#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dig s SER 2 N 0.00 -0.97 -1.55 1.61 0.15 -1.26 -4.95 113.70 106.74 2dig s SER 2 Ca 0.00 1.10 -0.13 0.00 0.70 0.00 0.00 55.95 57.62 2dig s SER 2 Cb 0.00 2.01 0.09 0.00 -1.71 0.00 0.00 66.02 66.41 2dig s SER 2 CO 0.00 -0.18 0.89 -1.20 1.20 0.00 0.00 173.24 173.94 2dig n SER 3 N 5.31 -3.92 0.00 5.45 7.64 -1.26 -4.80 113.62 122.04 2dig n SER 3 Ca -0.08 -0.85 0.00 0.00 1.01 0.00 0.00 58.87 58.95 2dig n SER 3 Cb 0.51 -3.60 0.00 0.00 -1.01 0.00 0.00 64.21 60.11 2dig n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dig n GLY 4 N -1.64 2.80 3.08 0.23 0.00 -1.26 -5.17 105.19 103.24 2dig n GLY 4 Ca 0.00 -0.12 -0.19 0.00 0.00 0.00 0.00 46.02 45.71 2dig n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dig s SER 5 N 0.00 1.31 -0.70 1.61 0.15 -1.26 -4.86 113.70 109.96 2dig s SER 5 Ca 0.00 -0.33 -0.35 0.00 0.70 0.00 0.00 55.95 55.97 2dig s SER 5 Cb 0.00 -0.10 -0.18 0.00 -1.71 0.00 0.00 66.02 64.03 2dig s SER 5 CO 0.00 0.05 2.43 -1.20 1.20 0.00 0.00 173.24 175.72 2dig n SER 6 N 2.31 0.94 -0.02 5.45 7.64 -1.26 -4.73 113.62 123.95 2dig n SER 6 Ca -0.16 0.28 -0.07 0.00 1.01 0.00 0.00 58.87 59.93 2dig n SER 6 Cb 0.56 -1.04 -0.02 0.00 -1.01 0.00 0.00 64.21 62.69 2dig n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dig n GLY 7 N 6.74 -0.18 3.91 0.23 0.00 -1.26 -5.06 105.19 109.57 2dig n GLY 7 Ca 0.56 -0.08 -0.22 0.00 0.00 0.00 0.00 46.02 46.27 2dig n GLY 7 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2dig s MET 8 N -2.24 3.25 0.40 1.61 1.00 -1.26 -5.02 119.30 117.05 2dig s MET 8 Ca -0.12 -0.83 0.19 0.00 0.00 0.00 0.00 55.69 54.94 2dig s MET 8 Cb 0.03 -2.79 0.84 0.00 0.00 0.00 0.00 34.83 32.92 2dig s MET 8 CO 0.16 0.44 1.82 -1.00 0.00 0.00 0.00 175.02 176.44 2dig h PRO 9 N 1.49 0.00 -6.20 2.03 0.13 -2.02 -3.45 132.00 123.97 2dig h PRO 9 Ca -0.50 0.00 -0.68 0.00 -0.87 0.00 0.00 66.00 63.95 2dig h PRO 9 Cb 1.23 0.00 0.08 0.00 0.13 0.00 0.00 31.00 32.44 2dig h PRO 9 CO 0.62 0.32 0.05 0.43 -0.23 0.00 0.00 178.00 179.20 2dig n SER 10 N -3.67 0.52 -4.09 1.44 7.64 -1.26 -4.86 113.62 109.35 2dig n SER 10 Ca -0.01 1.14 -0.37 0.00 1.01 0.00 0.00 58.87 60.65 2dig n SER 10 Cb 0.43 -1.10 0.07 0.00 -1.01 0.00 0.00 64.21 62.60 2dig n SER 10 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 2dig n ARG 11 N 1.49 -0.35 -0.47 1.43 0.00 -1.26 -4.67 116.66 112.84 2dig n ARG 11 Ca 0.16 -0.09 0.42 0.00 -0.00 0.00 0.00 57.85 58.33 2dig n ARG 11 Cb 0.22 -1.20 0.76 0.00 -0.00 0.00 0.00 32.46 32.23 2dig n ARG 11 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.63 177.41 2dig h LYS 12 N -1.26 0.02 -4.68 2.89 3.64 -1.96 -3.27 116.57 111.95 2dig h LYS 12 Ca -0.43 -0.00 -0.68 0.00 -1.27 0.00 0.00 60.65 58.26 2dig h LYS 12 Cb 1.36 -0.00 -0.34 0.00 -0.41 0.00 0.00 32.23 32.84 2dig h LYS 12 CO 0.26 0.01 -0.66 -0.06 -2.27 0.00 0.00 179.45 176.73 2dig s PHE 13 N -4.96 3.39 0.43 1.91 0.08 -1.26 -5.09 117.98 112.48 2dig s PHE 13 Ca -0.05 -2.11 -0.22 0.00 0.12 0.00 0.00 56.93 54.67 2dig s PHE 13 Cb 0.25 -2.49 -0.13 0.00 -0.57 0.00 0.00 43.02 40.08 2dig s PHE 13 CO 0.84 -0.86 0.40 0.00 -0.10 0.00 0.00 175.22 175.50 2dig n ALA 14 N 4.59 -1.93 -1.86 5.36 0.00 -1.24 -4.83 120.51 120.60 2dig n ALA 14 Ca -0.09 0.13 -0.42 0.00 0.00 0.00 0.00 53.44 53.07 2dig n ALA 14 Cb 0.43 -1.69 -0.03 0.00 0.00 0.00 0.00 19.45 18.17 2dig n ALA 14 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2dig s ASP 15 N -0.98 6.54 0.00 0.00 1.11 -1.26 -1.79 116.67 120.29 2dig s ASP 15 Ca 0.62 2.72 0.00 0.00 0.18 0.00 0.00 52.55 56.08 2dig s ASP 15 Cb -0.60 -2.61 0.00 0.00 1.07 0.00 0.00 42.92 40.78 2dig s ASP 15 CO 0.59 -0.83 0.00 0.61 1.18 0.00 0.00 175.17 176.73 2dig n GLY 16 N 3.09 2.58 3.77 0.21 0.00 -0.33 -5.00 105.19 109.51 2dig n GLY 16 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 2dig n GLY 16 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2dig s GLU 17 N -0.41 4.19 -0.43 1.61 2.56 -0.74 -4.61 118.70 120.87 2dig s GLU 17 Ca 0.00 2.46 -0.19 0.00 0.00 0.00 0.00 54.97 57.24 2dig s GLU 17 Cb 0.00 -3.01 0.02 0.00 2.00 0.00 0.00 34.13 33.14 2dig s GLU 17 CO 0.00 -0.44 0.51 0.08 -0.56 0.00 0.00 175.26 174.85 2dig s VAL 18 N -0.97 4.99 0.32 3.70 1.01 -1.26 -2.18 120.40 126.01 2dig s VAL 18 Ca 0.53 -0.20 0.02 0.00 0.00 0.00 0.00 61.98 62.34 2dig s VAL 18 Cb -0.44 -4.10 -0.01 0.00 0.00 0.00 0.00 36.38 31.82 2dig s VAL 18 CO 0.58 -0.49 0.08 1.33 0.00 0.00 0.00 175.10 176.60 2dig n VAL 19 N 5.59 0.00 -3.79 2.92 0.24 -0.12 -4.95 118.33 118.22 2dig n VAL 19 Ca -0.05 -1.78 -0.37 0.00 -2.04 0.00 0.00 64.34 60.10 2dig n VAL 19 Cb 0.47 0.57 -0.06 0.00 -1.47 0.00 0.00 33.84 33.35 2dig n VAL 19 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 2dig s ARG 20 N -3.22 3.63 -0.07 7.34 1.81 -1.01 -0.22 118.95 127.22 2dig s ARG 20 Ca 0.11 -0.04 0.00 0.00 -1.72 0.00 0.00 55.73 54.08 2dig s ARG 20 Cb 0.01 -3.23 0.02 0.00 -0.45 0.00 0.00 34.95 31.30 2dig s ARG 20 CO 0.08 0.69 -0.05 0.20 -0.68 0.00 0.00 175.30 175.54 2dig s GLY 21 N -0.83 0.60 -0.40 -3.53 0.00 -0.54 -1.99 107.32 100.64 2dig s GLY 21 Ca 0.16 -0.24 -0.28 0.00 0.00 0.00 0.00 44.72 44.35 2dig s GLY 21 CO 0.05 0.63 1.66 -1.60 0.00 0.00 0.00 173.10 173.84 2dig s ARG 22 N 1.30 3.32 0.36 2.90 3.52 -0.86 -2.32 118.95 127.18 2dig s ARG 22 Ca -0.04 1.11 -0.28 0.00 -0.13 0.00 0.00 55.73 56.39 2dig s ARG 22 Cb -0.14 -4.16 -0.11 0.00 -1.56 0.00 0.00 34.95 28.99 2dig s ARG 22 CO -0.02 -1.88 1.42 -0.46 -0.81 0.00 0.00 175.30 173.55 2dig s TRP 23 N 6.63 2.74 -0.43 5.12 -0.11 -1.01 -4.91 118.94 126.98 2dig s TRP 23 Ca 0.71 1.26 -0.28 0.00 1.22 0.00 0.00 56.10 59.01 2dig s TRP 23 Cb -0.18 -3.90 -0.01 0.00 -1.50 0.00 0.00 33.47 27.88 2dig s TRP 23 CO 0.31 -2.60 1.75 -1.25 -4.62 0.00 0.00 176.95 170.54 2dig s PRO 24 N -2.01 3.17 0.00 5.86 0.04 -1.26 -2.45 135.00 138.34 2dig s PRO 24 Ca 0.52 1.09 0.00 0.00 0.04 0.00 0.00 61.00 62.65 2dig s PRO 24 Cb -0.44 -4.22 0.00 0.00 0.04 0.00 0.00 34.50 29.88 2dig s PRO 24 CO 0.59 -2.07 0.00 0.41 0.04 0.00 0.00 177.00 175.98 2dig n GLY 25 N 5.44 2.86 0.15 0.56 0.00 -1.26 -4.85 105.19 108.09 2dig n GLY 25 Ca 0.21 -0.78 0.02 0.00 0.00 0.00 0.00 46.02 45.47 2dig n GLY 25 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2dig h SER 26 N 0.79 0.00 -2.63 1.61 0.87 -1.92 -3.47 113.55 108.80 2dig h SER 26 Ca 0.00 0.00 -0.36 0.00 -1.23 0.00 0.00 61.79 60.20 2dig h SER 26 Cb 0.00 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 61.90 2dig h SER 26 CO 0.00 0.52 -0.42 -1.54 -0.53 0.00 0.00 176.83 174.86 2dig n SER 27 N -3.38 -5.03 -4.06 6.23 3.41 -1.03 -4.96 113.62 104.81 2dig n SER 27 Ca 0.01 0.18 -0.24 0.00 -0.26 0.00 0.00 58.87 58.56 2dig n SER 27 Cb 0.67 -4.31 -0.16 0.00 -0.26 0.00 0.00 64.21 60.15 2dig n SER 27 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2dig s LEU 28 N -5.41 1.77 -0.07 1.04 1.43 -1.26 -4.95 118.68 111.23 2dig s LEU 28 Ca 0.00 -0.29 -0.29 0.00 -1.03 0.00 0.00 54.13 52.52 2dig s LEU 28 Cb 0.00 -0.81 -0.02 0.00 0.03 0.00 0.00 46.19 45.39 2dig s LEU 28 CO 0.00 0.08 0.98 -0.31 0.23 0.00 0.00 176.35 177.33 2dig s TYR 29 N 0.34 3.57 0.19 0.29 1.51 -1.26 -2.40 117.35 119.59 2dig s TYR 29 Ca -0.08 1.61 0.08 0.00 -1.01 0.00 0.00 57.07 57.67 2dig s TYR 29 Cb -0.13 -3.14 -0.05 0.00 -0.11 0.00 0.00 41.96 38.53 2dig s TYR 29 CO 0.02 -0.14 -0.16 0.71 -1.11 0.00 0.00 175.55 174.88 2dig s TYR 30 N 1.61 1.75 -0.22 2.71 2.02 -0.98 -4.84 117.35 119.41 2dig s TYR 30 Ca 0.49 -0.53 -0.29 0.00 -0.37 0.00 0.00 57.07 56.37 2dig s TYR 30 Cb -0.19 -0.83 -0.04 0.00 -0.40 0.00 0.00 41.96 40.50 2dig s TYR 30 CO 0.21 0.36 1.90 -2.00 -1.57 0.00 0.00 175.55 174.45 2dig s GLU 31 N -3.38 3.51 0.10 -0.62 2.12 -1.26 -1.46 118.70 117.70 2dig s GLU 31 Ca 0.21 1.83 0.04 0.00 0.36 0.00 0.00 54.97 57.41 2dig s GLU 31 Cb -0.02 -4.20 -0.03 0.00 0.26 0.00 0.00 34.13 30.13 2dig s GLU 31 CO 0.07 -1.66 -0.11 0.14 -0.54 0.00 0.00 175.26 173.16 2dig s VAL 32 N 6.52 1.01 0.09 3.70 -7.23 0.69 -4.43 120.40 120.76 2dig s VAL 32 Ca 0.85 -1.60 0.02 0.00 -1.81 0.00 0.00 61.98 59.44 2dig s VAL 32 Cb -0.29 -1.33 -0.04 0.00 0.56 0.00 0.00 36.38 35.28 2dig s VAL 32 CO 0.34 -0.49 0.13 -0.70 -0.31 0.00 0.00 175.10 174.07 2dig s GLU 33 N -2.62 3.06 -0.25 4.82 2.12 -0.92 -0.94 118.70 123.96 2dig s GLU 33 Ca 0.05 -0.64 -0.20 0.00 0.36 0.00 0.00 54.97 54.53 2dig s GLU 33 Cb -0.04 -2.81 -0.02 0.00 0.26 0.00 0.00 34.13 31.52 2dig s GLU 33 CO 0.01 0.57 0.62 0.42 -0.54 0.00 0.00 175.26 176.34 2dig s ILE 34 N -1.48 4.99 -0.26 -3.70 -1.09 -0.93 -1.52 121.20 117.21 2dig s ILE 34 Ca 0.31 1.12 -0.15 0.00 -2.23 0.00 0.00 60.65 59.70 2dig s ILE 34 Cb -0.12 -3.93 -0.12 0.00 -1.58 0.00 0.00 42.46 36.71 2dig s ILE 34 CO 0.24 0.03 -0.29 0.18 -1.23 0.00 0.00 174.94 173.88 2dig n LEU 35 N 5.68 1.94 -3.83 2.97 4.77 0.38 -1.19 117.00 127.73 2dig n LEU 35 Ca -0.01 0.35 -0.06 0.00 -0.03 0.00 0.00 56.01 56.26 2dig n LEU 35 Cb 0.49 -0.83 -0.02 0.00 -2.33 0.00 0.00 43.42 40.73 2dig n LEU 35 CO 0.43 0.48 0.53 -0.94 -1.33 0.00 0.00 177.39 176.56 2dig s SER 36 N -7.32 -0.25 -0.06 -1.43 1.04 -1.01 -4.85 113.70 99.82 2dig s SER 36 Ca -0.37 -0.55 0.02 0.00 0.48 0.00 0.00 55.95 55.54 2dig s SER 36 Cb 0.13 0.67 0.01 0.00 0.10 0.00 0.00 66.02 66.93 2dig s SER 36 CO 0.50 -1.23 -0.12 -2.28 0.98 0.00 0.00 173.24 171.09 2dig s HIS 37 N -3.76 1.36 -0.27 5.02 2.46 -1.26 0.14 115.29 118.97 2dig s HIS 37 Ca 0.11 -0.47 -0.22 0.00 0.47 0.00 0.00 55.06 54.96 2dig s HIS 37 Cb -0.05 -1.00 -0.01 0.00 -0.13 0.00 0.00 32.58 31.40 2dig s HIS 37 CO 0.05 -0.24 0.71 -0.51 -2.47 0.00 0.00 174.74 172.29 2dig s ASP 38 N 0.56 6.64 -0.19 9.88 1.01 0.67 -4.94 116.67 130.30 2dig s ASP 38 Ca -0.12 0.71 -0.00 0.00 0.71 0.00 0.00 52.55 53.85 2dig s ASP 38 Cb -0.14 -2.37 0.14 0.00 1.01 0.00 0.00 42.92 41.55 2dig s ASP 38 CO 0.03 -0.48 1.92 -1.54 0.21 0.00 0.00 175.17 175.30 2dig n SER 39 N 5.93 5.69 0.07 0.27 3.41 -1.26 -2.88 113.62 124.85 2dig n SER 39 Ca 0.02 -2.77 0.00 0.00 -0.26 0.00 0.00 58.87 55.86 2dig n SER 39 Cb 0.48 -1.02 0.00 0.00 -0.26 0.00 0.00 64.21 63.41 2dig n SER 39 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 2dig n THR 40 N 0.69 0.61 -0.85 6.66 -1.04 -1.26 -4.86 114.28 114.23 2dig n THR 40 Ca 0.18 0.20 0.08 0.00 -2.04 0.00 0.00 64.05 62.48 2dig n THR 40 Cb 0.58 -1.06 0.29 0.00 -1.82 0.00 0.00 70.33 68.33 2dig n THR 40 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 2dig n SER 41 N -3.31 4.31 -3.93 8.00 7.64 -1.26 -4.95 113.62 120.12 2dig n SER 41 Ca 0.00 -2.84 -0.30 0.00 1.01 0.00 0.00 58.87 56.75 2dig n SER 41 Cb 0.00 -0.55 0.02 0.00 -1.01 0.00 0.00 64.21 62.67 2dig n SER 41 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2dig n GLN 42 N 0.02 -5.00 -4.32 1.43 3.00 -1.14 -4.93 117.38 106.44 2dig n GLN 42 Ca 0.22 0.56 -0.34 0.00 -0.01 0.00 0.00 57.00 57.43 2dig n GLN 42 Cb 0.92 -5.34 -0.11 0.00 0.00 0.00 0.00 30.24 25.70 2dig n GLN 42 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 2dig s LEU 43 N -7.19 3.41 -0.19 1.08 1.43 -1.22 -2.59 118.68 113.41 2dig s LEU 43 Ca 0.55 -0.05 -0.09 0.00 -1.03 0.00 0.00 54.13 53.51 2dig s LEU 43 Cb -0.28 -1.82 -0.05 0.00 0.03 0.00 0.00 46.19 44.07 2dig s LEU 43 CO 0.85 0.20 0.12 -0.31 0.23 0.00 0.00 176.35 177.43 2dig s TYR 44 N 0.20 3.39 -0.58 0.29 1.51 0.74 -0.24 117.35 122.65 2dig s TYR 44 Ca -0.00 0.30 -0.22 0.00 -1.01 0.00 0.00 57.07 56.13 2dig s TYR 44 Cb -0.13 -2.14 0.06 0.00 -0.11 0.00 0.00 41.96 39.64 2dig s TYR 44 CO 0.02 0.29 0.87 0.99 -1.11 0.00 0.00 175.55 176.60 2dig s THR 45 N 0.30 4.50 0.28 -0.71 2.01 0.12 -1.09 115.64 121.06 2dig s THR 45 Ca 0.07 -0.21 0.08 0.00 0.31 0.00 0.00 61.69 61.94 2dig s THR 45 Cb -0.11 -4.54 -0.04 0.00 0.01 0.00 0.00 72.50 67.82 2dig s THR 45 CO -0.01 -1.18 0.14 0.68 -0.69 0.00 0.00 174.62 173.56 2dig s VAL 46 N 3.62 3.76 -0.07 3.82 -7.23 -0.82 -0.47 120.40 123.02 2dig s VAL 46 Ca 0.23 -1.60 0.03 0.00 -1.81 0.00 0.00 61.98 58.83 2dig s VAL 46 Cb -0.16 -3.13 0.01 0.00 0.56 0.00 0.00 36.38 33.65 2dig s VAL 46 CO 0.13 -0.30 -0.15 -0.75 -0.31 0.00 0.00 175.10 173.72 2dig s LYS 47 N -3.82 1.99 0.25 4.82 2.20 -0.58 -1.96 119.74 122.65 2dig s LYS 47 Ca 0.35 -0.54 -0.12 0.00 -0.36 0.00 0.00 55.97 55.30 2dig s LYS 47 Cb -0.06 -1.61 -0.08 0.00 -1.51 0.00 0.00 37.83 34.57 2dig s LYS 47 CO 0.23 0.09 0.61 0.71 -0.36 0.00 0.00 175.35 176.63 2dig s TYR 48 N 0.50 3.44 0.18 4.03 1.51 0.73 -2.16 117.35 125.59 2dig s TYR 48 Ca -0.14 1.02 -0.23 0.00 -1.01 0.00 0.00 57.07 56.71 2dig s TYR 48 Cb -0.16 -2.37 0.08 0.00 -0.11 0.00 0.00 41.96 39.40 2dig s TYR 48 CO 0.05 0.24 1.46 1.17 -1.11 0.00 0.00 175.55 177.35 2dig n LYS 49 N -0.05 -0.32 -0.36 -0.62 4.81 -1.26 0.14 118.16 120.49 2dig n LYS 49 Ca 0.01 1.44 0.30 0.00 -0.87 0.00 0.00 58.31 59.18 2dig n LYS 49 Cb 0.52 -2.12 0.56 0.00 0.02 0.00 0.00 35.03 34.01 2dig n LYS 49 CO 0.00 0.00 0.00 -0.44 1.17 0.00 0.00 177.40 178.13 2dig h ASP 50 N 0.00 0.38 0.00 3.14 3.32 -1.97 -3.44 116.42 117.86 2dig h ASP 50 Ca 0.24 0.19 0.00 0.00 0.02 0.00 0.00 57.03 57.47 2dig h ASP 50 Cb 0.47 0.16 0.00 0.00 0.22 0.00 0.00 39.33 40.19 2dig h ASP 50 CO -0.91 -0.22 0.00 0.61 -1.72 0.00 0.00 179.24 177.00 2dig n GLY 51 N -1.36 1.56 3.56 2.75 0.00 0.38 -5.14 105.19 106.94 2dig n GLY 51 Ca 0.35 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.03 2dig n GLY 51 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2dig s THR 52 N -2.00 3.67 -0.11 2.61 2.01 -1.18 -4.88 115.64 115.75 2dig s THR 52 Ca 0.00 -0.49 -0.00 0.00 0.31 0.00 0.00 61.69 61.51 2dig s THR 52 Cb 0.00 -2.51 -0.02 0.00 0.01 0.00 0.00 72.50 69.98 2dig s THR 52 CO 0.00 0.59 -0.09 -1.61 -0.69 0.00 0.00 174.62 172.82 2dig s GLU 53 N -0.67 3.20 0.23 4.92 2.02 -1.26 -0.19 118.70 126.96 2dig s GLU 53 Ca 0.10 -0.61 0.01 0.00 0.02 0.00 0.00 54.97 54.50 2dig s GLU 53 Cb -0.11 -2.67 -0.04 0.00 0.10 0.00 0.00 34.13 31.41 2dig s GLU 53 CO 0.02 0.38 0.17 -0.51 0.02 0.00 0.00 175.26 175.34 2dig s LEU 54 N -0.07 1.30 -0.30 1.80 1.43 -0.83 -4.99 118.68 117.03 2dig s LEU 54 Ca -0.01 -1.48 0.03 0.00 -1.03 0.00 0.00 54.13 51.64 2dig s LEU 54 Cb -0.14 0.43 0.07 0.00 0.03 0.00 0.00 46.19 46.59 2dig s LEU 54 CO 0.03 -0.90 -0.03 -1.61 0.23 0.00 0.00 176.35 174.07 2dig s GLU 55 N -3.97 2.00 -0.14 1.70 2.02 -1.26 -1.94 118.70 117.11 2dig s GLU 55 Ca 0.39 -1.54 -0.03 0.00 0.02 0.00 0.00 54.97 53.82 2dig s GLU 55 Cb 0.06 -3.06 -0.03 0.00 0.10 0.00 0.00 34.13 31.21 2dig s GLU 55 CO 0.16 -0.72 -0.06 -0.51 0.02 0.00 0.00 175.26 174.15 2dig s LEU 56 N 1.05 3.14 0.58 1.80 1.43 -0.25 -4.77 118.68 121.67 2dig s LEU 56 Ca -0.01 -0.15 -0.19 0.00 -1.03 0.00 0.00 54.13 52.74 2dig s LEU 56 Cb -0.20 -1.74 -0.04 0.00 0.03 0.00 0.00 46.19 44.24 2dig s LEU 56 CO -0.06 0.19 1.22 -0.54 0.23 0.00 0.00 176.35 177.40 2dig s LYS 57 N 0.22 3.02 0.52 1.70 1.02 -1.26 -0.19 119.74 124.77 2dig s LYS 57 Ca -0.04 1.88 0.43 0.00 0.02 0.00 0.00 55.97 58.26 2dig s LYS 57 Cb -0.14 -1.99 1.63 0.00 -0.52 0.00 0.00 37.83 36.81 2dig s LYS 57 CO 0.03 -1.18 1.62 1.49 -0.92 0.00 0.00 175.35 176.39 2dig h GLU 58 N 1.00 0.02 -0.04 1.68 4.81 -1.84 0.82 114.58 121.03 2dig h GLU 58 Ca -0.50 -0.00 -0.09 0.00 -0.13 0.00 0.00 59.36 58.63 2dig h GLU 58 Cb 1.30 -0.00 0.01 0.00 0.63 0.00 0.00 28.75 30.68 2dig h GLU 58 CO 0.56 0.01 -0.33 -0.97 -0.73 0.00 0.00 179.01 177.55 2dig h ASN 59 N 0.02 0.36 -0.11 1.04 -0.73 -1.88 -3.15 115.58 111.14 2dig h ASN 59 Ca 0.85 -0.69 0.03 0.00 1.87 0.00 0.00 56.30 58.36 2dig h ASN 59 Cb 3.22 -0.11 -0.00 0.00 0.27 0.00 0.00 38.32 41.70 2dig h ASN 59 CO -0.13 1.00 0.12 0.44 -0.37 0.00 0.00 177.43 178.49 2dig h ASP 60 N -0.24 0.00 -3.02 1.15 5.19 0.33 -3.40 116.42 116.42 2dig h ASP 60 Ca -0.03 0.00 -0.62 0.00 -0.62 0.00 0.00 57.03 55.76 2dig h ASP 60 Cb 1.01 0.00 -0.08 0.00 0.18 0.00 0.00 39.33 40.45 2dig h ASP 60 CO 0.07 0.00 -0.32 -0.63 -3.12 0.00 0.00 179.24 175.24 2dig s ILE 61 N -4.63 5.25 0.06 0.35 1.01 -0.75 -2.02 121.20 120.48 2dig s ILE 61 Ca -0.05 0.57 -0.14 0.00 0.00 0.00 0.00 60.65 61.04 2dig s ILE 61 Cb 0.15 -3.60 0.02 0.00 0.01 0.00 0.00 42.46 39.04 2dig s ILE 61 CO 0.54 0.52 0.32 -1.59 0.00 0.00 0.00 174.94 174.73 2dig s LYS 62 N -0.48 0.87 0.11 2.79 -2.85 -0.84 -4.90 119.74 114.45 2dig s LYS 62 Ca 0.19 -0.58 0.03 0.00 -1.00 0.00 0.00 55.97 54.61 2dig s LYS 62 Cb -0.14 0.38 -0.04 0.00 -2.06 0.00 0.00 37.83 35.97 2dig s LYS 62 CO 0.07 -0.30 0.12 0.45 0.10 0.00 0.00 175.35 175.80 2dig s SER 63 N -2.30 5.64 -0.25 0.03 0.15 -1.26 -2.39 113.70 113.32 2dig s SER 63 Ca -0.02 -0.02 -0.28 0.00 0.70 0.00 0.00 55.95 56.33 2dig s SER 63 Cb 0.00 -1.53 0.16 0.00 -1.71 0.00 0.00 66.02 62.94 2dig s SER 63 CO -0.06 0.13 1.20 -0.83 1.20 0.00 0.00 173.24 174.88 2dig s GLY 64 N -2.71 -0.02 1.01 9.45 0.00 -1.26 -5.01 107.32 108.78 2dig s GLY 64 Ca 0.31 2.68 -0.17 0.00 0.00 0.00 0.00 44.72 47.54 2dig s GLY 64 CO 0.23 1.38 0.89 -1.55 0.00 0.00 0.00 173.10 174.06 2dig n PRO 65 N 1.11 -2.78 -3.56 2.90 -0.04 -1.26 -4.97 135.00 126.41 2dig n PRO 65 Ca -0.08 -1.43 -0.06 0.00 -0.04 0.00 0.00 63.50 61.89 2dig n PRO 65 Cb 0.58 -1.34 -0.02 0.00 -0.04 0.00 0.00 33.50 32.67 2dig n PRO 65 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2dig s SER 66 N -3.91 -0.23 -0.13 3.54 1.04 -1.26 -5.10 113.70 107.64 2dig s SER 66 Ca 0.58 0.00 -0.14 0.00 0.48 0.00 0.00 55.95 56.87 2dig s SER 66 Cb -0.06 0.25 -0.05 0.00 0.10 0.00 0.00 66.02 66.26 2dig s SER 66 CO 0.45 -0.40 -0.28 -1.20 0.98 0.00 0.00 173.24 172.79 2dig n SER 67 N -0.15 1.66 0.00 7.02 7.64 -1.26 -5.36 113.62 123.18 2dig n SER 67 Ca -0.03 0.28 0.00 0.00 1.01 0.00 0.00 58.87 60.12 2dig n SER 67 Cb 0.60 -0.66 0.00 0.00 -1.01 0.00 0.00 64.21 63.13 2dig n SER 67 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64