#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cp3 n SER 2 N 0.00 -5.86 -0.06 1.61 7.64 -1.26 -4.86 113.62 110.83 2cp3 n SER 2 Ca 0.00 -0.09 -0.08 0.00 1.01 0.00 0.00 58.87 59.71 2cp3 n SER 2 Cb 0.00 -4.82 -0.07 0.00 -1.01 0.00 0.00 64.21 58.31 2cp3 n SER 2 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2cp3 n SER 3 N -2.02 2.81 0.00 6.43 7.64 -1.26 -4.95 113.62 122.26 2cp3 n SER 3 Ca -0.21 -0.05 0.00 0.00 1.01 0.00 0.00 58.87 59.62 2cp3 n SER 3 Cb 0.67 0.05 0.00 0.00 -1.01 0.00 0.00 64.21 63.92 2cp3 n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2cp3 n GLY 4 N 2.72 -0.65 2.91 0.23 0.00 -1.26 -5.17 105.19 103.97 2cp3 n GLY 4 Ca -0.22 0.32 -0.03 0.00 0.00 0.00 0.00 46.02 46.09 2cp3 n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2cp3 n SER 5 N 0.00 -1.43 -4.69 1.61 3.41 -1.26 -5.19 113.62 106.07 2cp3 n SER 5 Ca 0.00 -1.82 -0.33 0.00 -0.26 0.00 0.00 58.87 56.46 2cp3 n SER 5 Cb 0.00 2.34 -0.07 0.00 -0.26 0.00 0.00 64.21 66.22 2cp3 n SER 5 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2cp3 s SER 6 N -2.79 4.00 -0.18 4.04 0.01 -1.26 -4.77 113.70 112.75 2cp3 s SER 6 Ca 0.16 -1.69 -0.15 0.00 1.31 0.00 0.00 55.95 55.58 2cp3 s SER 6 Cb -0.03 0.60 -0.07 0.00 0.21 0.00 0.00 66.02 66.74 2cp3 s SER 6 CO 0.05 -0.90 -0.27 0.61 0.41 0.00 0.00 173.24 173.14 2cp3 n GLY 7 N -1.25 -0.66 3.83 3.44 0.00 -1.26 -4.99 105.19 104.30 2cp3 n GLY 7 Ca -0.19 -0.24 -0.31 0.00 0.00 0.00 0.00 46.02 45.28 2cp3 n GLY 7 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2cp3 s LEU 8 N -7.94 3.20 0.08 0.99 1.43 -1.26 -5.08 118.68 110.09 2cp3 s LEU 8 Ca -0.26 1.61 0.01 0.00 -1.03 0.00 0.00 54.13 54.46 2cp3 s LEU 8 Cb 0.05 -4.50 -0.04 0.00 0.03 0.00 0.00 46.19 41.73 2cp3 s LEU 8 CO 0.39 -1.31 -0.05 -0.13 0.23 0.00 0.00 176.35 175.47 2cp3 s ARG 9 N -4.93 0.74 -0.31 1.70 0.52 -1.26 -5.01 118.95 110.40 2cp3 s ARG 9 Ca 0.58 -1.27 -0.28 0.00 -0.52 0.00 0.00 55.73 54.23 2cp3 s ARG 9 Cb -0.14 -0.06 -0.02 0.00 0.52 0.00 0.00 34.95 35.25 2cp3 s ARG 9 CO 0.52 -0.05 1.79 -0.51 0.02 0.00 0.00 175.30 177.07 2cp3 s LEU 10 N -2.95 3.54 0.00 2.53 1.43 -1.26 -3.10 118.68 118.87 2cp3 s LEU 10 Ca 0.09 1.36 0.00 0.00 -1.03 0.00 0.00 54.13 54.55 2cp3 s LEU 10 Cb 0.06 -3.53 0.00 0.00 0.03 0.00 0.00 46.19 42.75 2cp3 s LEU 10 CO -0.06 -1.66 0.00 0.61 0.23 0.00 0.00 176.35 175.47 2cp3 n GLY 11 N 5.36 1.29 3.30 -3.19 0.00 -0.87 -5.04 105.19 106.04 2cp3 n GLY 11 Ca 0.23 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.03 2cp3 n GLY 11 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2cp3 s ASP 12 N -2.00 2.50 -0.26 1.61 1.01 -1.18 -4.91 116.67 113.44 2cp3 s ASP 12 Ca 0.00 -0.79 -0.21 0.00 0.71 0.00 0.00 52.55 52.26 2cp3 s ASP 12 Cb 0.00 -0.13 -0.02 0.00 1.01 0.00 0.00 42.92 43.78 2cp3 s ASP 12 CO 0.00 -0.02 0.66 -0.13 0.21 0.00 0.00 175.17 175.89 2cp3 s ARG 13 N -2.45 4.10 0.33 8.23 3.00 -1.26 -0.26 118.95 130.64 2cp3 s ARG 13 Ca 0.11 0.59 0.03 0.00 0.00 0.00 0.00 55.73 56.46 2cp3 s ARG 13 Cb -0.07 -3.66 -0.06 0.00 0.00 0.00 0.00 34.95 31.16 2cp3 s ARG 13 CO 0.05 -0.45 0.07 0.14 0.00 0.00 0.00 175.30 175.12 2cp3 s VAL 14 N 2.58 1.01 -0.10 3.52 -7.23 0.11 -2.64 120.40 117.65 2cp3 s VAL 14 Ca 0.28 -2.00 -0.01 0.00 -1.81 0.00 0.00 61.98 58.43 2cp3 s VAL 14 Cb -0.15 -2.71 -0.03 0.00 0.56 0.00 0.00 36.38 34.05 2cp3 s VAL 14 CO 0.09 0.00 -0.04 -0.22 -0.31 0.00 0.00 175.10 174.61 2cp3 s LEU 15 N -3.48 3.29 -0.27 1.32 2.96 0.29 -1.23 118.68 121.57 2cp3 s LEU 15 Ca 0.35 -0.02 0.02 0.00 -0.22 0.00 0.00 54.13 54.27 2cp3 s LEU 15 Cb 0.08 -1.75 0.06 0.00 0.50 0.00 0.00 46.19 45.08 2cp3 s LEU 15 CO 0.15 0.31 -0.08 -0.69 -1.32 0.00 0.00 176.35 174.72 2cp3 s VAL 16 N -0.46 2.29 0.00 1.68 1.01 0.87 -2.89 120.40 122.89 2cp3 s VAL 16 Ca 0.07 -1.68 0.00 0.00 0.00 0.00 0.00 61.98 60.37 2cp3 s VAL 16 Cb -0.12 -2.38 0.00 0.00 0.00 0.00 0.00 36.38 33.88 2cp3 s VAL 16 CO 0.02 -0.10 0.00 0.61 0.00 0.00 0.00 175.10 175.63 2cp3 n GLY 17 N 4.44 3.11 0.00 4.51 0.00 -1.26 -3.25 105.19 112.74 2cp3 n GLY 17 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.90 2cp3 n GLY 17 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cp3 n GLY 18 N -0.86 1.97 0.23 -0.02 0.00 -1.26 -4.94 105.19 100.32 2cp3 n GLY 18 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2cp3 n GLY 18 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2cp3 n THR 19 N -0.29 0.00 -1.75 2.61 5.66 -1.26 -5.09 114.28 114.15 2cp3 n THR 19 Ca 0.00 0.00 -0.40 0.00 -3.05 0.00 0.00 64.05 60.60 2cp3 n THR 19 Cb 0.00 0.00 -0.03 0.00 -1.55 0.00 0.00 70.33 68.75 2cp3 n THR 19 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 175.07 171.48 2cp3 s LYS 20 N -1.85 2.76 0.02 1.09 1.02 -1.20 -4.83 119.74 116.73 2cp3 s LYS 20 Ca 0.00 1.46 -0.25 0.00 0.02 0.00 0.00 55.97 57.19 2cp3 s LYS 20 Cb 0.00 -4.41 -0.05 0.00 -0.52 0.00 0.00 37.83 32.86 2cp3 s LYS 20 CO 0.00 -2.54 0.77 0.95 -0.92 0.00 0.00 175.35 173.61 2cp3 s THR 21 N 9.39 4.82 0.09 2.17 -4.23 -1.26 -0.09 115.64 126.52 2cp3 s THR 21 Ca 0.89 1.63 -0.18 0.00 -1.18 0.00 0.00 61.69 62.86 2cp3 s THR 21 Cb -0.22 -4.12 0.04 0.00 1.34 0.00 0.00 72.50 69.54 2cp3 s THR 21 CO 0.29 0.32 0.43 -0.83 -0.54 0.00 0.00 174.62 174.29 2cp3 s GLY 22 N 0.24 -0.31 0.06 3.99 0.00 -0.36 -4.35 107.32 106.59 2cp3 s GLY 22 Ca 0.40 0.17 -0.18 0.00 0.00 0.00 0.00 44.72 45.10 2cp3 s GLY 22 CO 0.22 -0.10 0.54 0.14 0.00 0.00 0.00 173.10 173.90 2cp3 s VAL 23 N -3.24 4.79 0.07 1.40 1.01 -0.66 -0.72 120.40 123.05 2cp3 s VAL 23 Ca -0.01 1.15 -0.31 0.00 0.00 0.00 0.00 61.98 62.81 2cp3 s VAL 23 Cb 0.01 -3.86 -0.07 0.00 0.00 0.00 0.00 36.38 32.45 2cp3 s VAL 23 CO -0.08 0.55 1.43 -0.69 0.00 0.00 0.00 175.10 176.31 2cp3 s VAL 24 N -1.11 3.41 -0.10 2.92 1.01 0.65 0.07 120.40 127.24 2cp3 s VAL 24 Ca 0.28 0.93 0.08 0.00 0.00 0.00 0.00 61.98 63.27 2cp3 s VAL 24 Cb -0.19 -3.60 -0.11 0.00 0.00 0.00 0.00 36.38 32.48 2cp3 s VAL 24 CO 0.18 0.04 0.01 0.54 0.00 0.00 0.00 175.10 175.87 2cp3 n ARG 25 N 4.67 2.13 -4.30 2.72 5.12 0.19 -2.05 116.66 125.14 2cp3 n ARG 25 Ca 0.13 0.01 -0.18 0.00 -1.93 0.00 0.00 57.85 55.87 2cp3 n ARG 25 Cb 0.42 -1.25 -0.15 0.00 -1.16 0.00 0.00 32.46 30.33 2cp3 n ARG 25 CO 0.00 0.00 0.00 -0.47 -1.93 0.00 0.00 177.63 175.23 2cp3 s TYR 26 N -2.24 0.74 -0.03 -1.55 5.04 -1.03 -4.93 117.35 113.35 2cp3 s TYR 26 Ca -0.06 -0.15 -0.02 0.00 -2.44 0.00 0.00 57.07 54.39 2cp3 s TYR 26 Cb 0.03 -0.51 0.01 0.00 0.35 0.00 0.00 41.96 41.85 2cp3 s TYR 26 CO 0.38 -0.05 0.07 0.08 -1.34 0.00 0.00 175.55 174.69 2cp3 s VAL 27 N 0.01 -0.01 -0.50 3.14 1.01 -1.26 -0.92 120.40 121.86 2cp3 s VAL 27 Ca 0.00 0.05 0.00 0.00 0.00 0.00 0.00 61.98 62.03 2cp3 s VAL 27 Cb -0.05 -0.11 0.00 0.00 0.00 0.00 0.00 36.38 36.22 2cp3 s VAL 27 CO -0.00 0.02 0.00 0.61 0.00 0.00 0.00 175.10 175.73 2cp3 n GLY 28 N 3.31 0.23 2.93 4.51 0.00 -1.17 -5.05 105.19 109.96 2cp3 n GLY 28 Ca -0.16 -1.77 -0.17 0.00 0.00 0.00 0.00 46.02 43.92 2cp3 n GLY 28 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2cp3 n GLU 29 N 0.00 0.07 -4.03 1.61 1.02 -1.26 -1.07 120.64 116.97 2cp3 n GLU 29 Ca 0.00 -2.06 -0.19 0.00 -0.02 0.00 0.00 57.16 54.89 2cp3 n GLU 29 Cb 0.00 -0.50 -0.07 0.00 -0.02 0.00 0.00 31.44 30.85 2cp3 n GLU 29 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 2cp3 n THR 30 N -2.49 0.00 -1.60 2.62 -2.24 -1.26 -4.73 114.28 104.58 2cp3 n THR 30 Ca 0.12 -2.13 -0.02 0.00 -2.27 0.00 0.00 64.05 59.76 2cp3 n THR 30 Cb 0.45 0.93 0.18 0.00 -2.10 0.00 0.00 70.33 69.79 2cp3 n THR 30 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2cp3 n ASP 31 N -1.73 2.48 0.00 3.42 8.00 -1.26 -4.70 116.55 122.76 2cp3 n ASP 31 Ca 0.02 -3.85 0.00 0.00 0.71 0.00 0.00 54.79 51.66 2cp3 n ASP 31 Cb 0.54 -0.55 0.00 0.00 -0.02 0.00 0.00 41.12 41.08 2cp3 n ASP 31 CO 0.00 0.00 0.00 2.22 -0.39 0.00 0.00 177.20 179.03 2cp3 n PHE 32 N -1.07 -0.56 -4.28 1.24 -1.74 -1.26 -5.11 117.46 104.68 2cp3 n PHE 32 Ca 0.28 0.00 -0.27 0.00 -0.56 0.00 0.00 57.45 56.90 2cp3 n PHE 32 Cb 0.85 0.36 -0.09 0.00 1.52 0.00 0.00 39.48 42.11 2cp3 n PHE 32 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 2cp3 s ALA 33 N -1.71 2.95 0.91 1.98 0.00 -1.26 -5.14 121.76 119.48 2cp3 s ALA 33 Ca 0.00 -1.43 -0.14 0.00 0.00 0.00 0.00 51.96 50.39 2cp3 s ALA 33 Cb 0.00 -0.77 0.17 0.00 0.00 0.00 0.00 23.12 22.52 2cp3 s ALA 33 CO 0.00 0.50 1.26 0.15 0.00 0.00 0.00 175.76 177.67 2cp3 s LYS 34 N -2.72 1.04 5.03 0.00 1.02 -1.26 -4.30 119.74 118.56 2cp3 s LYS 34 Ca 0.24 -0.34 0.00 0.00 0.02 0.00 0.00 55.97 55.89 2cp3 s LYS 34 Cb -0.09 -1.91 0.00 0.00 -0.52 0.00 0.00 37.83 35.31 2cp3 s LYS 34 CO 0.15 -2.14 0.00 0.41 -0.92 0.00 0.00 175.35 172.85 2cp3 n GLY 35 N -3.59 0.35 3.04 -3.33 0.00 -1.26 -4.83 105.19 95.58 2cp3 n GLY 35 Ca 0.13 -0.81 -0.13 0.00 0.00 0.00 0.00 46.02 45.22 2cp3 n GLY 35 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2cp3 s GLU 36 N 0.00 0.20 0.21 1.61 2.02 -1.26 -4.57 118.70 116.91 2cp3 s GLU 36 Ca 0.00 0.39 0.09 0.00 0.02 0.00 0.00 54.97 55.47 2cp3 s GLU 36 Cb 0.00 -0.03 -0.05 0.00 0.10 0.00 0.00 34.13 34.16 2cp3 s GLU 36 CO 0.00 -0.10 -0.16 -1.58 0.02 0.00 0.00 175.26 173.44 2cp3 s TRP 37 N 0.73 1.84 -0.11 1.61 0.52 -0.23 -2.81 118.94 120.49 2cp3 s TRP 37 Ca -0.05 -0.51 -0.01 0.00 0.02 0.00 0.00 56.10 55.55 2cp3 s TRP 37 Cb -0.07 -0.85 0.03 0.00 -1.15 0.00 0.00 33.47 31.43 2cp3 s TRP 37 CO -0.04 0.42 -0.04 0.00 0.02 0.00 0.00 176.95 177.31 2cp3 s GLY 39 N 1.81 1.53 -0.00 0.00 0.00 -0.10 -2.80 107.32 107.75 2cp3 s GLY 39 Ca 0.04 -0.47 -0.05 0.00 0.00 0.00 0.00 44.72 44.25 2cp3 s GLY 39 CO -0.07 2.08 0.23 0.14 0.00 0.00 0.00 173.10 175.47 2cp3 s VAL 40 N 3.62 5.37 -0.29 1.40 1.01 -0.58 0.53 120.40 131.45 2cp3 s VAL 40 Ca 0.39 0.02 -0.06 0.00 0.00 0.00 0.00 61.98 62.33 2cp3 s VAL 40 Cb -0.11 -3.55 0.02 0.00 0.00 0.00 0.00 36.38 32.73 2cp3 s VAL 40 CO 0.21 0.35 0.06 -0.70 0.00 0.00 0.00 175.10 175.01 2cp3 s GLU 41 N -1.83 3.00 0.08 2.72 -6.30 0.11 -1.09 118.70 115.39 2cp3 s GLU 41 Ca 0.27 -0.91 -0.12 0.00 -2.50 0.00 0.00 54.97 51.71 2cp3 s GLU 41 Cb -0.13 -3.31 -0.06 0.00 0.00 0.00 0.00 34.13 30.63 2cp3 s GLU 41 CO 0.17 -0.46 0.44 -0.51 0.02 0.00 0.00 175.26 174.92 2cp3 s LEU 42 N 1.46 4.37 0.14 2.70 1.43 0.94 -1.66 118.68 128.06 2cp3 s LEU 42 Ca 0.02 0.90 -0.10 0.00 -1.03 0.00 0.00 54.13 53.92 2cp3 s LEU 42 Cb -0.17 -2.98 -0.04 0.00 0.03 0.00 0.00 46.19 43.03 2cp3 s LEU 42 CO 0.01 0.18 1.45 0.44 0.23 0.00 0.00 176.35 178.66 2cp3 h ASP 43 N 3.86 0.93 -3.37 2.29 5.19 -1.87 -3.45 116.42 120.01 2cp3 h ASP 43 Ca -0.49 -0.48 -0.55 0.00 -0.62 0.00 0.00 57.03 54.89 2cp3 h ASP 43 Cb 1.20 -0.27 -0.03 0.00 0.18 0.00 0.00 39.33 40.41 2cp3 h ASP 43 CO 0.65 1.26 -0.16 -1.61 -3.12 0.00 0.00 179.24 176.27 2cp3 s GLU 44 N -4.20 3.77 -0.81 3.56 0.41 -1.26 -4.97 118.70 115.19 2cp3 s GLU 44 Ca -0.10 0.20 -0.23 0.00 -0.41 0.00 0.00 54.97 54.43 2cp3 s GLU 44 Cb 0.11 -2.71 -0.16 0.00 -1.78 0.00 0.00 34.13 29.59 2cp3 s GLU 44 CO 0.88 0.36 1.91 -0.35 -0.49 0.00 0.00 175.26 177.57 2cp3 n PRO 45 N -0.04 1.44 -0.97 0.39 -0.04 -1.26 -4.46 135.00 130.06 2cp3 n PRO 45 Ca -0.00 -1.92 0.03 0.00 -0.04 0.00 0.00 63.50 61.56 2cp3 n PRO 45 Cb 0.52 -3.06 0.15 0.00 -0.04 0.00 0.00 33.50 31.07 2cp3 n PRO 45 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2cp3 n LEU 46 N 8.97 2.41 0.00 1.53 4.77 -1.16 -5.01 117.00 128.51 2cp3 n LEU 46 Ca 0.49 -3.48 -0.23 0.00 -0.03 0.00 0.00 56.01 52.76 2cp3 n LEU 46 Cb 0.42 -0.36 0.01 0.00 -2.33 0.00 0.00 43.42 41.15 2cp3 n LEU 46 CO 0.98 1.22 0.10 0.61 -1.33 0.00 0.00 177.39 178.97 2cp3 n GLY 47 N -0.68 2.65 0.04 -0.72 0.00 -0.69 -5.01 105.19 100.78 2cp3 n GLY 47 Ca 0.17 -2.28 -0.05 0.00 0.00 0.00 0.00 46.02 43.87 2cp3 n GLY 47 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2cp3 n LYS 48 N -1.75 1.43 -4.27 1.61 4.76 -1.26 -4.74 118.16 113.95 2cp3 n LYS 48 Ca 0.01 0.03 -0.25 0.00 -2.87 0.00 0.00 58.31 55.22 2cp3 n LYS 48 Cb 0.57 -1.17 -0.06 0.00 -1.84 0.00 0.00 35.03 32.53 2cp3 n LYS 48 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 2cp3 n ASN 49 N -2.52 2.01 -1.58 4.39 3.02 -1.20 -4.77 115.26 114.62 2cp3 n ASN 49 Ca -0.13 -2.98 -0.10 0.00 -0.03 0.00 0.00 54.58 51.34 2cp3 n ASN 49 Cb 0.69 0.69 0.09 0.00 -0.61 0.00 0.00 39.78 40.64 2cp3 n ASN 49 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 2cp3 n ASP 50 N -1.46 3.31 -0.15 6.41 5.68 -1.26 -2.71 116.55 126.38 2cp3 n ASP 50 Ca -0.11 -3.55 -0.01 0.00 -0.50 0.00 0.00 54.79 50.62 2cp3 n ASP 50 Cb 0.56 -0.41 -0.00 0.00 -1.14 0.00 0.00 41.12 40.13 2cp3 n ASP 50 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2cp3 n GLY 51 N -0.77 0.34 2.72 6.12 0.00 -1.26 -3.75 105.19 108.60 2cp3 n GLY 51 Ca 0.30 -0.86 -0.28 0.00 0.00 0.00 0.00 46.02 45.18 2cp3 n GLY 51 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cp3 s ALA 52 N -2.06 1.00 -0.30 4.61 0.00 -1.26 -2.59 121.76 121.16 2cp3 s ALA 52 Ca 0.00 -0.78 -0.10 0.00 0.00 0.00 0.00 51.96 51.07 2cp3 s ALA 52 Cb 0.00 -1.22 -0.03 0.00 0.00 0.00 0.00 23.12 21.87 2cp3 s ALA 52 CO 0.00 -1.24 0.17 0.08 0.00 0.00 0.00 175.76 174.77 2cp3 s VAL 53 N 1.86 4.94 -1.75 0.00 1.01 0.06 -4.38 120.40 122.15 2cp3 s VAL 53 Ca 0.01 -0.15 0.00 0.00 0.00 0.00 0.00 61.98 61.83 2cp3 s VAL 53 Cb -0.17 -3.44 0.00 0.00 0.00 0.00 0.00 36.38 32.77 2cp3 s VAL 53 CO -0.11 0.15 0.00 0.00 0.00 0.00 0.00 175.10 175.14 2cp3 n ALA 54 N 5.03 -0.59 0.00 5.51 0.00 -1.26 -1.54 120.51 127.66 2cp3 n ALA 54 Ca -0.14 0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.47 2cp3 n ALA 54 Cb 0.50 -2.14 0.00 0.00 0.00 0.00 0.00 19.45 17.82 2cp3 n ALA 54 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2cp3 n GLY 55 N -1.00 2.99 3.61 0.00 0.00 -1.26 -5.01 105.19 104.52 2cp3 n GLY 55 Ca -0.24 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.35 2cp3 n GLY 55 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2cp3 s THR 56 N -2.45 4.03 -0.25 2.61 2.01 -0.59 -4.98 115.64 116.02 2cp3 s THR 56 Ca 0.00 1.10 -0.08 0.00 0.31 0.00 0.00 61.69 63.02 2cp3 s THR 56 Cb 0.00 -4.22 -0.03 0.00 0.01 0.00 0.00 72.50 68.25 2cp3 s THR 56 CO 0.00 -0.67 0.09 -0.60 -0.69 0.00 0.00 174.62 172.76 2cp3 s ARG 57 N 4.58 3.75 -0.08 4.92 3.52 -1.26 -0.76 118.95 133.63 2cp3 s ARG 57 Ca 0.58 -0.43 -0.02 0.00 -0.13 0.00 0.00 55.73 55.73 2cp3 s ARG 57 Cb -0.14 -3.38 -0.26 0.00 -1.56 0.00 0.00 34.95 29.60 2cp3 s ARG 57 CO 0.29 -0.14 0.54 1.88 -0.81 0.00 0.00 175.30 177.06 2cp3 h TYR 58 N 8.10 0.38 -3.86 5.12 0.05 -1.89 -3.48 116.97 121.40 2cp3 h TYR 58 Ca -0.37 -0.28 -0.29 0.00 0.05 0.00 0.00 58.73 57.84 2cp3 h TYR 58 Cb 1.18 -0.02 -0.28 0.00 1.01 0.00 0.00 36.73 38.63 2cp3 h TYR 58 CO 0.68 1.52 -0.74 -0.59 -1.05 0.00 0.00 178.16 177.98 2cp3 s PHE 59 N -2.58 0.33 -0.27 4.88 -0.71 -1.25 -5.10 117.98 113.28 2cp3 s PHE 59 Ca -0.15 -0.10 -0.29 0.00 -1.04 0.00 0.00 56.93 55.35 2cp3 s PHE 59 Cb 0.07 -0.21 0.01 0.00 -1.21 0.00 0.00 43.02 41.67 2cp3 s PHE 59 CO 0.80 -0.02 1.14 -1.14 -1.34 0.00 0.00 175.22 174.66 2cp3 s GLN 60 N -0.22 4.12 -0.00 1.99 2.00 -1.26 -4.59 119.66 121.70 2cp3 s GLN 60 Ca 0.00 1.27 -0.04 0.00 -2.00 0.00 0.00 55.36 54.60 2cp3 s GLN 60 Cb -0.02 -3.74 -0.00 0.00 0.80 0.00 0.00 33.01 30.04 2cp3 s GLN 60 CO -0.00 -0.84 0.07 0.00 -0.50 0.00 0.00 175.29 174.02 2cp3 n PRO 62 N 1.89 -2.04 -2.25 0.00 -0.02 -1.26 -4.78 135.00 126.54 2cp3 n PRO 62 Ca -0.21 -0.58 -0.42 0.00 -2.02 0.00 0.00 63.50 60.28 2cp3 n PRO 62 Cb 0.56 -1.84 -0.03 0.00 -0.02 0.00 0.00 33.50 32.17 2cp3 n PRO 62 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2cp3 s PRO 63 N -3.76 4.33 -1.38 0.52 0.04 -1.26 -2.99 135.00 130.50 2cp3 s PRO 63 Ca 0.60 1.96 -0.05 0.00 0.04 0.00 0.00 61.00 63.55 2cp3 s PRO 63 Cb -0.16 -3.40 0.01 0.00 0.04 0.00 0.00 34.50 30.98 2cp3 s PRO 63 CO 0.65 -0.45 0.62 1.63 0.04 0.00 0.00 177.00 179.49 2cp3 n LYS 64 N 4.53 -4.77 -0.03 4.56 4.76 -1.22 -4.88 118.16 121.10 2cp3 n LYS 64 Ca 0.12 0.81 -0.04 0.00 -2.87 0.00 0.00 58.31 56.33 2cp3 n LYS 64 Cb 0.44 -5.49 -0.04 0.00 -1.84 0.00 0.00 35.03 28.10 2cp3 n LYS 64 CO 0.00 0.00 0.00 1.19 -1.37 0.00 0.00 177.40 177.22 2cp3 n PHE 65 N -4.44 0.00 -3.96 2.13 3.01 -1.16 -1.71 117.46 111.34 2cp3 n PHE 65 Ca -0.09 0.00 -0.36 0.00 1.01 0.00 0.00 57.45 58.01 2cp3 n PHE 65 Cb 0.60 -0.27 -0.07 0.00 -0.01 0.00 0.00 39.48 39.73 2cp3 n PHE 65 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 2cp3 s GLY 66 N -4.13 2.10 -0.04 1.37 0.00 -1.10 -0.04 107.32 105.48 2cp3 s GLY 66 Ca -0.06 -0.67 0.01 0.00 0.00 0.00 0.00 44.72 44.00 2cp3 s GLY 66 CO 0.20 -0.37 -0.05 -2.27 0.00 0.00 0.00 173.10 170.60 2cp3 s LEU 67 N -0.90 1.45 -0.42 0.66 2.96 -0.25 -3.20 118.68 118.97 2cp3 s LEU 67 Ca 0.14 -0.12 -0.21 0.00 -0.22 0.00 0.00 54.13 53.72 2cp3 s LEU 67 Cb -0.12 -0.43 0.02 0.00 0.50 0.00 0.00 46.19 46.17 2cp3 s LEU 67 CO 0.03 -0.03 0.66 -0.36 -1.32 0.00 0.00 176.35 175.33 2cp3 s PHE 68 N 0.72 3.07 0.04 5.38 0.08 -1.26 -1.53 117.98 124.48 2cp3 s PHE 68 Ca -0.10 0.04 0.06 0.00 0.12 0.00 0.00 56.93 57.06 2cp3 s PHE 68 Cb -0.13 -3.34 -0.02 0.00 -0.57 0.00 0.00 43.02 38.96 2cp3 s PHE 68 CO 0.00 -0.84 -0.17 0.00 -0.10 0.00 0.00 175.22 174.11 2cp3 s ALA 69 N 2.85 1.44 0.50 5.36 0.00 -1.12 -4.97 121.76 125.82 2cp3 s ALA 69 Ca 0.24 -0.93 -0.22 0.00 0.00 0.00 0.00 51.96 51.05 2cp3 s ALA 69 Cb -0.14 -0.26 -0.08 0.00 0.00 0.00 0.00 23.12 22.64 2cp3 s ALA 69 CO 0.19 0.30 1.02 -2.30 0.00 0.00 0.00 175.76 174.97 2cp3 n PRO 70 N 1.89 1.24 -0.15 0.00 -0.02 -1.26 -1.35 135.00 135.35 2cp3 n PRO 70 Ca -0.18 0.46 -0.05 0.00 -2.02 0.00 0.00 63.50 61.71 2cp3 n PRO 70 Cb 0.54 -2.14 0.03 0.00 -0.02 0.00 0.00 33.50 31.91 2cp3 n PRO 70 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 2cp3 h ILE 71 N 1.16 0.98 0.00 4.25 2.10 -1.84 -0.71 117.51 123.45 2cp3 h ILE 71 Ca -0.47 -0.16 -0.01 0.00 1.08 0.00 0.00 64.86 65.30 2cp3 h ILE 71 Cb 1.34 0.47 -0.00 0.00 -1.09 0.00 0.00 36.82 37.54 2cp3 h ILE 71 CO 0.55 0.09 -0.04 1.12 -1.08 0.00 0.00 178.15 178.78 2cp3 h HIS 72 N 0.47 0.00 0.00 2.19 2.07 -1.91 -1.05 115.15 116.93 2cp3 h HIS 72 Ca 0.20 0.00 -0.14 0.00 -2.85 0.00 0.00 60.37 57.58 2cp3 h HIS 72 Cb 0.09 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 30.05 2cp3 h HIS 72 CO -0.10 0.04 -0.78 0.87 -3.07 0.00 0.00 177.93 174.89 2cp3 h LYS 73 N 0.00 0.00 -6.73 5.12 1.79 -1.51 -3.45 116.57 111.78 2cp3 h LYS 73 Ca -0.00 0.00 -0.52 0.00 -2.18 0.00 0.00 60.65 57.95 2cp3 h LYS 73 Cb 0.12 0.00 0.04 0.00 -1.58 0.00 0.00 32.23 30.81 2cp3 h LYS 73 CO 0.00 0.52 0.64 0.08 -1.08 0.00 0.00 179.45 179.62 2cp3 s VAL 74 N -2.91 3.10 -0.32 0.50 1.01 -0.40 -4.76 120.40 116.63 2cp3 s VAL 74 Ca 0.02 0.96 0.03 0.00 0.00 0.00 0.00 61.98 62.99 2cp3 s VAL 74 Cb 0.08 -3.61 0.09 0.00 0.00 0.00 0.00 36.38 32.93 2cp3 s VAL 74 CO 0.77 0.17 0.01 -0.63 0.00 0.00 0.00 175.10 175.42 2cp3 s ILE 75 N -0.27 2.34 0.73 2.22 -1.09 -1.14 -4.94 121.20 119.04 2cp3 s ILE 75 Ca 0.54 -2.10 -0.16 0.00 -2.23 0.00 0.00 60.65 56.71 2cp3 s ILE 75 Cb -0.37 -2.61 0.04 0.00 -1.58 0.00 0.00 42.46 37.93 2cp3 s ILE 75 CO 0.42 -0.43 1.25 -1.14 -1.23 0.00 0.00 174.94 173.81 2cp3 n ARG 76 N 4.34 0.66 -1.12 2.79 0.63 -1.26 -0.55 116.66 122.16 2cp3 n ARG 76 Ca -0.02 0.29 0.00 0.00 -0.92 0.00 0.00 57.85 57.21 2cp3 n ARG 76 Cb 0.42 -2.49 0.14 0.00 0.45 0.00 0.00 32.46 30.97 2cp3 n ARG 76 CO 0.00 0.00 0.00 -0.89 -2.51 0.00 0.00 177.63 174.23 2cp3 n ILE 77 N -2.59 1.81 -4.05 5.15 5.41 -1.08 -4.83 119.36 119.18 2cp3 n ILE 77 Ca 0.15 -2.99 -0.19 0.00 1.00 0.00 0.00 62.75 60.72 2cp3 n ILE 77 Cb 0.49 -0.09 -0.02 0.00 -0.71 0.00 0.00 39.64 39.32 2cp3 n ILE 77 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2cp3 n GLY 78 N -0.73 3.21 0.35 7.39 0.00 -1.26 -5.03 105.19 109.12 2cp3 n GLY 78 Ca 0.20 -2.28 -0.01 0.00 0.00 0.00 0.00 46.02 43.93 2cp3 n GLY 78 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2cp3 n SER 79 N -1.62 2.56 0.00 1.61 3.41 -1.26 -5.03 113.62 113.29 2cp3 n SER 79 Ca -0.06 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.55 2cp3 n SER 79 Cb 0.42 -0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.35 2cp3 n SER 79 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2cp3 n GLY 80 N 3.27 -1.80 3.56 5.00 0.00 -1.26 -5.09 105.19 108.87 2cp3 n GLY 80 Ca -0.02 0.79 -0.28 0.00 0.00 0.00 0.00 46.02 46.52 2cp3 n GLY 80 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2cp3 s PRO 81 N 0.00 2.63 0.00 1.61 0.04 -1.26 -4.50 135.00 133.51 2cp3 s PRO 81 Ca 0.00 -0.45 0.00 0.00 0.04 0.00 0.00 61.00 60.59 2cp3 s PRO 81 Cb 0.00 -5.10 0.00 0.00 0.04 0.00 0.00 34.50 29.44 2cp3 s PRO 81 CO 0.00 -3.36 0.00 -1.13 0.04 0.00 0.00 177.00 172.55 2cp3 n SER 82 N 13.65 1.25 0.07 6.66 3.41 -1.26 -4.83 113.62 132.57 2cp3 n SER 82 Ca 0.40 0.00 -0.21 0.00 -0.26 0.00 0.00 58.87 58.80 2cp3 n SER 82 Cb 0.47 0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 64.29 2cp3 n SER 82 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 2cp3 h SER 83 N 0.00 0.74 0.00 4.04 0.87 -2.07 -3.57 113.55 113.56 2cp3 h SER 83 Ca 0.00 -0.84 0.00 0.00 -1.23 0.00 0.00 61.79 59.72 2cp3 h SER 83 Cb 0.81 -0.23 0.00 0.00 -0.44 0.00 0.00 62.40 62.54 2cp3 h SER 83 CO 0.00 1.51 0.00 0.61 -0.53 0.00 0.00 176.83 178.42