33.01 34.17 2dnt s GLN 70 CO 0.44 -0.29 1.06 0.21 -0.55 0.00 0.00 175.29 176.15 2dnt s LYS 71 N 2.46 1.60 -0.23 1.67 2.20 -1.26 -4.81 119.74 121.37 2dnt s LYS 71 Ca 0.21 -0.75 -0.02 0.00 -0.36 0.00 0.00 55.97 55.05 2dnt s LYS 71 Cb 0.00 -2.20 0.00 0.00 -1.51 0.00 0.00 37.83 34.13 2dnt s LYS 71 CO -0.19 -1.58 0.06 0.39 -0.36 0.00 0.00 175.35 173.67 2dnt n GLU 72 N -3.04 -2.38 -0.06 4.03 1.02 -1.26 -5.00 120.64 113.96 2dnt n GLU 72 Ca 0.13 2.06 -0.04 0.00 -0.02 0.00 0.00 57.16 59.30 2dnt n GLU 72 Cb 0.60 -4.15 -0.03 0.00 -0.02 0.00 0.00 31.44 27.84 2dnt n GLU 72 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2dnt h SER 73 N 2.06 0.00 -3.26 1.62 0.87 -2.08 -3.44 113.55 109.32 2dnt h SER 73 Ca 0.00 -0.20 -0.58 0.00 -1.23 0.00 0.00 61.79 59.78 2dnt h SER 73 Cb 0.09 0.00 -0.07 0.00 -0.44 0.00 0.00 62.40 61.99 2dnt h SER 73 CO 0.08 0.65 0.49 -0.83 -0.53 0.00 0.00 176.83 176.70 2dnt s GLY 74 N -3.79 1.98 -0.07 5.77 0.00 -1.26 -5.01 107.32 104.93 2dnt s GLY 74 Ca -0.06 0.05 -0.30 0.00 0.00 0.00 0.00 44.72 44.41 2dnt s GLY 74 CO 0.17 1.81 1.23 2.56 0.00 0.00 0.00 173.10 178.87 2dnt s PRO 75 N 2.48 4.32 0.54 2.90 0.04 -1.26 -5.03 135.00 138.99 2dnt s PRO 75 Ca 0.39 1.70 0.04 0.00 0.04 0.00 0.00 61.00 63.17 2dnt s PRO 75 Cb -0.16 -3.60 0.04 0.00 0.04 0.00 0.00 34.50 30.83 2dnt s PRO 75 CO 0.11 -0.50 0.74 -1.54 0.04 0.00 0.00 177.00 175.85 2dnt s SER 76 N 1.60 5.25 0.06 6.66 1.04 -1.26 -5.12 113.70 121.93 2dnt s SER 76 Ca 0.56 -0.27 0.04 0.00 0.48 0.00 0.00 55.95 56.77 2dnt s SER 76 Cb -0.25 -0.58 -0.03 0.00 0.10 0.00 0.00 66.02 65.27 2dnt s SER 76 CO 0.21 -1.14 -0.12 -0.94 0.98 0.00 0.00 173.24 172.22 2dnt s SER 77 N -4.47 1.46 0.00 7.02 1.04 -1.26 -5.27 113.70 112.22 2dnt s SER 77 Ca 0.58 -0.56 0.00 0.00 0.48 0.00 0.00 55.95 56.45 2dnt s SER 77 Cb -0.09 -0.04 0.00 0.00 0.10 0.00 0.00 66.02 65.99 2dnt s SER 77 CO 0.38 -0.08 0.00 0.61 0.98 0.00 0.00 173.24 175.12