#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dib s SER 2 N 0.00 -0.39 -0.14 1.61 0.01 -1.26 -5.17 113.70 108.37 2dib s SER 2 Ca 0.00 0.61 -0.17 0.00 1.31 0.00 0.00 55.95 57.70 2dib s SER 2 Cb 0.00 0.67 0.04 0.00 0.21 0.00 0.00 66.02 66.95 2dib s SER 2 CO 0.00 -0.28 0.46 -0.55 0.41 0.00 0.00 173.24 173.28 2dib s SER 3 N -0.38 -0.45 0.00 2.44 0.15 -1.26 -5.14 113.70 109.06 2dib s SER 3 Ca -0.05 0.78 0.00 0.00 0.70 0.00 0.00 55.95 57.37 2dib s SER 3 Cb -0.03 0.81 0.00 0.00 -1.71 0.00 0.00 66.02 65.09 2dib s SER 3 CO 0.03 -0.25 0.00 0.61 1.20 0.00 0.00 173.24 174.83 2dib n GLY 4 N 2.39 1.26 3.71 9.45 0.00 -1.26 -5.16 105.19 115.58 2dib n GLY 4 Ca -0.15 0.49 -0.35 0.00 0.00 0.00 0.00 46.02 46.01 2dib n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dib s SER 5 N 0.00 5.37 -0.11 1.61 1.04 -1.26 -5.11 113.70 115.24 2dib s SER 5 Ca 0.00 0.15 0.01 0.00 0.48 0.00 0.00 55.95 56.60 2dib s SER 5 Cb 0.00 -1.52 -0.01 0.00 0.10 0.00 0.00 66.02 64.59 2dib s SER 5 CO 0.00 0.36 -0.16 -0.55 0.98 0.00 0.00 173.24 173.86 2dib s SER 6 N -1.09 3.77 0.00 7.02 0.15 -1.26 -5.02 113.70 117.27 2dib s SER 6 Ca 0.15 -0.37 0.00 0.00 0.70 0.00 0.00 55.95 56.43 2dib s SER 6 Cb -0.11 -1.44 0.00 0.00 -1.71 0.00 0.00 66.02 62.75 2dib s SER 6 CO 0.05 0.19 0.00 0.61 1.20 0.00 0.00 173.24 175.29 2dib n GLY 7 N 3.35 2.69 3.03 9.45 0.00 -1.26 -5.09 105.19 117.37 2dib n GLY 7 Ca -0.18 -0.17 -0.33 0.00 0.00 0.00 0.00 46.02 45.33 2dib n GLY 7 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2dib s HIS 8 N 0.00 3.63 0.81 1.61 4.02 -1.26 -5.09 115.29 119.02 2dib s HIS 8 Ca 0.00 -3.06 -0.16 0.00 1.02 0.00 0.00 55.06 52.86 2dib s HIS 8 Cb 0.00 -3.05 -0.09 0.00 -1.02 0.00 0.00 32.58 28.42 2dib s HIS 8 CO 0.00 -0.71 -0.13 1.19 1.02 0.00 0.00 174.74 176.11 2dib n PHE 9 N 2.56 -3.01 0.97 1.40 3.01 -1.26 -4.77 117.46 116.37 2dib n PHE 9 Ca 0.16 0.21 0.05 0.00 1.01 0.00 0.00 57.45 58.89 2dib n PHE 9 Cb 0.36 -1.67 0.33 0.00 -0.01 0.00 0.00 39.48 38.49 2dib n PHE 9 CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 2dib n PRO 10 N 0.79 0.49 -2.40 -1.08 -0.04 -1.26 -4.76 135.00 126.74 2dib n PRO 10 Ca 0.05 0.00 -0.24 0.00 -0.04 0.00 0.00 63.50 63.27 2dib n PRO 10 Cb 0.52 -1.35 0.05 0.00 -0.04 0.00 0.00 33.50 32.68 2dib n PRO 10 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2dib s ALA 11 N -2.00 3.50 -0.16 0.55 0.00 -1.26 -5.12 121.76 117.27 2dib s ALA 11 Ca 0.16 -1.11 -0.11 0.00 0.00 0.00 0.00 51.96 50.91 2dib s ALA 11 Cb 0.08 -2.36 0.05 0.00 0.00 0.00 0.00 23.12 20.89 2dib s ALA 11 CO 0.13 -1.05 0.40 1.03 0.00 0.00 0.00 175.76 176.27 2dib s ARG 12 N -5.03 0.41 0.11 0.00 0.52 -1.26 -5.14 118.95 108.56 2dib s ARG 12 Ca 0.59 0.69 0.10 0.00 -0.52 0.00 0.00 55.73 56.59 2dib s ARG 12 Cb -0.11 0.06 -0.04 0.00 0.52 0.00 0.00 34.95 35.38 2dib s ARG 12 CO 0.42 -0.12 -0.23 0.08 0.02 0.00 0.00 175.30 175.46 2dib s VAL 13 N 0.99 2.49 0.16 3.52 1.01 -1.26 -5.09 120.40 122.22 2dib s VAL 13 Ca -0.06 -1.57 -0.31 0.00 0.00 0.00 0.00 61.98 60.03 2dib s VAL 13 Cb -0.07 -2.10 -0.11 0.00 0.00 0.00 0.00 36.38 34.11 2dib s VAL 13 CO -0.08 0.15 1.77 -0.75 0.00 0.00 0.00 175.10 176.19 2dib s LYS 14 N -1.93 4.13 -0.50 2.72 2.20 -1.26 -4.96 119.74 120.15 2dib s LYS 14 Ca 0.15 2.59 0.03 0.00 -0.36 0.00 0.00 55.97 58.38 2dib s LYS 14 Cb -0.10 -3.34 0.15 0.00 -1.51 0.00 0.00 37.83 33.02 2dib s LYS 14 CO 0.07 -0.79 0.31 0.08 -0.36 0.00 0.00 175.35 174.66 2dib s VAL 15 N 1.97 1.67 0.44 4.02 1.01 -1.26 -5.11 120.40 123.14 2dib s VAL 15 Ca 0.78 -3.01 -0.24 0.00 0.00 0.00 0.00 61.98 59.51 2dib s VAL 15 Cb -0.48 -2.15 -0.10 0.00 0.00 0.00 0.00 36.38 33.66 2dib s VAL 15 CO 0.34 -0.96 1.08 -1.84 0.00 0.00 0.00 175.10 173.72 2dib n GLU 16 N 3.07 1.45 -2.21 2.72 0.28 -1.26 -4.90 120.64 119.79 2dib n GLU 16 Ca 0.14 0.52 -0.42 0.00 -0.16 0.00 0.00 57.16 57.24 2dib n GLU 16 Cb 0.36 -2.15 -0.03 0.00 1.43 0.00 0.00 31.44 31.06 2dib n GLU 16 CO 0.00 0.00 0.00 -1.25 -0.16 0.00 0.00 177.13 175.72 2dib s PRO 17 N -2.15 4.34 -0.18 3.44 0.04 -1.26 -4.92 135.00 134.31 2dib s PRO 17 Ca 0.64 2.03 0.14 0.00 0.04 0.00 0.00 61.00 63.85 2dib s PRO 17 Cb -0.53 -3.26 0.72 0.00 0.04 0.00 0.00 34.50 31.47 2dib s PRO 17 CO 0.56 -0.40 1.61 0.00 0.04 0.00 0.00 177.00 178.80 2dib n ALA 18 N 3.88 3.52 -3.16 8.56 0.00 -1.26 -4.91 120.51 127.15 2dib n ALA 18 Ca 0.11 -1.64 -0.12 0.00 0.00 0.00 0.00 53.44 51.79 2dib n ALA 18 Cb 0.43 -1.09 -0.10 0.00 0.00 0.00 0.00 19.45 18.70 2dib n ALA 18 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2dib s VAL 19 N -2.33 0.06 -0.09 0.00 0.11 -1.26 -5.09 120.40 111.80 2dib s VAL 19 Ca 0.49 -0.52 -0.01 0.00 -2.93 0.00 0.00 61.98 59.01 2dib s VAL 19 Cb 0.35 -0.49 -0.01 0.00 -1.53 0.00 0.00 36.38 34.71 2dib s VAL 19 CO 0.17 -0.29 0.05 0.44 -3.33 0.00 0.00 175.10 172.14 2dib h ASP 20 N 4.32 -0.03 -6.49 3.54 3.32 -1.93 -3.47 116.42 115.68 2dib h ASP 20 Ca -0.30 0.00 -0.51 0.00 0.02 0.00 0.00 57.03 56.24 2dib h ASP 20 Cb 1.19 0.01 -0.32 0.00 0.22 0.00 0.00 39.33 40.43 2dib h ASP 20 CO 0.40 0.43 -0.74 0.35 -1.72 0.00 0.00 179.24 177.96 2dib n THR 21 N -4.64 0.00 0.32 0.35 -2.24 -1.26 -4.72 114.28 102.09 2dib n THR 21 Ca -0.00 0.00 0.06 0.00 -2.27 0.00 0.00 64.05 61.83 2dib n THR 21 Cb 0.02 -0.41 -0.08 0.00 -2.10 0.00 0.00 70.33 67.76 2dib n THR 21 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2dib n SER 22 N -1.94 1.25 -0.62 3.42 7.64 -1.26 -4.04 113.62 118.07 2dib n SER 22 Ca 0.10 -0.46 0.06 0.00 1.01 0.00 0.00 58.87 59.58 2dib n SER 22 Cb 0.38 1.22 0.20 0.00 -1.01 0.00 0.00 64.21 65.00 2dib n SER 22 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 2dib n ARG 23 N -1.53 2.00 -2.37 1.43 1.85 -1.26 -4.73 116.66 112.05 2dib n ARG 23 Ca 0.00 -2.87 -0.42 0.00 -1.00 0.00 0.00 57.85 53.57 2dib n ARG 23 Cb 0.23 -1.70 -0.03 0.00 -1.05 0.00 0.00 32.46 29.92 2dib n ARG 23 CO 0.00 0.00 0.00 0.42 -0.01 0.00 0.00 177.63 178.04 2dib s ILE 24 N -2.97 3.88 -0.06 8.89 1.01 -1.26 -5.03 121.20 125.66 2dib s ILE 24 Ca 0.39 1.35 0.03 0.00 0.00 0.00 0.00 60.65 62.41 2dib s ILE 24 Cb 0.34 -3.86 -0.03 0.00 0.01 0.00 0.00 42.46 38.92 2dib s ILE 24 CO 0.03 0.10 -0.12 -0.54 0.00 0.00 0.00 174.94 174.41 2dib s LYS 25 N 1.12 2.58 -0.10 2.79 1.02 -1.25 -4.94 119.74 120.97 2dib s LYS 25 Ca 0.60 -0.66 0.01 0.00 0.02 0.00 0.00 55.97 55.94 2dib s LYS 25 Cb -0.31 -2.44 0.02 0.00 -0.52 0.00 0.00 37.83 34.58 2dib s LYS 25 CO 0.29 0.63 -0.12 0.14 -0.92 0.00 0.00 175.35 175.37 2dib s VAL 26 N -0.74 1.28 0.05 3.17 -7.23 -1.26 -1.07 120.40 114.60 2dib s VAL 26 Ca 0.11 -0.50 0.06 0.00 -1.81 0.00 0.00 61.98 59.84 2dib s VAL 26 Cb -0.11 -1.20 -0.02 0.00 0.56 0.00 0.00 36.38 35.61 2dib s VAL 26 CO 0.01 0.40 -0.16 0.72 -0.31 0.00 0.00 175.10 175.75 2dib s PHE 27 N 1.12 1.40 0.00 2.82 -0.12 -0.87 -4.98 117.98 117.36 2dib s PHE 27 Ca -0.05 -0.37 0.00 0.00 -0.05 0.00 0.00 56.93 56.46 2dib s PHE 27 Cb -0.14 -0.82 0.00 0.00 -0.63 0.00 0.00 43.02 41.42 2dib s PHE 27 CO -0.02 0.06 0.00 0.41 -0.05 0.00 0.00 175.22 175.62 2dib n GLY 28 N 1.76 3.66 0.23 1.99 0.00 -1.26 -1.28 105.19 110.29 2dib n GLY 28 Ca -0.18 -1.71 -0.08 0.00 0.00 0.00 0.00 46.02 44.05 2dib n GLY 28 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dib h PRO 29 N 0.00 0.57 0.00 1.61 0.13 -1.97 0.18 132.00 132.53 2dib h PRO 29 Ca 0.00 -0.30 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 2dib h PRO 29 Cb 0.00 0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.14 2dib h PRO 29 CO 0.00 0.89 0.14 0.78 -0.23 0.00 0.00 178.00 179.58 2dib h GLY 30 N 1.05 0.00 0.00 1.56 0.00 -1.80 0.13 103.07 104.01 2dib h GLY 30 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.37 2dib h GLY 30 CO 0.08 0.00 -0.82 4.51 0.00 0.00 0.00 176.54 180.31 2dib n ILE 31 N -2.43 0.00 -0.07 2.60 0.13 -1.11 -4.77 119.36 113.70 2dib n ILE 31 Ca -0.02 0.00 -0.18 0.00 -1.10 0.00 0.00 62.75 61.46 2dib n ILE 31 Cb 0.18 0.25 -0.13 0.00 -0.84 0.00 0.00 39.64 39.10 2dib n ILE 31 CO 0.00 0.00 0.00 -0.33 2.80 0.00 0.00 176.55 179.02 2dib h GLU 32 N 0.00 0.03 0.00 9.51 4.39 -0.00 -3.43 114.58 125.08 2dib h GLU 32 Ca 0.00 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.65 2dib h GLU 32 Cb 0.11 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.78 2dib h GLU 32 CO 0.00 1.02 0.00 0.41 -1.16 0.00 0.00 179.01 179.28 2dib n GLY 33 N 1.56 0.85 0.13 -3.84 0.00 0.41 -4.61 105.19 99.69 2dib n GLY 33 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.83 2dib n GLY 33 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2dib n LYS 34 N 0.00 0.00 -1.19 1.61 4.76 -1.24 -4.71 118.16 117.39 2dib n LYS 34 Ca 0.00 0.00 -0.22 0.00 -2.87 0.00 0.00 58.31 55.22 2dib n LYS 34 Cb 0.00 -0.41 0.18 0.00 -1.84 0.00 0.00 35.03 32.96 2dib n LYS 34 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 2dib n ASP 35 N -2.45 3.63 -0.70 4.39 8.00 -1.26 -4.43 116.55 123.73 2dib n ASP 35 Ca 0.00 -3.62 0.05 0.00 0.71 0.00 0.00 54.79 51.92 2dib n ASP 35 Cb 0.00 -0.82 0.15 0.00 -0.02 0.00 0.00 41.12 40.43 2dib n ASP 35 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 2dib n VAL 36 N -1.14 0.58 -0.98 2.53 0.31 -1.26 -4.43 118.33 113.95 2dib n VAL 36 Ca 0.57 -0.47 -0.36 0.00 -0.01 0.00 0.00 64.34 64.07 2dib n VAL 36 Cb 1.61 0.11 0.05 0.00 -0.91 0.00 0.00 33.84 34.71 2dib n VAL 36 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 2dib n PHE 37 N 0.44 -4.60 -1.78 3.52 3.72 -1.26 -4.69 117.46 112.80 2dib n PHE 37 Ca 0.11 0.01 -0.41 0.00 -0.05 0.00 0.00 57.45 57.11 2dib n PHE 37 Cb 0.35 -1.49 -0.01 0.00 -0.94 0.00 0.00 39.48 37.38 2dib n PHE 37 CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 176.76 177.21 2dib s ARG 38 N -2.23 4.11 -1.29 -1.08 3.52 -1.26 -2.18 118.95 118.54 2dib s ARG 38 Ca 0.43 2.58 -0.05 0.00 -0.13 0.00 0.00 55.73 58.56 2dib s ARG 38 Cb -0.19 -3.00 0.01 0.00 -1.56 0.00 0.00 34.95 30.20 2dib s ARG 38 CO 0.80 -0.61 0.72 0.39 -0.81 0.00 0.00 175.30 175.80 2dib n GLU 39 N 1.64 -5.31 -4.79 5.12 1.02 0.73 -4.79 120.64 114.26 2dib n GLU 39 Ca 0.06 0.77 -0.25 0.00 -0.02 0.00 0.00 57.16 57.72 2dib n GLU 39 Cb 0.38 -5.43 -0.15 0.00 -0.02 0.00 0.00 31.44 26.22 2dib n GLU 39 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2dib s ALA 40 N -3.17 1.56 -0.69 0.62 0.00 -0.92 -5.03 121.76 114.13 2dib s ALA 40 Ca 0.36 -0.87 -0.25 0.00 0.00 0.00 0.00 51.96 51.20 2dib s ALA 40 Cb -0.16 -0.36 0.05 0.00 0.00 0.00 0.00 23.12 22.65 2dib s ALA 40 CO 0.44 0.37 1.13 0.99 0.00 0.00 0.00 175.76 178.69 2dib s THR 41 N -0.56 4.02 0.11 0.00 2.01 -1.26 -4.25 115.64 115.71 2dib s THR 41 Ca 0.07 0.11 0.10 0.00 0.31 0.00 0.00 61.69 62.28 2dib s THR 41 Cb -0.08 -4.79 -0.04 0.00 0.01 0.00 0.00 72.50 67.60 2dib s THR 41 CO 0.00 -1.63 -0.26 0.28 -0.69 0.00 0.00 174.62 172.32 2dib s THR 42 N 4.92 2.17 0.07 -0.82 -1.32 -1.02 -4.99 115.64 114.66 2dib s THR 42 Ca 0.30 -1.65 -0.13 0.00 -1.21 0.00 0.00 61.69 58.99 2dib s THR 42 Cb -0.12 -1.91 0.02 0.00 -1.51 0.00 0.00 72.50 68.98 2dib s THR 42 CO 0.14 0.14 0.31 1.51 -2.21 0.00 0.00 174.62 174.50 2dib s ASP 43 N -1.86 -0.11 0.42 8.08 1.47 -1.26 -0.83 116.67 122.59 2dib s ASP 43 Ca 0.13 -0.32 0.04 0.00 1.18 0.00 0.00 52.55 53.58 2dib s ASP 43 Cb -0.10 0.39 -0.04 0.00 -0.34 0.00 0.00 42.92 42.83 2dib s ASP 43 CO 0.05 -0.70 0.05 0.72 0.68 0.00 0.00 175.17 175.96 2dib s PHE 44 N -3.16 2.01 -0.07 2.11 -0.71 -0.72 -2.65 117.98 114.78 2dib s PHE 44 Ca -0.01 -0.98 0.03 0.00 -1.04 0.00 0.00 56.93 54.93 2dib s PHE 44 Cb 0.01 -1.45 0.01 0.00 -1.21 0.00 0.00 43.02 40.38 2dib s PHE 44 CO -0.07 0.09 -0.16 0.99 -1.34 0.00 0.00 175.22 174.73 2dib s THR 45 N -3.03 1.39 -0.47 -4.49 2.01 -0.40 -2.55 115.64 108.10 2dib s THR 45 Ca 0.24 -0.63 -0.11 0.00 0.31 0.00 0.00 61.69 61.49 2dib s THR 45 Cb 0.05 -1.23 0.11 0.00 0.01 0.00 0.00 72.50 71.43 2dib s THR 45 CO 0.12 0.41 0.36 -0.69 -0.69 0.00 0.00 174.62 174.13 2dib s VAL 46 N 0.51 4.52 -0.12 3.82 1.01 0.72 -2.04 120.40 128.83 2dib s VAL 46 Ca -0.14 -1.55 -0.29 0.00 0.00 0.00 0.00 61.98 59.99 2dib s VAL 46 Cb -0.16 -3.88 -0.05 0.00 0.00 0.00 0.00 36.38 32.30 2dib s VAL 46 CO 0.05 -0.70 1.66 -0.62 0.00 0.00 0.00 175.10 175.48 2dib s ASP 47 N 2.70 6.53 -0.05 3.32 2.15 -0.23 -2.13 116.67 128.97 2dib s ASP 47 Ca 0.04 2.02 0.02 0.00 0.43 0.00 0.00 52.55 55.06 2dib s ASP 47 Cb -0.26 -2.53 0.01 0.00 -0.30 0.00 0.00 42.92 39.84 2dib s ASP 47 CO 0.02 -1.07 -0.08 -0.55 -0.17 0.00 0.00 175.17 173.31 2dib s SER 48 N 3.80 1.32 0.00 -0.34 0.15 -1.24 -3.75 113.70 113.64 2dib s SER 48 Ca 0.73 -0.21 0.00 0.00 0.70 0.00 0.00 55.95 57.18 2dib s SER 48 Cb -0.30 -0.57 0.00 0.00 -1.71 0.00 0.00 66.02 63.43 2dib s SER 48 CO 0.29 0.01 0.00 0.54 1.20 0.00 0.00 173.24 175.28 2dib n ARG 49 N 3.79 0.00 0.00 5.44 1.74 -1.26 -4.42 116.66 121.95 2dib n ARG 49 Ca -0.23 0.00 0.04 0.00 -0.77 0.00 0.00 57.85 56.89 2dib n ARG 49 Cb 0.52 0.00 0.23 0.00 -1.02 0.00 0.00 32.46 32.18 2dib n ARG 49 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 2dib n PRO 50 N -2.22 0.49 -0.09 5.56 -0.04 -1.26 -3.09 135.00 134.34 2dib n PRO 50 Ca 0.00 0.00 -0.19 0.00 -0.04 0.00 0.00 63.50 63.27 2dib n PRO 50 Cb 0.00 -1.24 -0.06 0.00 -0.04 0.00 0.00 33.50 32.15 2dib n PRO 50 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2dib n LEU 51 N -0.74 1.44 -4.10 1.53 4.77 -1.26 -4.97 117.00 113.66 2dib n LEU 51 Ca 0.06 0.25 -0.10 0.00 -0.03 0.00 0.00 56.01 56.18 2dib n LEU 51 Cb 0.03 -0.59 -0.09 0.00 -2.33 0.00 0.00 43.42 40.44 2dib n LEU 51 CO 0.04 0.30 -0.18 0.28 -1.33 0.00 0.00 177.39 176.50 2dib s THR 52 N -2.40 0.06 0.00 -5.08 -1.32 -1.18 -5.07 115.64 100.65 2dib s THR 52 Ca -0.27 -1.77 0.00 0.00 -1.21 0.00 0.00 61.69 58.44 2dib s THR 52 Cb 0.10 -2.12 0.00 0.00 -1.51 0.00 0.00 72.50 68.96 2dib s THR 52 CO 0.34 -0.27 0.00 0.00 -2.21 0.00 0.00 174.62 172.48 2dib n GLN 53 N -0.19 1.30 -1.49 7.08 3.00 -1.26 -4.20 117.38 121.61 2dib n GLN 53 Ca -0.04 0.00 -0.22 0.00 -0.01 0.00 0.00 57.00 56.73 2dib n GLN 53 Cb 0.64 -0.71 0.09 0.00 0.00 0.00 0.00 30.24 30.25 2dib n GLN 53 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.06 178.39 2dib n VAL 54 N -1.33 2.89 0.00 5.09 0.24 -1.26 -2.95 118.33 121.01 2dib n VAL 54 Ca 0.00 -3.41 0.00 0.00 -2.04 0.00 0.00 64.34 58.89 2dib n VAL 54 Cb 0.21 -0.92 0.00 0.00 -1.47 0.00 0.00 33.84 31.66 2dib n VAL 54 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2dib n GLY 55 N -0.89 1.78 0.00 7.63 0.00 -1.26 -4.46 105.19 107.99 2dib n GLY 55 Ca 0.47 0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.62 2dib n GLY 55 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dib n GLY 56 N 0.00 -0.45 2.27 -0.02 0.00 -1.26 -4.80 105.19 100.93 2dib n GLY 56 Ca 0.00 -1.68 -0.27 0.00 0.00 0.00 0.00 46.02 44.08 2dib n GLY 56 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2dib n ASP 57 N -1.20 5.11 -1.67 1.61 -0.08 -1.26 -4.72 116.55 114.32 2dib n ASP 57 Ca 0.00 -3.74 -0.10 0.00 -1.51 0.00 0.00 54.79 49.43 2dib n ASP 57 Cb 0.00 -0.46 0.22 0.00 2.34 0.00 0.00 41.12 43.22 2dib n ASP 57 CO 0.00 0.00 0.00 1.41 0.12 0.00 0.00 177.20 178.73 2dib n HIS 58 N -0.62 2.04 -4.81 -0.67 8.25 -1.26 -4.96 115.22 113.19 2dib n HIS 58 Ca 0.43 -1.55 -0.32 0.00 -0.26 0.00 0.00 57.72 56.02 2dib n HIS 58 Cb 0.79 -0.68 -0.13 0.00 1.12 0.00 0.00 29.99 31.10 2dib n HIS 58 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2dib s ILE 59 N -3.18 2.97 -0.04 1.59 -1.09 -1.26 -3.69 121.20 116.49 2dib s ILE 59 Ca 0.51 -0.90 -0.03 0.00 -2.23 0.00 0.00 60.65 58.00 2dib s ILE 59 Cb 0.43 -2.20 0.02 0.00 -1.58 0.00 0.00 42.46 39.14 2dib s ILE 59 CO 0.07 0.49 0.10 -0.75 -1.23 0.00 0.00 174.94 173.63 2dib s LYS 60 N -1.01 0.09 0.07 2.79 2.36 -1.23 -5.03 119.74 117.79 2dib s LYS 60 Ca 0.13 0.20 0.03 0.00 -2.55 0.00 0.00 55.97 53.78 2dib s LYS 60 Cb -0.11 -0.03 -0.03 0.00 -1.05 0.00 0.00 37.83 36.61 2dib s LYS 60 CO 0.03 -0.07 -0.09 0.00 1.55 0.00 0.00 175.35 176.77 2dib s ALA 61 N 0.44 0.87 -0.19 3.13 0.00 -1.26 -2.95 121.76 121.79 2dib s ALA 61 Ca -0.03 -1.04 -0.05 0.00 0.00 0.00 0.00 51.96 50.84 2dib s ALA 61 Cb -0.05 0.06 0.10 0.00 0.00 0.00 0.00 23.12 23.23 2dib s ALA 61 CO -0.02 -0.06 0.34 -1.58 0.00 0.00 0.00 175.76 174.44 2dib s HIS 62 N -2.20 -0.65 0.22 0.00 5.04 -1.16 -4.84 115.29 111.70 2dib s HIS 62 Ca 0.00 1.02 -0.21 0.00 -1.54 0.00 0.00 55.06 54.33 2dib s HIS 62 Cb -0.04 0.05 -0.08 0.00 0.04 0.00 0.00 32.58 32.55 2dib s HIS 62 CO -0.01 -0.54 0.76 0.42 -2.34 0.00 0.00 174.74 173.03 2dib s ILE 63 N 2.51 4.49 -0.29 0.89 1.01 -1.26 -2.14 121.20 126.41 2dib s ILE 63 Ca 0.05 1.42 -0.00 0.00 0.00 0.00 0.00 60.65 62.11 2dib s ILE 63 Cb -0.13 -3.93 0.09 0.00 0.01 0.00 0.00 42.46 38.50 2dib s ILE 63 CO -0.12 0.26 0.07 0.00 0.00 0.00 0.00 174.94 175.14 2dib s ALA 64 N -1.46 1.75 0.81 9.38 0.00 -0.99 -3.73 121.76 127.51 2dib s ALA 64 Ca 0.42 -1.68 -0.13 0.00 0.00 0.00 0.00 51.96 50.58 2dib s ALA 64 Cb -0.18 -1.61 0.08 0.00 0.00 0.00 0.00 23.12 21.41 2dib s ALA 64 CO 0.22 -1.57 1.18 -0.80 0.00 0.00 0.00 175.76 174.79 2dib s ASN 65 N 1.50 3.71 0.00 0.00 0.01 -0.09 -0.94 114.94 119.13 2dib s ASN 65 Ca 0.07 2.25 0.16 0.00 -0.71 0.00 0.00 52.86 54.63 2dib s ASN 65 Cb -0.18 -2.58 0.93 0.00 0.41 0.00 0.00 41.25 39.84 2dib s ASN 65 CO -0.19 -2.58 1.35 -0.81 -1.51 0.00 0.00 177.10 173.36 2dib n PRO 66 N -3.38 0.48 -0.04 -0.60 -0.04 -1.23 -2.21 135.00 127.99 2dib n PRO 66 Ca 0.13 0.01 0.00 0.00 -0.04 0.00 0.00 63.50 63.59 2dib n PRO 66 Cb 0.51 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.36 2dib n PRO 66 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2dib n SER 67 N -1.01 1.62 0.00 3.54 7.64 -1.26 -5.01 113.62 119.14 2dib n SER 67 Ca 0.12 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.00 2dib n SER 67 Cb 0.06 1.25 0.00 0.00 -1.01 0.00 0.00 64.21 64.51 2dib n SER 67 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dib n GLY 68 N 1.91 1.46 3.67 0.23 0.00 -0.94 -5.13 105.19 106.39 2dib n GLY 68 Ca -0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.61 2dib n GLY 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dib s ALA 69 N -0.96 0.91 -0.05 4.61 0.00 -1.26 -4.73 121.76 120.28 2dib s ALA 69 Ca 0.00 -0.29 0.01 0.00 0.00 0.00 0.00 51.96 51.68 2dib s ALA 69 Cb 0.00 -3.14 0.02 0.00 0.00 0.00 0.00 23.12 20.00 2dib s ALA 69 CO 0.00 -2.87 -0.06 -1.54 0.00 0.00 0.00 175.76 171.30 2dib s SER 70 N -3.36 1.09 0.12 0.00 1.04 -1.26 -0.91 113.70 110.42 2dib s SER 70 Ca 0.65 -0.16 -0.19 0.00 0.48 0.00 0.00 55.95 56.74 2dib s SER 70 Cb -0.19 -0.51 -0.07 0.00 0.10 0.00 0.00 66.02 65.34 2dib s SER 70 CO 0.58 -0.04 0.61 -0.89 0.98 0.00 0.00 173.24 174.48 2dib s THR 71 N 0.87 4.70 0.08 2.02 2.01 -1.24 -5.01 115.64 119.06 2dib s THR 71 Ca -0.12 1.20 -0.31 0.00 0.31 0.00 0.00 61.69 62.78 2dib s THR 71 Cb -0.15 -3.88 -0.06 0.00 0.01 0.00 0.00 72.50 68.42 2dib s THR 71 CO 0.01 0.43 1.21 -0.70 -0.69 0.00 0.00 174.62 174.88 2dib s GLU 72 N -1.43 4.44 0.15 4.92 2.12 -1.26 -4.15 118.70 123.48 2dib s GLU 72 Ca 0.34 1.79 0.06 0.00 0.36 0.00 0.00 54.97 57.52 2dib s GLU 72 Cb -0.18 -3.33 -0.04 0.00 0.26 0.00 0.00 34.13 30.84 2dib s GLU 72 CO 0.20 -0.24 0.07 0.00 -0.54 0.00 0.00 175.26 174.74 2dib s PHE 74 N -1.65 1.72 0.17 0.00 0.08 -0.48 -4.98 117.98 112.84 2dib s PHE 74 Ca 0.29 -1.36 -0.30 0.00 0.12 0.00 0.00 56.93 55.68 2dib s PHE 74 Cb -0.10 -1.36 -0.07 0.00 -0.57 0.00 0.00 43.02 40.92 2dib s PHE 74 CO 0.21 -0.71 0.95 0.08 -0.10 0.00 0.00 175.22 175.64 2dib s VAL 75 N 1.62 4.29 -0.23 -0.44 1.01 -1.26 -0.49 120.40 124.90 2dib s VAL 75 Ca -0.02 2.07 -0.03 0.00 0.00 0.00 0.00 61.98 64.00 2dib s VAL 75 Cb -0.18 -4.32 0.08 0.00 0.00 0.00 0.00 36.38 31.95 2dib s VAL 75 CO -0.09 0.41 0.07 -0.89 0.00 0.00 0.00 175.10 174.60 2dib s THR 76 N -0.59 0.44 -0.00 3.92 2.01 0.60 -4.94 115.64 117.07 2dib s THR 76 Ca 0.44 -0.74 -0.27 0.00 0.31 0.00 0.00 61.69 61.43 2dib s THR 76 Cb -0.25 -1.12 -0.04 0.00 0.01 0.00 0.00 72.50 71.11 2dib s THR 76 CO 0.31 -0.40 0.86 -1.81 -0.69 0.00 0.00 174.62 172.89 2dib s ASP 77 N 1.87 7.24 -0.05 3.53 1.01 -1.26 0.56 116.67 129.58 2dib s ASP 77 Ca 0.03 1.50 0.05 0.00 0.71 0.00 0.00 52.55 54.84 2dib s ASP 77 Cb -0.17 -2.51 0.23 0.00 1.01 0.00 0.00 42.92 41.48 2dib s ASP 77 CO -0.17 -0.16 0.95 0.59 0.21 0.00 0.00 175.17 176.59 2dib n ASN 78 N 3.62 2.05 -2.84 0.27 3.02 -1.13 -4.86 115.26 115.39 2dib n ASN 78 Ca 0.02 -2.20 -0.07 0.00 -0.03 0.00 0.00 54.58 52.30 2dib n ASN 78 Cb 0.51 -0.44 -0.01 0.00 -0.61 0.00 0.00 39.78 39.23 2dib n ASN 78 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2dib n ALA 79 N 0.17 -1.03 0.00 5.41 0.00 -1.26 -4.61 120.51 119.19 2dib n ALA 79 Ca 0.08 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.49 2dib n ALA 79 Cb 0.43 -0.84 0.00 0.00 0.00 0.00 0.00 19.45 19.04 2dib n ALA 79 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2dib n ASP 80 N -1.66 3.75 0.00 0.00 2.03 -1.26 -4.57 116.55 114.84 2dib n ASP 80 Ca 0.02 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.33 2dib n ASP 80 Cb 0.49 0.53 0.00 0.00 -0.72 0.00 0.00 41.12 41.42 2dib n ASP 80 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2dib n GLY 81 N 2.17 0.94 3.86 0.27 0.00 -1.15 -4.52 105.19 106.76 2dib n GLY 81 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.81 2dib n GLY 81 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2dib s THR 82 N 0.00 3.52 0.13 2.61 -4.23 -1.26 -3.60 115.64 112.81 2dib s THR 82 Ca 0.00 -1.34 0.11 0.00 -1.18 0.00 0.00 61.69 59.28 2dib s THR 82 Cb 0.00 -3.19 -0.04 0.00 1.34 0.00 0.00 72.50 70.61 2dib s THR 82 CO 0.00 -0.16 -0.27 -0.31 -0.54 0.00 0.00 174.62 173.34 2dib s TYR 83 N -2.31 2.29 -0.19 3.99 1.51 -0.91 -2.84 117.35 118.91 2dib s TYR 83 Ca 0.42 -0.38 -0.02 0.00 -1.01 0.00 0.00 57.07 56.08 2dib s TYR 83 Cb -0.06 -1.24 0.05 0.00 -0.11 0.00 0.00 41.96 40.61 2dib s TYR 83 CO 0.27 0.34 0.00 -1.14 -1.11 0.00 0.00 175.55 173.91 2dib s GLN 84 N -2.08 0.96 -0.18 -0.62 2.00 0.19 -0.20 119.66 119.73 2dib s GLN 84 Ca 0.14 -0.49 -0.06 0.00 -2.00 0.00 0.00 55.36 52.95 2dib s GLN 84 Cb -0.10 -2.08 -0.03 0.00 0.80 0.00 0.00 33.01 31.60 2dib s GLN 84 CO 0.06 -0.57 0.02 0.08 -0.50 0.00 0.00 175.29 174.39 2dib s VAL 85 N 1.75 4.35 -0.07 1.34 1.01 -1.06 0.22 120.40 127.94 2dib s VAL 85 Ca -0.01 -0.19 0.04 0.00 0.00 0.00 0.00 61.98 61.82 2dib s VAL 85 Cb -0.17 -2.95 -0.02 0.00 0.00 0.00 0.00 36.38 33.24 2dib s VAL 85 CO -0.07 0.45 -0.20 -0.70 0.00 0.00 0.00 175.10 174.58 2dib s GLU 86 N 0.61 2.70 0.07 2.72 2.12 0.35 -1.76 118.70 125.51 2dib s GLU 86 Ca 0.01 -0.80 -0.15 0.00 0.36 0.00 0.00 54.97 54.39 2dib s GLU 86 Cb -0.14 -2.31 0.03 0.00 0.26 0.00 0.00 34.13 31.97 2dib s GLU 86 CO 0.02 0.42 0.34 1.52 -0.54 0.00 0.00 175.26 177.02 2dib s TYR 87 N -0.22 -0.14 -0.32 5.30 -0.85 -0.01 -1.38 117.35 119.72 2dib s TYR 87 Ca -0.01 -0.05 0.02 0.00 -0.52 0.00 0.00 57.07 56.50 2dib s TYR 87 Cb -0.13 0.15 0.10 0.00 0.38 0.00 0.00 41.96 42.45 2dib s TYR 87 CO 0.03 -0.57 0.07 0.99 -1.52 0.00 0.00 175.55 174.54 2dib s THR 88 N -3.01 1.62 0.07 -3.49 2.01 -1.26 -2.42 115.64 109.16 2dib s THR 88 Ca -0.02 -1.88 -0.31 0.00 0.31 0.00 0.00 61.69 59.79 2dib s THR 88 Cb 0.01 -2.20 -0.07 0.00 0.01 0.00 0.00 72.50 70.25 2dib s THR 88 CO -0.06 -0.62 1.39 -2.16 -0.69 0.00 0.00 174.62 172.49 2dib s PRO 89 N 1.24 4.31 -0.09 4.92 0.04 -1.26 -4.78 135.00 139.38 2dib s PRO 89 Ca 0.10 2.03 0.15 0.00 0.04 0.00 0.00 61.00 63.32 2dib s PRO 89 Cb -0.18 -3.40 0.60 0.00 0.04 0.00 0.00 34.50 31.56 2dib s PRO 89 CO -0.16 -0.49 1.48 1.97 0.04 0.00 0.00 177.00 179.84 2dib n PHE 90 N 4.57 1.23 -3.78 0.56 1.16 -1.26 -0.19 117.46 119.74 2dib n PHE 90 Ca 0.12 -0.49 -0.14 0.00 -1.87 0.00 0.00 57.45 55.07 2dib n PHE 90 Cb 0.43 -0.21 -0.15 0.00 -1.61 0.00 0.00 39.48 37.94 2dib n PHE 90 CO 0.00 0.00 0.00 -1.21 -1.87 0.00 0.00 176.76 173.68 2dib s GLU 91 N -1.78 -0.00 -0.86 3.97 0.41 -1.26 -4.86 118.70 114.32 2dib s GLU 91 Ca 0.42 0.19 -0.21 0.00 -0.41 0.00 0.00 54.97 54.96 2dib s GLU 91 Cb 0.27 -0.19 0.09 0.00 -1.78 0.00 0.00 34.13 32.52 2dib s GLU 91 CO 0.20 -0.14 1.15 -1.59 -0.49 0.00 0.00 175.26 174.40 2dib s LYS 92 N 0.91 3.43 0.03 1.61 -2.85 -1.26 -4.77 119.74 116.84 2dib s LYS 92 Ca -0.07 -1.27 -0.10 0.00 -1.00 0.00 0.00 55.97 53.53 2dib s LYS 92 Cb -0.10 -4.76 0.04 0.00 -2.06 0.00 0.00 37.83 30.94 2dib s LYS 92 CO -0.03 -1.90 0.48 0.41 0.10 0.00 0.00 175.35 174.41 2dib n GLY 93 N 5.72 0.71 3.62 0.59 0.00 -1.26 -4.92 105.19 109.66 2dib n GLY 93 Ca 0.16 -0.96 -0.41 0.00 0.00 0.00 0.00 46.02 44.81 2dib n GLY 93 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2dib s LEU 94 N 0.00 4.08 0.23 0.99 2.96 -1.26 -1.97 118.68 123.72 2dib s LEU 94 Ca 0.11 0.66 0.07 0.00 -0.22 0.00 0.00 54.13 54.75 2dib s LEU 94 Cb -0.01 -2.88 -0.04 0.00 0.50 0.00 0.00 46.19 43.77 2dib s LEU 94 CO 0.01 -0.42 0.15 -1.00 -1.32 0.00 0.00 176.35 173.77 2dib s HIS 95 N 2.57 3.06 -0.40 5.38 3.76 -0.76 -3.54 115.29 125.35 2dib s HIS 95 Ca 0.27 -0.11 -0.05 0.00 -0.15 0.00 0.00 55.06 55.02 2dib s HIS 95 Cb -0.15 -1.40 0.10 0.00 1.11 0.00 0.00 32.58 32.24 2dib s HIS 95 CO 0.09 0.53 0.20 0.08 -0.85 0.00 0.00 174.74 174.80 2dib s VAL 96 N -2.06 3.54 -0.23 -0.90 1.01 -0.12 -2.39 120.40 119.25 2dib s VAL 96 Ca 0.32 -1.80 -0.18 0.00 0.00 0.00 0.00 61.98 60.32 2dib s VAL 96 Cb -0.08 -3.31 -0.03 0.00 0.00 0.00 0.00 36.38 32.96 2dib s VAL 96 CO 0.24 -0.58 0.53 -0.69 0.00 0.00 0.00 175.10 174.60 2dib s VAL 97 N 1.24 5.07 -0.28 2.92 1.01 -1.17 -2.34 120.40 126.86 2dib s VAL 97 Ca 0.05 0.95 -0.09 0.00 0.00 0.00 0.00 61.98 62.89 2dib s VAL 97 Cb -0.23 -3.85 -0.03 0.00 0.00 0.00 0.00 36.38 32.27 2dib s VAL 97 CO -0.02 0.12 0.14 -1.61 0.00 0.00 0.00 175.10 173.72 2dib s GLU 98 N 2.05 3.70 -0.04 2.72 2.02 -0.91 -0.09 118.70 128.15 2dib s GLU 98 Ca 0.23 -0.47 0.00 0.00 0.02 0.00 0.00 54.97 54.76 2dib s GLU 98 Cb -0.16 -3.51 -0.03 0.00 0.10 0.00 0.00 34.13 30.53 2dib s GLU 98 CO 0.09 -0.24 -0.02 0.08 0.02 0.00 0.00 175.26 175.20 2dib s VAL 99 N 1.67 4.10 -0.07 2.63 1.01 -1.26 -3.00 120.40 125.48 2dib s VAL 99 Ca 0.06 -0.47 -0.03 0.00 0.00 0.00 0.00 61.98 61.54 2dib s VAL 99 Cb -0.16 -2.76 0.04 0.00 0.00 0.00 0.00 36.38 33.50 2dib s VAL 99 CO 0.07 0.49 0.15 0.42 0.00 0.00 0.00 175.10 176.23 2dib s THR 100 N -0.96 -0.10 -0.30 3.92 -4.23 -1.15 -3.56 115.64 109.26 2dib s THR 100 Ca 0.16 0.22 -0.01 0.00 -1.18 0.00 0.00 61.69 60.88 2dib s THR 100 Cb -0.11 -0.25 0.05 0.00 1.34 0.00 0.00 72.50 73.53 2dib s THR 100 CO 0.06 0.09 -0.01 -0.47 -0.54 0.00 0.00 174.62 173.75 2dib s TYR 101 N 1.44 3.28 -1.15 3.99 6.14 0.77 -3.50 117.35 128.32 2dib s TYR 101 Ca -0.06 -1.97 -0.02 0.00 0.64 0.00 0.00 57.07 55.66 2dib s TYR 101 Cb -0.12 -2.12 -0.02 0.00 0.42 0.00 0.00 41.96 40.12 2dib s TYR 101 CO -0.06 -0.82 0.97 -0.25 0.64 0.00 0.00 175.55 176.03 2dib n ASP 102 N 4.59 -3.59 -3.19 4.32 9.92 -1.24 -2.37 116.55 124.99 2dib n ASP 102 Ca -0.13 -0.65 -0.23 0.00 -0.53 0.00 0.00 54.79 53.25 2dib n ASP 102 Cb 0.43 -5.14 0.04 0.00 -0.64 0.00 0.00 41.12 35.81 2dib n ASP 102 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 2dib n ASP 103 N -3.16 -5.85 -3.38 -2.24 9.92 -1.26 -4.81 116.55 105.78 2dib n ASP 103 Ca -0.22 -0.36 -0.08 0.00 -0.53 0.00 0.00 54.79 53.60 2dib n ASP 103 Cb 0.65 -4.71 -0.08 0.00 -0.64 0.00 0.00 41.12 36.34 2dib n ASP 103 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 2dib s VAL 104 N -3.18 -0.62 0.43 2.53 1.01 -1.00 -4.99 120.40 114.58 2dib s VAL 104 Ca 0.38 -0.04 -0.24 0.00 0.00 0.00 0.00 61.98 62.08 2dib s VAL 104 Cb -0.17 -0.80 -0.08 0.00 0.00 0.00 0.00 36.38 35.33 2dib s VAL 104 CO 0.47 -0.09 1.18 -2.16 0.00 0.00 0.00 175.10 174.49 2dib s PRO 105 N 2.57 3.88 0.66 2.72 0.04 -1.26 -0.17 135.00 143.43 2dib s PRO 105 Ca 0.11 1.82 -0.11 0.00 0.04 0.00 0.00 61.00 62.86 2dib s PRO 105 Cb -0.15 -2.53 -0.01 0.00 0.04 0.00 0.00 34.50 31.85 2dib s PRO 105 CO -0.16 -0.47 1.05 0.96 0.04 0.00 0.00 177.00 178.43 2dib s ILE 106 N -1.48 4.22 -2.00 0.56 -4.36 -1.23 -4.89 121.20 112.01 2dib s ILE 106 Ca 0.61 0.76 0.08 0.00 -0.26 0.00 0.00 60.65 61.84 2dib s ILE 106 Cb -0.30 -3.54 0.23 0.00 1.25 0.00 0.00 42.46 40.10 2dib s ILE 106 CO 0.37 -0.90 0.93 -0.81 0.24 0.00 0.00 174.94 174.77 2dib n PRO 107 N -2.87 0.49 -0.00 0.37 -0.04 -1.26 -1.90 135.00 129.79 2dib n PRO 107 Ca 0.07 0.00 0.06 0.00 -0.04 0.00 0.00 63.50 63.59 2dib n PRO 107 Cb 0.54 -1.26 -0.09 0.00 -0.04 0.00 0.00 33.50 32.65 2dib n PRO 107 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2dib n ASN 108 N -0.76 1.71 -4.86 3.54 5.03 -1.26 -4.99 115.26 113.66 2dib n ASN 108 Ca 0.06 -0.21 -0.33 0.00 0.87 0.00 0.00 54.58 54.97 2dib n ASN 108 Cb 0.03 1.42 -0.06 0.00 -1.02 0.00 0.00 39.78 40.16 2dib n ASN 108 CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 2dib s SER 109 N -3.11 6.70 0.75 6.41 0.15 -0.80 -3.84 113.70 119.96 2dib s SER 109 Ca -0.02 1.00 -0.11 0.00 0.70 0.00 0.00 55.95 57.51 2dib s SER 109 Cb 0.08 -2.26 0.04 0.00 -1.71 0.00 0.00 66.02 62.18 2dib s SER 109 CO 0.52 -0.02 1.10 -2.16 1.20 0.00 0.00 173.24 173.87 2dib s PRO 110 N -2.54 2.37 0.44 5.44 0.04 -1.26 -4.85 135.00 134.63 2dib s PRO 110 Ca 0.45 1.22 0.04 0.00 0.04 0.00 0.00 61.00 62.75 2dib s PRO 110 Cb -0.12 -1.91 0.01 0.00 0.04 0.00 0.00 34.50 32.52 2dib s PRO 110 CO 0.20 -1.56 0.62 -0.06 0.04 0.00 0.00 177.00 176.24 2dib s PHE 111 N -2.78 2.98 -0.24 0.56 0.08 0.88 -4.93 117.98 114.52 2dib s PHE 111 Ca 0.62 -0.12 -0.02 0.00 0.12 0.00 0.00 56.93 57.53 2dib s PHE 111 Cb -0.18 -2.37 0.08 0.00 -0.57 0.00 0.00 43.02 39.98 2dib s PHE 111 CO 0.53 -0.43 0.06 0.15 -0.10 0.00 0.00 175.22 175.43 2dib s LYS 112 N -4.46 0.68 -0.40 0.44 1.02 -1.26 -3.03 119.74 112.73 2dib s LYS 112 Ca 0.52 -0.69 -0.07 0.00 0.02 0.00 0.00 55.97 55.75 2dib s LYS 112 Cb -0.10 -2.01 0.08 0.00 -0.52 0.00 0.00 37.83 35.28 2dib s LYS 112 CO 0.35 -0.79 0.22 0.08 -0.92 0.00 0.00 175.35 174.29 2dib s VAL 113 N 1.77 3.91 -0.51 3.17 1.01 -1.01 -4.92 120.40 123.82 2dib s VAL 113 Ca 0.03 -1.52 -0.22 0.00 0.00 0.00 0.00 61.98 60.28 2dib s VAL 113 Cb -0.17 -3.43 0.05 0.00 0.00 0.00 0.00 36.38 32.83 2dib s VAL 113 CO -0.16 -0.49 0.76 0.00 0.00 0.00 0.00 175.10 175.21 2dib s ALA 114 N 1.35 3.29 0.37 5.51 0.00 -1.26 -1.83 121.76 129.18 2dib s ALA 114 Ca 0.03 -1.44 -0.23 0.00 0.00 0.00 0.00 51.96 50.32 2dib s ALA 114 Cb -0.23 -3.51 -0.10 0.00 0.00 0.00 0.00 23.12 19.28 2dib s ALA 114 CO 0.01 -2.13 0.93 0.08 0.00 0.00 0.00 175.76 174.65 2dib s VAL 115 N 3.22 4.32 0.03 0.00 1.01 -0.83 -4.76 120.40 123.39 2dib s VAL 115 Ca 0.23 1.62 0.06 0.00 0.00 0.00 0.00 61.98 63.89 2dib s VAL 115 Cb -0.16 -3.80 -0.02 0.00 0.00 0.00 0.00 36.38 32.40 2dib s VAL 115 CO 0.16 -0.08 -0.18 0.28 0.00 0.00 0.00 175.10 175.29 2dib s THR 116 N -1.88 1.42 -0.21 3.92 -1.32 -1.26 -4.11 115.64 112.20 2dib s THR 116 Ca 0.55 -1.00 -0.30 0.00 -1.21 0.00 0.00 61.69 59.73 2dib s THR 116 Cb -0.14 -1.23 -0.07 0.00 -1.51 0.00 0.00 72.50 69.54 2dib s THR 116 CO 0.19 0.21 2.17 -0.62 -2.21 0.00 0.00 174.62 174.35 2dib n GLU 117 N 2.11 1.88 0.00 7.08 -0.58 -1.26 -4.49 120.64 125.38 2dib n GLU 117 Ca -0.17 0.55 0.00 0.00 -0.42 0.00 0.00 57.16 57.13 2dib n GLU 117 Cb 0.54 -3.01 0.00 0.00 -0.57 0.00 0.00 31.44 28.40 2dib n GLU 117 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2dib n GLY 118 N 5.71 0.39 2.91 0.62 0.00 -1.26 -5.00 105.19 108.56 2dib n GLY 118 Ca 0.31 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.11 2dib n GLY 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dib n GLN 120 N -3.69 0.69 -2.05 0.00 6.02 -1.26 -4.81 117.38 112.28 2dib n GLN 120 Ca -0.13 0.26 -0.39 0.00 -0.01 0.00 0.00 57.00 56.73 2dib n GLN 120 Cb 0.62 -1.73 -0.03 0.00 1.02 0.00 0.00 30.24 30.12 2dib n GLN 120 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 2dib s PRO 121 N -1.96 2.70 0.05 -1.09 0.04 -1.26 -4.96 135.00 128.53 2dib s PRO 121 Ca 0.67 0.67 0.02 0.00 0.04 0.00 0.00 61.00 62.40 2dib s PRO 121 Cb -0.51 -4.37 -0.03 0.00 0.04 0.00 0.00 34.50 29.64 2dib s PRO 121 CO 0.55 -2.64 -0.08 0.45 0.04 0.00 0.00 177.00 175.32 2dib s SER 122 N 7.84 0.98 0.01 6.66 0.15 -1.26 -5.16 113.70 122.92 2dib s SER 122 Ca 0.68 -0.61 0.06 0.00 0.70 0.00 0.00 55.95 56.78 2dib s SER 122 Cb -0.13 0.03 -0.02 0.00 -1.71 0.00 0.00 66.02 64.19 2dib s SER 122 CO 0.22 -0.22 -0.19 -0.55 1.20 0.00 0.00 173.24 173.70 2dib s SER 123 N -1.77 2.20 0.00 5.45 0.15 -1.26 -5.13 113.70 113.34 2dib s SER 123 Ca -0.07 -0.41 0.00 0.00 0.70 0.00 0.00 55.95 56.17 2dib s SER 123 Cb -0.08 -0.21 0.00 0.00 -1.71 0.00 0.00 66.02 64.02 2dib s SER 123 CO 0.00 0.18 0.00 0.61 1.20 0.00 0.00 173.24 175.23 2dib n GLY 124 N 2.27 3.21 3.71 9.45 0.00 -1.26 -5.17 105.19 117.40 2dib n GLY 124 Ca -0.16 -0.67 -0.29 0.00 0.00 0.00 0.00 46.02 44.90 2dib n GLY 124 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dib s PRO 125 N 1.37 0.99 -0.26 1.61 0.04 -1.26 -5.08 135.00 132.42 2dib s PRO 125 Ca 0.00 0.72 -0.03 0.00 0.04 0.00 0.00 61.00 61.73 2dib s PRO 125 Cb 0.00 -1.79 0.15 0.00 0.04 0.00 0.00 34.50 32.90 2dib s PRO 125 CO 0.00 -2.40 0.48 -1.12 0.04 0.00 0.00 177.00 174.00 2dib s SER 126 N -3.44 -0.49 -1.21 6.66 0.01 -1.26 -4.92 113.70 109.05 2dib s SER 126 Ca 0.64 0.65 -0.07 0.00 1.31 0.00 0.00 55.95 58.49 2dib s SER 126 Cb -0.18 1.60 0.01 0.00 0.21 0.00 0.00 66.02 67.65 2dib s SER 126 CO 0.57 -0.27 1.05 -0.24 0.41 0.00 0.00 173.24 174.76 2dib n SER 127 N 5.40 -5.32 0.00 2.44 2.88 -1.26 -5.37 113.62 112.39 2dib n SER 127 Ca -0.04 -0.50 0.00 0.00 -1.33 0.00 0.00 58.87 57.00 2dib n SER 127 Cb 0.50 -4.65 0.00 0.00 -0.75 0.00 0.00 64.21 59.32 2dib n SER 127 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42