#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 4.13 -3.41 1.61 3.41 -1.26 -4.75 113.62 113.35 2cp3 n SER 2 Ca 0.00 -3.65 -0.22 0.00 -0.26 0.00 0.00 58.87 54.74 2cp3 n SER 2 Cb 0.00 -0.84 -0.10 0.00 -0.26 0.00 0.00 64.21 63.02 2cp3 n SER 2 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2cp3 s SER 3 N -1.49 1.98 0.00 4.04 0.01 -1.26 -5.11 113.70 111.86 2cp3 s SER 3 Ca 0.57 -1.63 0.00 0.00 1.31 0.00 0.00 55.95 56.20 2cp3 s SER 3 Cb 0.48 0.19 0.00 0.00 0.21 0.00 0.00 66.02 66.90 2cp3 s SER 3 CO 0.08 -0.31 0.00 0.61 0.41 0.00 0.00 173.24 174.04 2cp3 n GLY 4 N 4.41 -1.15 3.61 3.44 0.00 -1.26 -4.94 105.19 109.30 2cp3 n GLY 4 Ca 0.08 -1.51 -0.02 0.00 0.00 0.00 0.00 46.02 44.57 2cp3 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2cp3 s SER 5 N -4.00 -1.07 -0.43 1.61 0.01 -1.26 -5.10 113.70 103.46 2cp3 s SER 5 Ca 0.00 1.51 0.00 0.00 1.31 0.00 0.00 55.95 58.78 2cp3 s SER 5 Cb 0.00 2.22 0.12 0.00 0.21 0.00 0.00 66.02 68.57 2cp3 s SER 5 CO 0.00 -0.22 0.20 -0.44 0.41 0.00 0.00 173.24 173.18 2cp3 s SER 6 N 2.87 4.97 -0.61 2.44 0.01 -1.26 -5.06 113.70 117.06 2cp3 s SER 6 Ca -0.05 -2.33 -0.20 0.00 1.31 0.00 0.00 55.95 54.68 2cp3 s SER 6 Cb -0.12 -1.74 0.09 0.00 0.21 0.00 0.00 66.02 64.46 2cp3 s SER 6 CO -0.18 -0.42 0.79 -0.83 0.41 0.00 0.00 173.24 173.00 2cp3 s GLY 7 N 1.07 1.64 0.28 3.44 0.00 -1.26 -4.79 107.32 107.70 2cp3 s GLY 7 Ca 0.12 -2.09 0.11 0.00 0.00 0.00 0.00 44.72 42.85 2cp3 s GLY 7 CO -0.05 1.74 -0.12 1.08 0.00 0.00 0.00 173.10 175.75 2cp3 s LEU 8 N 3.15 2.81 0.00 0.66 1.02 -1.26 -5.15 118.68 119.90 2cp3 s LEU 8 Ca 0.15 -0.91 0.00 0.00 0.02 0.00 0.00 54.13 53.40 2cp3 s LEU 8 Cb -0.22 -1.31 -0.00 0.00 0.02 0.00 0.00 46.19 44.68 2cp3 s LEU 8 CO 0.08 0.01 0.02 0.54 0.02 0.00 0.00 176.35 177.01 2cp3 n ARG 9 N -0.73 1.31 -2.73 1.70 1.74 -1.26 -5.11 116.66 111.58 2cp3 n ARG 9 Ca -0.05 -1.22 -0.41 0.00 -0.77 0.00 0.00 57.85 55.39 2cp3 n ARG 9 Cb 0.60 0.44 -0.04 0.00 -1.02 0.00 0.00 32.46 32.44 2cp3 n ARG 9 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2cp3 s LEU 10 N 0.00 4.44 0.00 0.55 1.43 -1.26 -4.13 118.68 119.70 2cp3 s LEU 10 Ca 0.03 1.72 0.00 0.00 -1.03 0.00 0.00 54.13 54.84 2cp3 s LEU 10 Cb 0.00 -3.57 0.00 0.00 0.03 0.00 0.00 46.19 42.65 2cp3 s LEU 10 CO 0.02 -0.16 0.00 0.61 0.23 0.00 0.00 176.35 177.05 2cp3 n GLY 11 N 2.57 0.75 2.76 -3.19 0.00 -0.75 -5.02 105.19 102.31 2cp3 n GLY 11 Ca 0.04 -0.35 -0.19 0.00 0.00 0.00 0.00 46.02 45.52 2cp3 n GLY 11 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2cp3 s ASP 12 N -2.98 0.81 -0.09 1.61 -1.08 -1.26 -4.86 116.67 108.82 2cp3 s ASP 12 Ca 0.00 -0.00 -0.29 0.00 -0.52 0.00 0.00 52.55 51.74 2cp3 s ASP 12 Cb 0.00 -0.22 -0.06 0.00 -1.46 0.00 0.00 42.92 41.17 2cp3 s ASP 12 CO 0.00 -0.16 1.95 -0.13 0.52 0.00 0.00 175.17 177.35 2cp3 s ARG 13 N 1.53 3.80 0.33 4.34 0.52 -1.26 -2.33 118.95 125.87 2cp3 s ARG 13 Ca -0.03 2.24 0.06 0.00 -0.52 0.00 0.00 55.73 57.48 2cp3 s ARG 13 Cb -0.13 -4.19 -0.07 0.00 0.52 0.00 0.00 34.95 31.09 2cp3 s ARG 13 CO -0.03 -1.33 0.00 0.14 0.02 0.00 0.00 175.30 174.10 2cp3 s VAL 14 N 5.65 1.57 -0.26 3.52 -7.23 0.56 -2.90 120.40 121.31 2cp3 s VAL 14 Ca 0.88 -2.05 0.02 0.00 -1.81 0.00 0.00 61.98 59.01 2cp3 s VAL 14 Cb -0.36 -2.71 0.05 0.00 0.56 0.00 0.00 36.38 33.92 2cp3 s VAL 14 CO 0.37 -0.11 -0.10 -0.22 -0.31 0.00 0.00 175.10 174.73 2cp3 s LEU 15 N -3.53 3.42 -0.39 1.32 2.96 -0.15 -0.87 118.68 121.45 2cp3 s LEU 15 Ca 0.34 -1.30 -0.19 0.00 -0.22 0.00 0.00 54.13 52.76 2cp3 s LEU 15 Cb 0.07 -1.58 0.01 0.00 0.50 0.00 0.00 46.19 45.19 2cp3 s LEU 15 CO 0.15 -0.19 0.54 -0.69 -1.32 0.00 0.00 176.35 174.84 2cp3 s VAL 16 N 1.15 4.97 0.00 1.68 1.01 -0.21 -3.05 120.40 125.96 2cp3 s VAL 16 Ca -0.07 0.17 0.00 0.00 0.00 0.00 0.00 61.98 62.08 2cp3 s VAL 16 Cb -0.19 -4.05 0.00 0.00 0.00 0.00 0.00 36.38 32.14 2cp3 s VAL 16 CO -0.05 -0.36 0.00 0.61 0.00 0.00 0.00 175.10 175.30 2cp3 n GLY 17 N 4.91 3.30 0.39 4.51 0.00 -1.26 -3.35 105.19 113.69 2cp3 n GLY 17 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 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 -1.86 1.55 0.91 -0.02 0.00 -1.26 -4.90 105.19 99.60 2cp3 n GLY 18 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.84 2cp3 n GLY 18 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2cp3 n THR 19 N -1.69 0.00 -2.77 2.61 -1.04 -1.26 -5.09 114.28 105.05 2cp3 n THR 19 Ca 0.00 0.00 -0.43 0.00 -2.04 0.00 0.00 64.05 61.58 2cp3 n THR 19 Cb 0.08 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.56 2cp3 n THR 19 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 2cp3 s LYS 20 N -1.48 3.72 -0.06 -2.82 1.02 -1.21 -4.96 119.74 113.95 2cp3 s LYS 20 Ca 0.00 0.45 -0.22 0.00 0.02 0.00 0.00 55.97 56.22 2cp3 s LYS 20 Cb 0.00 -3.86 -0.04 0.00 -0.52 0.00 0.00 37.83 33.41 2cp3 s LYS 20 CO 0.00 -1.11 0.63 0.95 -0.92 0.00 0.00 175.35 174.90 2cp3 s THR 21 N 3.74 5.03 0.01 2.17 -4.23 -1.26 -1.05 115.64 120.06 2cp3 s THR 21 Ca 0.40 1.30 -0.25 0.00 -1.18 0.00 0.00 61.69 61.96 2cp3 s THR 21 Cb -0.11 -3.97 0.06 0.00 1.34 0.00 0.00 72.50 69.82 2cp3 s THR 21 CO 0.23 0.31 0.57 -0.83 -0.54 0.00 0.00 174.62 174.36 2cp3 s GLY 22 N 0.49 -0.48 0.27 3.99 0.00 -0.05 -3.40 107.32 108.15 2cp3 s GLY 22 Ca 0.34 0.83 -0.10 0.00 0.00 0.00 0.00 44.72 45.79 2cp3 s GLY 22 CO 0.16 0.52 0.59 0.14 0.00 0.00 0.00 173.10 174.52 2cp3 s VAL 23 N -1.99 4.90 -0.19 1.40 1.01 -0.36 -0.32 120.40 124.84 2cp3 s VAL 23 Ca -0.08 0.49 -0.29 0.00 0.00 0.00 0.00 61.98 62.10 2cp3 s VAL 23 Cb -0.01 -3.64 -0.01 0.00 0.00 0.00 0.00 36.38 32.72 2cp3 s VAL 23 CO 0.02 -0.16 1.20 -0.69 0.00 0.00 0.00 175.10 175.47 2cp3 s VAL 24 N -1.93 4.39 -0.09 2.92 1.01 -0.98 0.97 120.40 126.68 2cp3 s VAL 24 Ca 0.48 1.67 0.13 0.00 0.00 0.00 0.00 61.98 64.27 2cp3 s VAL 24 Cb -0.11 -4.09 -0.20 0.00 0.00 0.00 0.00 36.38 31.99 2cp3 s VAL 24 CO 0.23 -0.16 0.16 0.54 0.00 0.00 0.00 175.10 175.87 2cp3 n ARG 25 N 6.55 1.23 -4.38 2.72 5.12 0.12 -1.81 116.66 126.22 2cp3 n ARG 25 Ca 0.13 -0.06 -0.20 0.00 -1.93 0.00 0.00 57.85 55.80 2cp3 n ARG 25 Cb 0.45 -1.36 -0.14 0.00 -1.16 0.00 0.00 32.46 30.26 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 -2.61 1.09 -0.10 -1.55 5.04 -1.14 -4.93 117.35 113.15 2cp3 s TYR 26 Ca -0.06 -0.30 -0.04 0.00 -2.44 0.00 0.00 57.07 54.23 2cp3 s TYR 26 Cb 0.06 -0.67 0.05 0.00 0.35 0.00 0.00 41.96 41.75 2cp3 s TYR 26 CO 0.59 0.01 0.20 0.08 -1.34 0.00 0.00 175.55 175.09 2cp3 s VAL 27 N -0.65 -0.21 -5.00 3.14 1.01 -1.26 -1.15 120.40 116.29 2cp3 s VAL 27 Ca 0.02 0.26 0.00 0.00 0.00 0.00 0.00 61.98 62.26 2cp3 s VAL 27 Cb -0.07 -0.34 0.00 0.00 0.00 0.00 0.00 36.38 35.98 2cp3 s VAL 27 CO 0.01 0.11 0.00 0.61 0.00 0.00 0.00 175.10 175.82 2cp3 n GLY 28 N 4.87 0.80 2.15 4.51 0.00 -1.02 -5.05 105.19 111.46 2cp3 n GLY 28 Ca -0.14 -1.75 -0.14 0.00 0.00 0.00 0.00 46.02 43.99 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 -0.04 -2.54 1.61 1.02 -1.26 -1.03 120.64 118.40 2cp3 n GLU 29 Ca 0.00 -1.41 -0.05 0.00 -0.02 0.00 0.00 57.16 55.68 2cp3 n GLU 29 Cb 0.00 -0.48 -0.02 0.00 -0.02 0.00 0.00 31.44 30.93 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 -2.42 0.00 -1.79 2.62 -2.24 -1.26 -4.80 114.28 104.38 2cp3 n THR 30 Ca 0.09 -0.58 0.06 0.00 -2.27 0.00 0.00 64.05 61.35 2cp3 n THR 30 Cb 0.33 0.28 0.15 0.00 -2.10 0.00 0.00 70.33 68.98 2cp3 n THR 30 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2cp3 n ASP 31 N -2.58 1.53 0.00 3.42 2.03 -1.26 -4.77 116.55 114.93 2cp3 n ASP 31 Ca 0.01 -3.30 0.00 0.00 0.52 0.00 0.00 54.79 52.02 2cp3 n ASP 31 Cb 0.14 -0.45 0.00 0.00 -0.72 0.00 0.00 41.12 40.09 2cp3 n ASP 31 CO 0.00 0.00 0.00 2.22 -1.92 0.00 0.00 177.20 177.50 2cp3 n PHE 32 N -0.71 0.00 -4.28 -0.67 1.16 -1.26 -5.12 117.46 106.58 2cp3 n PHE 32 Ca 0.15 0.00 -0.27 0.00 -1.87 0.00 0.00 57.45 55.46 2cp3 n PHE 32 Cb 0.80 0.19 -0.07 0.00 -1.61 0.00 0.00 39.48 38.80 2cp3 n PHE 32 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2cp3 s ALA 33 N -1.58 3.75 0.05 1.98 0.00 -1.26 -5.14 121.76 119.56 2cp3 s ALA 33 Ca 0.00 -1.70 0.01 0.00 0.00 0.00 0.00 51.96 50.27 2cp3 s ALA 33 Cb 0.00 -0.28 -0.04 0.00 0.00 0.00 0.00 23.12 22.80 2cp3 s ALA 33 CO 0.00 -0.18 0.12 0.15 0.00 0.00 0.00 175.76 175.86 2cp3 s LYS 34 N -3.93 3.11 0.00 0.00 1.02 -1.26 -4.60 119.74 114.07 2cp3 s LYS 34 Ca 0.33 -0.56 0.00 0.00 0.02 0.00 0.00 55.97 55.76 2cp3 s LYS 34 Cb 0.03 -2.86 0.00 0.00 -0.52 0.00 0.00 37.83 34.48 2cp3 s LYS 34 CO 0.18 0.60 0.00 0.41 -0.92 0.00 0.00 175.35 175.62 2cp3 n GLY 35 N 0.56 -1.71 3.79 -3.33 0.00 -1.26 -4.97 105.19 98.28 2cp3 n GLY 35 Ca -0.08 -2.04 -0.36 0.00 0.00 0.00 0.00 46.02 43.53 2cp3 n GLY 35 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2cp3 s GLU 36 N 0.00 3.54 0.05 1.61 2.12 -1.26 -4.50 118.70 120.26 2cp3 s GLU 36 Ca 0.00 -0.22 0.05 0.00 0.36 0.00 0.00 54.97 55.15 2cp3 s GLU 36 Cb 0.00 -3.15 -0.03 0.00 0.26 0.00 0.00 34.13 31.21 2cp3 s GLU 36 CO 0.00 0.63 -0.13 -1.58 -0.54 0.00 0.00 175.26 173.63 2cp3 s TRP 37 N -0.61 1.14 -0.08 5.30 0.52 -0.19 -2.75 118.94 122.26 2cp3 s TRP 37 Ca 0.12 -0.42 -0.01 0.00 0.02 0.00 0.00 56.10 55.82 2cp3 s TRP 37 Cb -0.12 -0.66 0.03 0.00 -1.15 0.00 0.00 33.47 31.57 2cp3 s TRP 37 CO 0.02 0.03 -0.03 0.00 0.02 0.00 0.00 176.95 177.00 2cp3 s GLY 39 N 1.71 2.46 -0.06 0.00 0.00 -0.30 -2.80 107.32 108.34 2cp3 s GLY 39 Ca 0.02 0.79 0.02 0.00 0.00 0.00 0.00 44.72 45.55 2cp3 s GLY 39 CO -0.05 2.00 -0.10 0.14 0.00 0.00 0.00 173.10 175.09 2cp3 s VAL 40 N 1.12 3.41 -0.37 1.40 1.01 0.12 0.14 120.40 127.24 2cp3 s VAL 40 Ca 0.58 -0.59 -0.05 0.00 0.00 0.00 0.00 61.98 61.92 2cp3 s VAL 40 Cb -0.28 -2.37 0.08 0.00 0.00 0.00 0.00 36.38 33.81 2cp3 s VAL 40 CO 0.29 0.59 0.15 -0.70 0.00 0.00 0.00 175.10 175.43 2cp3 s GLU 41 N -0.76 2.37 0.82 2.72 -6.30 0.27 -0.59 118.70 117.23 2cp3 s GLU 41 Ca 0.12 -1.49 -0.11 0.00 -2.50 0.00 0.00 54.97 50.99 2cp3 s GLU 41 Cb -0.11 -3.52 0.08 0.00 0.00 0.00 0.00 34.13 30.58 2cp3 s GLU 41 CO 0.01 -0.87 1.10 -0.51 0.02 0.00 0.00 175.26 175.01 2cp3 s LEU 42 N 1.29 2.53 -0.09 2.70 1.43 -1.26 -1.23 118.68 124.04 2cp3 s LEU 42 Ca 0.02 1.33 0.11 0.00 -1.03 0.00 0.00 54.13 54.56 2cp3 s LEU 42 Cb -0.22 -3.90 -0.24 0.00 0.03 0.00 0.00 46.19 41.86 2cp3 s LEU 42 CO -0.01 -2.11 0.48 0.47 0.23 0.00 0.00 176.35 175.42 2cp3 n ASP 43 N -3.52 0.89 -4.60 2.29 9.92 -1.22 -4.92 116.55 115.39 2cp3 n ASP 43 Ca 0.07 0.29 -0.27 0.00 -0.53 0.00 0.00 54.79 54.35 2cp3 n ASP 43 Cb 0.56 0.04 -0.09 0.00 -0.64 0.00 0.00 41.12 40.99 2cp3 n ASP 43 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 2cp3 s GLU 44 N -2.57 2.16 -0.84 -1.24 2.02 -1.26 -5.02 118.70 111.95 2cp3 s GLU 44 Ca -0.09 -1.20 -0.20 0.00 0.02 0.00 0.00 54.97 53.50 2cp3 s GLU 44 Cb 0.07 -2.23 -0.20 0.00 0.10 0.00 0.00 34.13 31.88 2cp3 s GLU 44 CO 0.81 0.45 2.27 -2.30 0.02 0.00 0.00 175.26 176.50 2cp3 n PRO 45 N 0.05 0.34 -1.46 0.39 -0.02 -1.26 -4.51 135.00 128.54 2cp3 n PRO 45 Ca -0.11 -0.66 0.00 0.00 -2.02 0.00 0.00 63.50 60.72 2cp3 n PRO 45 Cb 0.55 -2.87 -0.00 0.00 -0.02 0.00 0.00 33.50 31.15 2cp3 n PRO 45 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2cp3 n LEU 46 N 14.68 0.32 0.00 2.45 4.77 -1.25 -5.11 117.00 132.86 2cp3 n LEU 46 Ca 0.51 -2.10 -0.18 0.00 -0.03 0.00 0.00 56.01 54.21 2cp3 n LEU 46 Cb 0.36 0.03 -0.00 0.00 -2.33 0.00 0.00 43.42 41.47 2cp3 n LEU 46 CO 0.70 0.89 0.03 0.61 -1.33 0.00 0.00 177.39 178.28 2cp3 n GLY 47 N 0.21 2.93 0.04 -0.72 0.00 -1.24 -4.98 105.19 101.43 2cp3 n GLY 47 Ca -0.05 -2.26 -0.05 0.00 0.00 0.00 0.00 46.02 43.66 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 -1.31 1.00 -2.86 1.61 4.76 -1.26 -4.81 118.16 115.30 2cp3 n LYS 48 Ca -0.03 0.03 -0.08 0.00 -2.87 0.00 0.00 58.31 55.37 2cp3 n LYS 48 Cb 0.42 -1.16 -0.03 0.00 -1.84 0.00 0.00 35.03 32.42 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 -2.59 -0.33 -2.31 4.39 3.02 -1.20 -4.77 115.26 111.48 2cp3 n ASN 49 Ca -0.13 -1.88 -0.34 0.00 -0.03 0.00 0.00 54.58 52.21 2cp3 n ASN 49 Cb 0.67 0.74 0.07 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 -2.39 7.29 -0.76 6.41 5.75 -1.26 -2.06 116.55 129.53 2cp3 n ASP 50 Ca 0.03 -3.79 -0.07 0.00 -0.01 0.00 0.00 54.79 50.95 2cp3 n ASP 50 Cb 0.25 -0.89 -0.01 0.00 -1.03 0.00 0.00 41.12 39.44 2cp3 n ASP 50 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2cp3 n GLY 51 N -0.87 0.26 2.92 6.12 0.00 -1.26 -4.20 105.19 108.16 2cp3 n GLY 51 Ca 0.60 -0.61 -0.25 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.34 1.17 -0.13 4.61 0.00 -1.26 -2.43 121.76 121.38 2cp3 s ALA 52 Ca 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 51.96 51.55 2cp3 s ALA 52 Cb 0.00 -0.76 -0.01 0.00 0.00 0.00 0.00 23.12 22.35 2cp3 s ALA 52 CO 0.00 -0.26 -0.14 0.08 0.00 0.00 0.00 175.76 175.44 2cp3 s VAL 53 N 1.42 2.89 -1.27 0.00 1.01 -0.73 -4.65 120.40 119.06 2cp3 s VAL 53 Ca -0.01 -0.71 -0.04 0.00 0.00 0.00 0.00 61.98 61.21 2cp3 s VAL 53 Cb -0.13 -2.21 0.00 0.00 0.00 0.00 0.00 36.38 34.04 2cp3 s VAL 53 CO -0.04 0.52 1.09 0.00 0.00 0.00 0.00 175.10 176.67 2cp3 n ALA 54 N 3.64 -1.70 -2.22 5.51 0.00 -1.26 -1.89 120.51 122.59 2cp3 n ALA 54 Ca -0.18 0.15 -0.19 0.00 0.00 0.00 0.00 53.44 53.22 2cp3 n ALA 54 Cb 0.53 -3.85 -0.02 0.00 0.00 0.00 0.00 19.45 16.11 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 -1.54 -0.02 2.77 0.00 0.00 -1.26 -4.97 105.19 100.18 2cp3 n GLY 55 Ca -0.15 -0.09 -0.30 0.00 0.00 0.00 0.00 46.02 45.48 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 -2.91 1.06 -0.35 2.61 2.01 -0.79 -5.10 115.64 112.17 2cp3 s THR 56 Ca 0.00 -1.52 -0.28 0.00 0.31 0.00 0.00 61.69 60.20 2cp3 s THR 56 Cb 0.00 -1.80 0.02 0.00 0.01 0.00 0.00 72.50 70.73 2cp3 s THR 56 CO 0.00 -0.67 1.03 -0.60 -0.69 0.00 0.00 174.62 173.69 2cp3 s ARG 57 N 1.52 3.96 -0.02 4.92 6.06 -1.26 -1.78 118.95 132.35 2cp3 s ARG 57 Ca 0.10 0.85 -0.16 0.00 -2.50 0.00 0.00 55.73 54.02 2cp3 s ARG 57 Cb -0.17 -3.78 -0.33 0.00 0.06 0.00 0.00 34.95 30.73 2cp3 s ARG 57 CO -0.23 -0.96 0.85 1.88 -2.50 0.00 0.00 175.30 174.34 2cp3 h TYR 58 N 8.34 0.80 -3.81 5.12 -1.99 -1.84 -3.47 116.97 120.12 2cp3 h TYR 58 Ca -0.22 -0.58 -0.35 0.00 2.00 0.00 0.00 58.73 59.58 2cp3 h TYR 58 Cb 1.07 -0.03 -0.30 0.00 2.00 0.00 0.00 36.73 39.47 2cp3 h TYR 58 CO 0.85 1.55 -0.76 -0.59 -0.00 0.00 0.00 178.16 179.21 2cp3 s PHE 59 N -2.55 0.55 0.30 4.88 -0.71 -1.25 -5.09 117.98 114.10 2cp3 s PHE 59 Ca -0.13 -0.11 -0.30 0.00 -1.04 0.00 0.00 56.93 55.36 2cp3 s PHE 59 Cb 0.04 -0.40 -0.11 0.00 -1.21 0.00 0.00 43.02 41.33 2cp3 s PHE 59 CO 0.89 -0.05 1.59 -1.14 -1.34 0.00 0.00 175.22 175.17 2cp3 s GLN 60 N 0.13 4.12 -0.25 1.99 2.00 -1.26 -4.69 119.66 121.70 2cp3 s GLN 60 Ca -0.01 2.58 -0.29 0.00 -2.00 0.00 0.00 55.36 55.64 2cp3 s GLN 60 Cb -0.05 -3.02 0.17 0.00 0.80 0.00 0.00 33.01 30.91 2cp3 s GLN 60 CO -0.00 -0.63 1.24 0.00 -0.50 0.00 0.00 175.29 175.40 2cp3 s PRO 62 N -0.94 1.87 0.48 0.00 0.04 -1.26 -4.78 135.00 130.40 2cp3 s PRO 62 Ca 0.05 0.68 -0.24 0.00 0.04 0.00 0.00 61.00 61.53 2cp3 s PRO 62 Cb -0.01 -1.89 -0.07 0.00 0.04 0.00 0.00 34.50 32.57 2cp3 s PRO 62 CO -0.05 -1.78 1.41 -2.14 0.04 0.00 0.00 177.00 174.47 2cp3 s PRO 63 N -5.10 3.52 -1.64 0.56 0.02 -1.26 -2.57 135.00 128.52 2cp3 s PRO 63 Ca 0.61 2.37 -0.02 0.00 0.02 0.00 0.00 61.00 63.98 2cp3 s PRO 63 Cb -0.15 -2.54 0.00 0.00 0.02 0.00 0.00 34.50 31.83 2cp3 s PRO 63 CO 0.55 -0.93 0.32 1.63 -0.33 0.00 0.00 177.00 178.24 2cp3 n LYS 64 N -0.45 -3.37 -2.55 5.54 4.01 -1.23 -4.88 118.16 115.24 2cp3 n LYS 64 Ca 0.07 0.95 0.01 0.00 -0.51 0.00 0.00 58.31 58.82 2cp3 n LYS 64 Cb 0.43 -5.70 0.05 0.00 -0.51 0.00 0.00 35.03 29.30 2cp3 n LYS 64 CO 0.00 0.00 0.00 1.19 -1.11 0.00 0.00 177.40 177.48 2cp3 n PHE 65 N -4.28 0.91 -3.15 2.13 3.72 -1.06 -3.65 117.46 112.08 2cp3 n PHE 65 Ca -0.17 -1.78 0.04 0.00 -0.05 0.00 0.00 57.45 55.48 2cp3 n PHE 65 Cb 0.65 -0.16 -0.01 0.00 -0.94 0.00 0.00 39.48 39.02 2cp3 n PHE 65 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 2cp3 s GLY 66 N -3.35 -0.85 -0.11 1.37 0.00 -0.88 -4.43 107.32 99.07 2cp3 s GLY 66 Ca 0.28 2.05 0.03 0.00 0.00 0.00 0.00 44.72 47.08 2cp3 s GLY 66 CO -0.07 3.50 -0.22 -2.27 0.00 0.00 0.00 173.10 174.04 2cp3 s LEU 67 N 2.88 2.04 -0.15 0.66 2.96 0.25 -3.26 118.68 124.06 2cp3 s LEU 67 Ca 0.15 -0.55 -0.15 0.00 -0.22 0.00 0.00 54.13 53.37 2cp3 s LEU 67 Cb -0.14 -1.36 -0.04 0.00 0.50 0.00 0.00 46.19 45.15 2cp3 s LEU 67 CO -0.19 0.12 0.34 -0.36 -1.32 0.00 0.00 176.35 174.95 2cp3 s PHE 68 N 0.51 3.47 -0.04 5.38 0.08 -1.26 0.15 117.98 126.27 2cp3 s PHE 68 Ca -0.15 0.67 -0.11 0.00 0.12 0.00 0.00 56.93 57.46 2cp3 s PHE 68 Cb -0.17 -2.40 0.02 0.00 -0.57 0.00 0.00 43.02 39.90 2cp3 s PHE 68 CO 0.05 0.21 0.25 0.00 -0.10 0.00 0.00 175.22 175.63 2cp3 s ALA 69 N 0.53 -0.61 0.47 5.36 0.00 -1.12 -4.99 121.76 121.41 2cp3 s ALA 69 Ca 0.19 0.34 -0.23 0.00 0.00 0.00 0.00 51.96 52.26 2cp3 s ALA 69 Cb -0.13 -0.09 -0.09 0.00 0.00 0.00 0.00 23.12 22.81 2cp3 s ALA 69 CO 0.05 -0.20 1.04 -2.30 0.00 0.00 0.00 175.76 174.35 2cp3 n PRO 70 N 1.88 1.32 -0.12 0.00 -0.02 -1.26 -1.39 135.00 135.41 2cp3 n PRO 70 Ca -0.19 0.48 -0.08 0.00 -2.02 0.00 0.00 63.50 61.70 2cp3 n PRO 70 Cb 0.57 -2.14 0.00 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 1.34 1.07 0.00 4.25 2.10 -1.84 -1.24 117.51 123.19 2cp3 h ILE 71 Ca -0.46 -0.17 0.00 0.00 1.08 0.00 0.00 64.86 65.30 2cp3 h ILE 71 Cb 1.34 0.53 0.00 0.00 -1.09 0.00 0.00 36.82 37.59 2cp3 h ILE 71 CO 0.56 0.09 0.00 1.12 -1.08 0.00 0.00 178.15 178.84 2cp3 h HIS 72 N 0.51 0.00 -0.64 2.19 2.07 -1.86 -1.39 115.15 116.02 2cp3 h HIS 72 Ca 0.15 0.00 -0.18 0.00 -2.85 0.00 0.00 60.37 57.49 2cp3 h HIS 72 Cb -0.03 0.00 -0.11 0.00 2.57 0.00 0.00 27.41 29.84 2cp3 h HIS 72 CO -0.06 0.00 0.23 1.63 -3.07 0.00 0.00 177.93 176.66 2cp3 n LYS 73 N -2.94 3.38 -4.68 5.12 4.76 -0.47 -4.90 118.16 118.43 2cp3 n LYS 73 Ca -0.01 -2.62 -0.33 0.00 -2.87 0.00 0.00 58.31 52.47 2cp3 n LYS 73 Cb 0.15 -2.09 -0.13 0.00 -1.84 0.00 0.00 35.03 31.12 2cp3 n LYS 73 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2cp3 s VAL 74 N -2.62 3.40 -0.30 -0.18 1.01 -0.53 -4.61 120.40 116.57 2cp3 s VAL 74 Ca 0.47 -0.56 -0.07 0.00 0.00 0.00 0.00 61.98 61.82 2cp3 s VAL 74 Cb 0.38 -2.42 0.01 0.00 0.00 0.00 0.00 36.38 34.35 2cp3 s VAL 74 CO 0.12 0.55 0.09 -0.63 0.00 0.00 0.00 175.10 175.23 2cp3 s ILE 75 N -0.13 4.02 0.40 2.22 -1.09 -1.17 -4.97 121.20 120.47 2cp3 s ILE 75 Ca 0.00 -0.72 -0.26 0.00 -2.23 0.00 0.00 60.65 57.44 2cp3 s ILE 75 Cb -0.13 -3.09 -0.09 0.00 -1.58 0.00 0.00 42.46 37.56 2cp3 s ILE 75 CO 0.03 0.05 1.32 -0.13 -1.23 0.00 0.00 174.94 174.98 2cp3 s ARG 76 N 1.50 4.00 -0.04 2.79 0.52 -1.26 -0.98 118.95 125.48 2cp3 s ARG 76 Ca 0.02 2.21 0.14 0.00 -0.52 0.00 0.00 55.73 57.58 2cp3 s ARG 76 Cb -0.17 -2.80 0.25 0.00 0.52 0.00 0.00 34.95 32.75 2cp3 s ARG 76 CO 0.03 -0.49 1.12 0.44 0.02 0.00 0.00 175.30 176.42 2cp3 n ILE 77 N 0.20 0.09 0.00 1.52 -5.35 -1.14 -4.87 119.36 109.80 2cp3 n ILE 77 Ca 0.03 -0.71 0.00 0.00 -0.27 0.00 0.00 62.75 61.80 2cp3 n ILE 77 Cb 0.43 0.81 0.00 0.00 -1.74 0.00 0.00 39.64 39.14 2cp3 n ILE 77 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2cp3 n GLY 78 N 0.06 0.01 3.01 3.28 0.00 -1.24 -4.91 105.19 105.40 2cp3 n GLY 78 Ca -0.10 -0.06 -0.17 0.00 0.00 0.00 0.00 46.02 45.68 2cp3 n GLY 78 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2cp3 n SER 79 N -1.79 -4.83 -2.45 1.61 7.64 -1.26 -4.19 113.62 108.33 2cp3 n SER 79 Ca 0.00 -0.41 -0.04 0.00 1.01 0.00 0.00 58.87 59.44 2cp3 n SER 79 Cb 0.00 -3.85 0.00 0.00 -1.01 0.00 0.00 64.21 59.35 2cp3 n SER 79 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2cp3 n GLY 80 N -1.55 -2.19 3.53 0.23 0.00 -1.26 -4.73 105.19 99.22 2cp3 n GLY 80 Ca -0.02 0.67 -0.16 0.00 0.00 0.00 0.00 46.02 46.51 2cp3 n GLY 80 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2cp3 n PRO 81 N -0.03 0.34 0.00 1.61 -0.02 -1.26 -4.47 135.00 131.17 2cp3 n PRO 81 Ca 0.06 -0.60 0.00 0.00 -2.02 0.00 0.00 63.50 60.93 2cp3 n PRO 81 Cb 0.21 -2.79 0.00 0.00 -0.02 0.00 0.00 33.50 30.90 2cp3 n PRO 81 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 2cp3 n SER 82 N 14.27 2.58 -2.55 2.55 7.64 -1.26 -5.12 113.62 131.72 2cp3 n SER 82 Ca 0.52 0.00 -0.05 0.00 1.01 0.00 0.00 58.87 60.35 2cp3 n SER 82 Cb 0.34 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.50 2cp3 n SER 82 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2cp3 n SER 83 N -2.55 -0.75 0.00 6.43 7.64 -1.26 -5.30 113.62 117.83 2cp3 n SER 83 Ca 0.00 1.30 0.00 0.00 1.01 0.00 0.00 58.87 61.18 2cp3 n SER 83 Cb 0.45 -5.11 0.00 0.00 -1.01 0.00 0.00 64.21 58.54 2cp3 n SER 83 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64