#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cp3 s SER 2 N 0.00 6.46 -0.13 1.61 1.04 -1.26 -4.97 113.70 116.45 2cp3 s SER 2 Ca 0.00 2.68 -0.10 0.00 0.48 0.00 0.00 55.95 59.01 2cp3 s SER 2 Cb 0.00 -2.55 -0.05 0.00 0.10 0.00 0.00 66.02 63.52 2cp3 s SER 2 CO 0.00 -1.01 0.20 -0.55 0.98 0.00 0.00 173.24 172.86 2cp3 s SER 3 N 3.40 6.41 0.08 7.02 0.15 -1.26 -5.09 113.70 124.42 2cp3 s SER 3 Ca 0.83 0.49 -0.03 0.00 0.70 0.00 0.00 55.95 57.93 2cp3 s SER 3 Cb -0.44 -2.12 -0.03 0.00 -1.71 0.00 0.00 66.02 61.73 2cp3 s SER 3 CO 0.38 0.29 0.06 -0.83 1.20 0.00 0.00 173.24 174.33 2cp3 s GLY 4 N -0.44 0.47 0.37 9.45 0.00 -1.26 -5.18 107.32 110.73 2cp3 s GLY 4 Ca 0.15 -1.10 0.03 0.00 0.00 0.00 0.00 44.72 43.80 2cp3 s GLY 4 CO 0.04 -1.18 0.24 1.44 0.00 0.00 0.00 173.10 173.64 2cp3 n SER 5 N 0.01 2.29 -4.64 1.64 7.64 -1.26 -5.12 113.62 114.19 2cp3 n SER 5 Ca -0.12 -2.31 -0.35 0.00 1.01 0.00 0.00 58.87 57.10 2cp3 n SER 5 Cb 0.62 0.01 -0.10 0.00 -1.01 0.00 0.00 64.21 63.74 2cp3 n SER 5 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2cp3 s SER 6 N -3.13 5.72 -0.12 6.43 1.04 -1.26 -4.99 113.70 117.39 2cp3 s SER 6 Ca 0.18 0.09 0.02 0.00 0.48 0.00 0.00 55.95 56.72 2cp3 s SER 6 Cb -0.01 -1.99 -0.24 0.00 0.10 0.00 0.00 66.02 63.88 2cp3 s SER 6 CO 0.11 0.16 0.34 0.61 0.98 0.00 0.00 173.24 175.44 2cp3 n GLY 7 N 3.66 -0.69 3.64 7.32 0.00 -1.26 -4.87 105.19 112.98 2cp3 n GLY 7 Ca -0.16 -0.20 -0.42 0.00 0.00 0.00 0.00 46.02 45.23 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 -6.56 4.02 0.47 0.99 1.43 -1.26 -4.97 118.68 112.79 2cp3 s LEU 8 Ca -0.18 2.33 0.08 0.00 -1.03 0.00 0.00 54.13 55.34 2cp3 s LEU 8 Cb 0.07 -3.52 0.03 0.00 0.03 0.00 0.00 46.19 42.80 2cp3 s LEU 8 CO 0.77 -1.42 0.61 0.00 0.23 0.00 0.00 176.35 176.53 2cp3 s ARG 9 N 5.23 2.65 0.38 1.70 1.70 -1.26 -4.88 118.95 124.48 2cp3 s ARG 9 Ca 0.93 -1.39 -0.26 0.00 -0.47 0.00 0.00 55.73 54.54 2cp3 s ARG 9 Cb -0.38 -2.68 -0.09 0.00 -0.57 0.00 0.00 34.95 31.22 2cp3 s ARG 9 CO 0.39 -0.44 1.22 -0.51 -1.08 0.00 0.00 175.30 174.88 2cp3 s LEU 10 N -4.42 4.25 -0.04 -1.89 1.43 -1.26 -3.50 118.68 113.25 2cp3 s LEU 10 Ca 0.56 2.47 -0.00 0.00 -1.03 0.00 0.00 54.13 56.13 2cp3 s LEU 10 Cb -0.08 -3.91 0.00 0.00 0.03 0.00 0.00 46.19 42.23 2cp3 s LEU 10 CO 0.34 -0.67 0.01 0.61 0.23 0.00 0.00 176.35 176.87 2cp3 n GLY 11 N 0.71 0.57 3.33 -3.19 0.00 -0.96 -5.00 105.19 100.65 2cp3 n GLY 11 Ca 0.03 -0.79 -0.35 0.00 0.00 0.00 0.00 46.02 44.92 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 -2.99 4.30 -0.39 1.61 1.11 -1.23 -4.87 116.67 114.21 2cp3 s ASP 12 Ca 0.01 -0.36 -0.28 0.00 0.18 0.00 0.00 52.55 52.09 2cp3 s ASP 12 Cb -0.00 -1.73 -0.00 0.00 1.07 0.00 0.00 42.92 42.26 2cp3 s ASP 12 CO 0.01 0.02 1.61 -0.13 1.18 0.00 0.00 175.17 177.85 2cp3 s ARG 13 N 1.25 3.41 0.43 8.23 3.00 -1.26 -0.00 118.95 134.00 2cp3 s ARG 13 Ca 0.03 1.12 0.06 0.00 0.00 0.00 0.00 55.73 56.94 2cp3 s ARG 13 Cb -0.14 -4.13 -0.07 0.00 0.00 0.00 0.00 34.95 30.61 2cp3 s ARG 13 CO -0.02 -1.77 0.02 0.14 0.00 0.00 0.00 175.30 173.67 2cp3 s VAL 14 N 6.29 1.88 -0.20 3.52 -7.23 0.47 0.45 120.40 125.57 2cp3 s VAL 14 Ca 0.70 -1.98 -0.03 0.00 -1.81 0.00 0.00 61.98 58.85 2cp3 s VAL 14 Cb -0.17 -2.86 -0.01 0.00 0.56 0.00 0.00 36.38 33.89 2cp3 s VAL 14 CO 0.32 0.00 -0.05 -0.22 -0.31 0.00 0.00 175.10 174.84 2cp3 s LEU 15 N -3.75 2.89 -0.24 1.32 2.96 0.28 -1.32 118.68 120.83 2cp3 s LEU 15 Ca 0.31 -0.37 -0.17 0.00 -0.22 0.00 0.00 54.13 53.69 2cp3 s LEU 15 Cb 0.08 -1.72 -0.03 0.00 0.50 0.00 0.00 46.19 45.01 2cp3 s LEU 15 CO 0.16 0.02 0.44 -0.69 -1.32 0.00 0.00 176.35 174.96 2cp3 s VAL 16 N 1.26 5.14 -1.84 1.68 1.01 0.20 -3.40 120.40 124.46 2cp3 s VAL 16 Ca 0.03 0.76 0.00 0.00 0.00 0.00 0.00 61.98 62.77 2cp3 s VAL 16 Cb -0.14 -3.76 0.00 0.00 0.00 0.00 0.00 36.38 32.47 2cp3 s VAL 16 CO -0.02 0.17 0.00 0.61 0.00 0.00 0.00 175.10 175.86 2cp3 n GLY 17 N 4.24 0.78 3.57 4.51 0.00 -1.26 -1.71 105.19 115.33 2cp3 n GLY 17 Ca -0.07 -0.09 -0.25 0.00 0.00 0.00 0.00 46.02 45.61 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 -0.81 -0.53 1.40 -0.02 0.00 -1.26 -4.71 105.19 99.25 2cp3 n GLY 18 Ca -0.21 0.22 0.00 0.00 0.00 0.00 0.00 46.02 46.03 2cp3 n GLY 18 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2cp3 n THR 19 N -4.82 0.00 -1.71 2.61 -2.24 -0.96 -5.09 114.28 102.08 2cp3 n THR 19 Ca -0.00 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.35 2cp3 n THR 19 Cb 0.56 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.76 2cp3 n THR 19 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2cp3 s LYS 20 N -0.79 3.44 -0.12 -0.78 1.02 -0.69 -4.76 119.74 117.06 2cp3 s LYS 20 Ca 0.00 2.07 -0.24 0.00 0.02 0.00 0.00 55.97 57.82 2cp3 s LYS 20 Cb 0.00 -4.28 -0.03 0.00 -0.52 0.00 0.00 37.83 33.01 2cp3 s LYS 20 CO 0.00 -1.75 0.75 0.95 -0.92 0.00 0.00 175.35 174.38 2cp3 s THR 21 N 7.01 4.97 0.03 2.17 -4.23 -1.26 0.62 115.64 124.96 2cp3 s THR 21 Ca 0.93 1.51 -0.21 0.00 -1.18 0.00 0.00 61.69 62.74 2cp3 s THR 21 Cb -0.33 -4.08 0.04 0.00 1.34 0.00 0.00 72.50 69.47 2cp3 s THR 21 CO 0.36 0.15 0.47 -0.83 -0.54 0.00 0.00 174.62 174.23 2cp3 s GLY 22 N 1.00 -0.36 0.22 3.99 0.00 -0.44 -4.45 107.32 107.29 2cp3 s GLY 22 Ca 0.37 0.51 -0.12 0.00 0.00 0.00 0.00 44.72 45.49 2cp3 s GLY 22 CO 0.15 0.23 0.58 0.14 0.00 0.00 0.00 173.10 174.20 2cp3 s VAL 23 N -2.28 4.87 0.14 1.40 1.01 -1.02 -0.40 120.40 124.13 2cp3 s VAL 23 Ca -0.06 0.63 -0.31 0.00 0.00 0.00 0.00 61.98 62.24 2cp3 s VAL 23 Cb -0.01 -3.65 -0.09 0.00 0.00 0.00 0.00 36.38 32.63 2cp3 s VAL 23 CO -0.01 -0.00 1.50 -0.69 0.00 0.00 0.00 175.10 175.90 2cp3 s VAL 24 N -1.75 2.93 -0.09 2.92 1.01 0.99 -0.81 120.40 125.61 2cp3 s VAL 24 Ca 0.46 0.66 0.07 0.00 0.00 0.00 0.00 61.98 63.17 2cp3 s VAL 24 Cb -0.12 -3.42 -0.11 0.00 0.00 0.00 0.00 36.38 32.73 2cp3 s VAL 24 CO 0.20 0.05 0.02 0.54 0.00 0.00 0.00 175.10 175.91 2cp3 n ARG 25 N 4.04 2.31 -4.02 2.72 5.12 0.14 -2.27 116.66 124.70 2cp3 n ARG 25 Ca 0.13 0.00 -0.11 0.00 -1.93 0.00 0.00 57.85 55.94 2cp3 n ARG 25 Cb 0.40 -1.23 -0.11 0.00 -1.16 0.00 0.00 32.46 30.36 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 -2.22 0.45 -0.13 -1.55 5.04 -1.09 -4.88 117.35 112.98 2cp3 s TYR 26 Ca -0.06 -0.52 -0.09 0.00 -2.44 0.00 0.00 57.07 53.97 2cp3 s TYR 26 Cb 0.03 -0.29 0.05 0.00 0.35 0.00 0.00 41.96 42.09 2cp3 s TYR 26 CO 0.36 -0.14 0.32 0.08 -1.34 0.00 0.00 175.55 174.83 2cp3 s VAL 27 N -1.44 -0.02 -5.00 3.14 1.01 -1.26 -2.01 120.40 114.82 2cp3 s VAL 27 Ca -0.13 0.08 0.00 0.00 0.00 0.00 0.00 61.98 61.93 2cp3 s VAL 27 Cb -0.10 -0.48 0.00 0.00 0.00 0.00 0.00 36.38 35.80 2cp3 s VAL 27 CO -0.00 0.03 0.00 0.61 0.00 0.00 0.00 175.10 175.74 2cp3 n GLY 28 N 3.79 -0.16 3.57 4.51 0.00 -1.19 -5.08 105.19 110.63 2cp3 n GLY 28 Ca -0.20 -1.74 -0.30 0.00 0.00 0.00 0.00 46.02 43.77 2cp3 n GLY 28 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2cp3 s GLU 29 N -1.42 -1.62 0.29 1.61 2.12 -1.26 -2.30 118.70 116.12 2cp3 s GLU 29 Ca 0.00 -0.20 0.06 0.00 0.36 0.00 0.00 54.97 55.19 2cp3 s GLU 29 Cb 0.00 -1.56 -0.02 0.00 0.26 0.00 0.00 34.13 32.80 2cp3 s GLU 29 CO 0.00 -3.95 0.23 0.25 -0.54 0.00 0.00 175.26 171.25 2cp3 n THR 30 N -4.90 0.00 -0.01 -1.70 -2.24 -1.25 -4.71 114.28 99.46 2cp3 n THR 30 Ca 0.15 -2.10 -0.02 0.00 -2.27 0.00 0.00 64.05 59.82 2cp3 n THR 30 Cb 0.60 1.02 -0.01 0.00 -2.10 0.00 0.00 70.33 69.84 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 -1.84 3.48 0.17 3.42 2.03 -1.26 -4.68 116.55 117.88 2cp3 n ASP 31 Ca 0.05 -0.01 0.06 0.00 0.52 0.00 0.00 54.79 55.42 2cp3 n ASP 31 Cb 0.52 -0.04 0.54 0.00 -0.72 0.00 0.00 41.12 41.42 2cp3 n ASP 31 CO 0.00 0.00 0.00 2.19 -1.92 0.00 0.00 177.20 177.47 2cp3 h PHE 32 N -0.01 0.18 -4.62 -0.67 -5.15 -2.00 -3.44 116.94 101.22 2cp3 h PHE 32 Ca -0.05 0.00 -0.32 0.00 -0.20 0.00 0.00 57.97 57.40 2cp3 h PHE 32 Cb 1.08 -0.06 -0.13 0.00 0.22 0.00 0.00 35.95 37.06 2cp3 h PHE 32 CO 0.00 0.15 -0.51 0.00 -2.00 0.00 0.00 178.31 175.95 2cp3 s ALA 33 N -5.12 1.32 0.75 12.09 0.00 -1.26 -5.18 121.76 124.37 2cp3 s ALA 33 Ca -0.06 -1.78 -0.03 0.00 0.00 0.00 0.00 51.96 50.09 2cp3 s ALA 33 Cb 0.17 1.39 0.14 0.00 0.00 0.00 0.00 23.12 24.82 2cp3 s ALA 33 CO 0.70 -0.65 0.95 1.63 0.00 0.00 0.00 175.76 178.39 2cp3 n LYS 34 N -0.43 -0.22 -0.10 0.00 5.02 -1.26 -4.41 118.16 116.75 2cp3 n LYS 34 Ca 0.04 -2.37 0.01 0.00 -2.02 0.00 0.00 58.31 53.97 2cp3 n LYS 34 Cb 0.64 -0.70 -0.00 0.00 -0.02 0.00 0.00 35.03 34.94 2cp3 n LYS 34 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2cp3 n GLY 35 N -2.10 -1.56 3.33 0.72 0.00 -1.26 -4.79 105.19 99.54 2cp3 n GLY 35 Ca 0.15 -1.22 -0.34 0.00 0.00 0.00 0.00 46.02 44.61 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 -0.21 3.39 0.41 1.61 8.01 -1.26 -3.85 118.70 126.81 2cp3 s GLU 36 Ca 0.00 -0.63 0.08 0.00 0.01 0.00 0.00 54.97 54.42 2cp3 s GLU 36 Cb 0.00 -2.90 -0.01 0.00 -4.31 0.00 0.00 34.13 26.91 2cp3 s GLU 36 CO 0.00 -0.07 0.47 -1.58 0.01 0.00 0.00 175.26 174.09 2cp3 s TRP 37 N 1.13 2.78 -0.05 1.61 0.52 -0.97 -1.86 118.94 122.09 2cp3 s TRP 37 Ca 0.01 -0.43 -0.02 0.00 0.02 0.00 0.00 56.10 55.68 2cp3 s TRP 37 Cb -0.15 -2.25 0.04 0.00 -1.15 0.00 0.00 33.47 29.96 2cp3 s TRP 37 CO -0.01 -0.25 0.10 0.00 0.02 0.00 0.00 176.95 176.81 2cp3 s GLY 39 N 1.36 1.91 -0.06 0.00 0.00 -0.85 -2.19 107.32 107.50 2cp3 s GLY 39 Ca -0.06 -0.39 -0.03 0.00 0.00 0.00 0.00 44.72 44.24 2cp3 s GLY 39 CO -0.05 1.36 0.08 0.14 0.00 0.00 0.00 173.10 174.64 2cp3 s VAL 40 N 2.23 4.88 -0.23 1.40 1.01 -0.17 0.28 120.40 129.81 2cp3 s VAL 40 Ca 0.27 -0.16 -0.05 0.00 0.00 0.00 0.00 61.98 62.04 2cp3 s VAL 40 Cb -0.16 -3.15 -0.02 0.00 0.00 0.00 0.00 36.38 33.05 2cp3 s VAL 40 CO 0.09 0.51 0.00 -0.70 0.00 0.00 0.00 175.10 175.00 2cp3 s GLU 41 N -1.28 3.51 -0.06 2.72 -6.30 0.01 0.05 118.70 117.35 2cp3 s GLU 41 Ca 0.18 -0.56 -0.13 0.00 -2.50 0.00 0.00 54.97 51.96 2cp3 s GLU 41 Cb -0.12 -3.13 -0.05 0.00 0.00 0.00 0.00 34.13 30.83 2cp3 s GLU 41 CO 0.08 -0.16 0.34 -0.51 0.02 0.00 0.00 175.26 175.02 2cp3 s LEU 42 N 1.44 4.41 0.43 2.70 1.43 -1.26 -2.43 118.68 125.40 2cp3 s LEU 42 Ca 0.05 0.78 0.16 0.00 -1.03 0.00 0.00 54.13 54.09 2cp3 s LEU 42 Cb -0.15 -2.45 0.96 0.00 0.03 0.00 0.00 46.19 44.58 2cp3 s LEU 42 CO -0.00 0.29 1.93 0.44 0.23 0.00 0.00 176.35 179.24 2cp3 h ASP 43 N 5.20 0.00 -2.71 2.29 3.32 -1.95 -3.44 116.42 119.13 2cp3 h ASP 43 Ca -0.50 0.00 -0.57 0.00 0.02 0.00 0.00 57.03 55.98 2cp3 h ASP 43 Cb 1.21 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.71 2cp3 h ASP 43 CO 0.64 0.25 -0.53 -1.61 -1.72 0.00 0.00 179.24 176.27 2cp3 s GLU 44 N -4.37 3.14 -0.98 3.56 2.02 -1.26 -5.01 118.70 115.80 2cp3 s GLU 44 Ca -0.03 -0.72 -0.23 0.00 0.02 0.00 0.00 54.97 54.01 2cp3 s GLU 44 Cb 0.15 -2.80 -0.14 0.00 0.10 0.00 0.00 34.13 31.43 2cp3 s GLU 44 CO 0.69 0.52 1.92 -0.35 0.02 0.00 0.00 175.26 178.06 2cp3 n PRO 45 N -0.29 1.39 -1.45 0.39 -0.04 -1.26 -4.44 135.00 129.31 2cp3 n PRO 45 Ca -0.08 -2.14 0.03 0.00 -0.04 0.00 0.00 63.50 61.28 2cp3 n PRO 45 Cb 0.54 -3.41 0.06 0.00 -0.04 0.00 0.00 33.50 30.64 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 12.22 1.48 0.00 1.53 4.77 -1.21 -5.02 117.00 130.77 2cp3 n LEU 46 Ca 0.46 -2.53 -0.13 0.00 -0.03 0.00 0.00 56.01 53.78 2cp3 n LEU 46 Cb 0.44 -0.07 0.05 0.00 -2.33 0.00 0.00 43.42 41.51 2cp3 n LEU 46 CO 0.82 0.76 0.27 0.61 -1.33 0.00 0.00 177.39 178.52 2cp3 n GLY 47 N 0.06 1.68 0.14 -0.72 0.00 -1.23 -4.97 105.19 100.15 2cp3 n GLY 47 Ca 0.10 -2.15 -0.14 0.00 0.00 0.00 0.00 46.02 43.83 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 -1.91 0.44 -3.39 1.61 5.02 -1.25 -4.74 118.16 113.94 2cp3 n LYS 48 Ca 0.11 0.11 -0.12 0.00 -2.02 0.00 0.00 58.31 56.39 2cp3 n LYS 48 Cb 0.39 -1.33 -0.04 0.00 -0.02 0.00 0.00 35.03 34.03 2cp3 n LYS 48 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 2cp3 n ASN 49 N -3.16 -0.56 -2.31 4.39 0.23 -1.22 -4.82 115.26 107.82 2cp3 n ASN 49 Ca -0.32 -2.39 -0.30 0.00 -0.53 0.00 0.00 54.58 51.04 2cp3 n ASN 49 Cb 0.82 1.23 0.05 0.00 -2.08 0.00 0.00 39.78 39.80 2cp3 n ASN 49 CO 0.00 0.00 0.00 -0.90 -0.93 0.00 0.00 177.26 175.43 2cp3 n ASP 50 N -2.06 7.22 -1.66 0.53 5.75 -1.26 -3.25 116.55 121.81 2cp3 n ASP 50 Ca 0.04 -3.54 -0.17 0.00 -0.01 0.00 0.00 54.79 51.12 2cp3 n ASP 50 Cb 0.39 -1.04 -0.03 0.00 -1.03 0.00 0.00 41.12 39.41 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 -0.33 0.43 3.13 6.12 0.00 -1.26 -4.23 105.19 109.05 2cp3 n GLY 51 Ca 0.51 -0.20 -0.25 0.00 0.00 0.00 0.00 46.02 46.08 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 -2.75 1.39 -0.09 4.61 0.00 -1.26 -2.59 121.76 121.07 2cp3 s ALA 52 Ca 0.00 -0.67 0.01 0.00 0.00 0.00 0.00 51.96 51.30 2cp3 s ALA 52 Cb 0.00 -0.41 0.02 0.00 0.00 0.00 0.00 23.12 22.73 2cp3 s ALA 52 CO 0.00 0.30 -0.11 0.08 0.00 0.00 0.00 175.76 176.03 2cp3 s VAL 53 N -0.17 1.15 -1.76 0.00 1.01 0.88 -4.74 120.40 116.76 2cp3 s VAL 53 Ca 0.02 -0.42 0.00 0.00 0.00 0.00 0.00 61.98 61.58 2cp3 s VAL 53 Cb -0.09 -1.10 0.00 0.00 0.00 0.00 0.00 36.38 35.20 2cp3 s VAL 53 CO 0.01 0.37 0.00 0.00 0.00 0.00 0.00 175.10 175.48 2cp3 n ALA 54 N 4.39 -0.56 0.00 5.51 0.00 -1.26 -1.64 120.51 126.96 2cp3 n ALA 54 Ca -0.18 0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2cp3 n ALA 54 Cb 0.51 -2.11 0.00 0.00 0.00 0.00 0.00 19.45 17.85 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 -0.96 2.90 3.66 0.00 0.00 -1.26 -5.02 105.19 104.51 2cp3 n GLY 55 Ca -0.23 -0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.36 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 -2.37 4.44 -0.28 2.61 2.01 -0.65 -5.01 115.64 116.39 2cp3 s THR 56 Ca 0.00 1.74 -0.07 0.00 0.31 0.00 0.00 61.69 63.67 2cp3 s THR 56 Cb 0.00 -4.14 -0.01 0.00 0.01 0.00 0.00 72.50 68.37 2cp3 s THR 56 CO 0.00 -0.17 0.07 -0.60 -0.69 0.00 0.00 174.62 173.23 2cp3 s ARG 57 N 3.40 3.31 -0.08 4.92 3.52 -1.26 -0.08 118.95 132.68 2cp3 s ARG 57 Ca 0.50 -0.71 -0.07 0.00 -0.13 0.00 0.00 55.73 55.33 2cp3 s ARG 57 Cb -0.19 -3.34 -0.04 0.00 -1.56 0.00 0.00 34.95 29.82 2cp3 s ARG 57 CO 0.11 -0.34 0.26 1.88 -0.81 0.00 0.00 175.30 176.40 2cp3 h TYR 58 N 8.24 -0.17 -3.27 5.12 -1.99 -1.85 -3.45 116.97 119.60 2cp3 h TYR 58 Ca -0.35 -0.00 -0.66 0.00 2.00 0.00 0.00 58.73 59.72 2cp3 h TYR 58 Cb 1.15 0.06 -0.30 0.00 2.00 0.00 0.00 36.73 39.63 2cp3 h TYR 58 CO 0.63 -0.06 -0.80 -0.59 -0.00 0.00 0.00 178.16 177.34 2cp3 s PHE 59 N -2.21 2.80 0.19 4.88 -0.71 -1.25 -5.09 117.98 116.59 2cp3 s PHE 59 Ca -0.04 -1.08 -0.31 0.00 -1.04 0.00 0.00 56.93 54.46 2cp3 s PHE 59 Cb 0.00 -1.92 -0.10 0.00 -1.21 0.00 0.00 43.02 39.79 2cp3 s PHE 59 CO 0.12 -0.51 1.59 -1.14 -1.34 0.00 0.00 175.22 173.93 2cp3 s GLN 60 N 0.93 4.20 -0.29 1.99 2.00 -1.26 -4.59 119.66 122.64 2cp3 s GLN 60 Ca -0.03 2.42 -0.22 0.00 -2.00 0.00 0.00 55.36 55.53 2cp3 s GLN 60 Cb -0.15 -3.13 0.13 0.00 0.80 0.00 0.00 33.01 30.67 2cp3 s GLN 60 CO -0.02 -0.62 1.03 0.00 -0.50 0.00 0.00 175.29 175.19 2cp3 n PRO 62 N 2.70 -1.95 -1.90 0.00 -0.02 -1.26 -4.65 135.00 127.92 2cp3 n PRO 62 Ca -0.14 -0.55 -0.41 0.00 -2.02 0.00 0.00 63.50 60.37 2cp3 n PRO 62 Cb 0.57 -1.80 -0.01 0.00 -0.02 0.00 0.00 33.50 32.23 2cp3 n PRO 62 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 2cp3 s PRO 63 N -3.68 4.19 -1.08 0.52 0.02 -1.26 -2.86 135.00 130.85 2cp3 s PRO 63 Ca 0.59 2.46 -0.07 0.00 0.02 0.00 0.00 61.00 64.00 2cp3 s PRO 63 Cb -0.15 -3.02 0.01 0.00 0.02 0.00 0.00 34.50 31.36 2cp3 s PRO 63 CO 0.65 -0.45 0.94 1.63 -0.33 0.00 0.00 177.00 179.44 2cp3 n LYS 64 N 0.99 -6.31 -1.75 5.54 4.01 -1.25 -4.92 118.16 114.48 2cp3 n LYS 64 Ca 0.02 0.66 0.03 0.00 -0.51 0.00 0.00 58.31 58.51 2cp3 n LYS 64 Cb 0.40 -5.18 0.03 0.00 -0.51 0.00 0.00 35.03 29.76 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 -4.49 0.25 -3.15 2.13 3.72 -1.13 -3.36 117.46 111.43 2cp3 n PHE 65 Ca 0.01 -0.84 0.05 0.00 -0.05 0.00 0.00 57.45 56.62 2cp3 n PHE 65 Cb 0.55 -0.17 -0.01 0.00 -0.94 0.00 0.00 39.48 38.91 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 -2.37 -0.47 -0.17 1.37 0.00 -1.20 -4.18 107.32 100.29 2cp3 s GLY 66 Ca 0.33 2.59 -0.02 0.00 0.00 0.00 0.00 44.72 47.62 2cp3 s GLY 66 CO -0.14 3.78 -0.10 -2.27 0.00 0.00 0.00 173.10 174.37 2cp3 s LEU 67 N 2.94 2.77 0.14 0.66 0.20 0.11 -3.41 118.68 122.08 2cp3 s LEU 67 Ca 0.04 -0.36 -0.24 0.00 0.69 0.00 0.00 54.13 54.25 2cp3 s LEU 67 Cb -0.10 -1.66 -0.07 0.00 -0.43 0.00 0.00 46.19 43.92 2cp3 s LEU 67 CO -0.13 0.08 0.73 -0.36 -0.29 0.00 0.00 176.35 176.39 2cp3 s PHE 68 N 0.84 3.87 -0.14 5.38 0.08 -1.26 -0.99 117.98 125.76 2cp3 s PHE 68 Ca -0.03 1.55 -0.20 0.00 0.12 0.00 0.00 56.93 58.37 2cp3 s PHE 68 Cb -0.15 -2.72 0.05 0.00 -0.57 0.00 0.00 43.02 39.63 2cp3 s PHE 68 CO 0.01 0.51 0.51 0.00 -0.10 0.00 0.00 175.22 176.14 2cp3 s ALA 69 N -1.03 -1.27 0.73 5.36 0.00 -0.93 -4.97 121.76 119.65 2cp3 s ALA 69 Ca 0.35 1.23 -0.16 0.00 0.00 0.00 0.00 51.96 53.38 2cp3 s ALA 69 Cb -0.22 -0.54 -0.01 0.00 0.00 0.00 0.00 23.12 22.35 2cp3 s ALA 69 CO 0.24 -0.27 0.80 -2.30 0.00 0.00 0.00 175.76 174.24 2cp3 n PRO 70 N 2.21 0.39 -0.12 0.00 -0.02 -1.26 -1.13 135.00 135.08 2cp3 n PRO 70 Ca -0.16 0.18 -0.08 0.00 -2.02 0.00 0.00 63.50 61.43 2cp3 n PRO 70 Cb 0.56 -2.07 0.00 0.00 -0.02 0.00 0.00 33.50 31.97 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 -0.36 1.06 0.00 4.25 2.10 -1.67 -1.23 117.51 121.67 2cp3 h ILE 71 Ca -0.46 -0.16 0.00 0.00 1.08 0.00 0.00 64.86 65.31 2cp3 h ILE 71 Cb 1.34 0.55 0.00 0.00 -1.09 0.00 0.00 36.82 37.61 2cp3 h ILE 71 CO 0.45 0.09 0.00 1.12 -1.08 0.00 0.00 178.15 178.73 2cp3 h HIS 72 N 0.47 0.00 -0.63 2.19 2.07 -1.91 -1.39 115.15 115.96 2cp3 h HIS 72 Ca 0.15 0.00 -0.18 0.00 -2.85 0.00 0.00 60.37 57.48 2cp3 h HIS 72 Cb -0.02 0.00 -0.11 0.00 2.57 0.00 0.00 27.41 29.85 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 -2.96 3.34 -5.14 5.12 4.76 -0.47 -4.90 118.16 117.91 2cp3 n LYS 73 Ca -0.02 -2.58 -0.32 0.00 -2.87 0.00 0.00 58.31 52.53 2cp3 n LYS 73 Cb 0.15 -2.08 -0.15 0.00 -1.84 0.00 0.00 35.03 31.11 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 -2.58 2.40 -0.20 -0.18 1.01 -0.53 -4.45 120.40 115.87 2cp3 s VAL 74 Ca 0.46 -0.95 0.00 0.00 0.00 0.00 0.00 61.98 61.50 2cp3 s VAL 74 Cb 0.37 -1.90 0.05 0.00 0.00 0.00 0.00 36.38 34.90 2cp3 s VAL 74 CO 0.12 0.57 -0.08 -0.63 0.00 0.00 0.00 175.10 175.08 2cp3 s ILE 75 N -0.34 1.48 0.61 2.22 1.01 -1.22 -4.94 121.20 120.02 2cp3 s ILE 75 Ca 0.02 -0.95 -0.18 0.00 0.00 0.00 0.00 60.65 59.54 2cp3 s ILE 75 Cb -0.12 -1.62 -0.03 0.00 0.01 0.00 0.00 42.46 40.70 2cp3 s ILE 75 CO 0.02 0.11 1.16 -0.60 0.00 0.00 0.00 174.94 175.63 2cp3 s ARG 76 N 1.46 2.98 -0.09 2.79 3.52 -1.26 1.00 118.95 129.34 2cp3 s ARG 76 Ca -0.02 1.64 0.23 0.00 -0.13 0.00 0.00 55.73 57.45 2cp3 s ARG 76 Cb -0.16 -1.95 0.44 0.00 -1.56 0.00 0.00 34.95 31.72 2cp3 s ARG 76 CO -0.08 -1.16 1.17 -0.89 -0.81 0.00 0.00 175.30 173.53 2cp3 n ILE 77 N -1.81 0.63 0.00 4.11 5.41 0.17 -4.82 119.36 123.06 2cp3 n ILE 77 Ca 0.12 -1.77 0.00 0.00 1.00 0.00 0.00 62.75 62.10 2cp3 n ILE 77 Cb 0.51 0.79 0.00 0.00 -0.71 0.00 0.00 39.64 40.23 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 0.03 -1.38 3.72 7.39 0.00 -1.26 -4.91 105.19 108.78 2cp3 n GLY 78 Ca 0.10 -1.14 -0.42 0.00 0.00 0.00 0.00 46.02 44.56 2cp3 n GLY 78 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2cp3 s SER 79 N -1.53 6.95 0.00 1.61 1.04 -1.26 -4.86 113.70 115.65 2cp3 s SER 79 Ca 0.00 2.22 0.00 0.00 0.48 0.00 0.00 55.95 58.65 2cp3 s SER 79 Cb 0.00 -2.59 0.00 0.00 0.10 0.00 0.00 66.02 63.53 2cp3 s SER 79 CO 0.00 -0.54 0.00 0.61 0.98 0.00 0.00 173.24 174.29 2cp3 n GLY 80 N 3.09 -1.40 2.71 7.32 0.00 -1.26 -5.05 105.19 110.60 2cp3 n GLY 80 Ca 0.09 0.55 -0.28 0.00 0.00 0.00 0.00 46.02 46.38 2cp3 n GLY 80 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2cp3 n PRO 81 N 0.00 2.07 -0.93 1.61 -0.04 -1.26 -4.36 135.00 132.09 2cp3 n PRO 81 Ca 0.00 -1.62 0.00 0.00 -0.04 0.00 0.00 63.50 61.84 2cp3 n PRO 81 Cb 0.00 -2.60 0.17 0.00 -0.04 0.00 0.00 33.50 31.02 2cp3 n PRO 81 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2cp3 n SER 82 N 4.96 2.30 0.00 3.54 3.41 -1.26 -4.73 113.62 121.84 2cp3 n SER 82 Ca 0.48 -3.79 0.00 0.00 -0.26 0.00 0.00 58.87 55.30 2cp3 n SER 82 Cb 0.20 -0.48 0.00 0.00 -0.26 0.00 0.00 64.21 63.67 2cp3 n SER 82 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2cp3 n SER 83 N -0.98 0.00 0.00 4.04 3.41 -1.26 -5.33 113.62 113.50 2cp3 n SER 83 Ca 0.23 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.84 2cp3 n SER 83 Cb 0.76 0.11 0.00 0.00 -0.26 0.00 0.00 64.21 64.83 2cp3 n SER 83 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49