#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d9f s SER 2 N 0.00 7.15 -0.23 1.61 1.04 -1.26 -4.88 113.70 117.13 2d9f s SER 2 Ca 0.00 1.36 -0.17 0.00 0.48 0.00 0.00 55.95 57.62 2d9f s SER 2 Cb 0.00 -2.40 -0.17 0.00 0.10 0.00 0.00 66.02 63.55 2d9f s SER 2 CO 0.00 0.26 0.01 -0.24 0.98 0.00 0.00 173.24 174.25 2d9f n SER 3 N 1.68 1.91 0.08 7.02 2.88 -1.26 -5.04 113.62 120.89 2d9f n SER 3 Ca -0.09 0.36 0.00 0.00 -1.33 0.00 0.00 58.87 57.81 2d9f n SER 3 Cb 0.50 -0.89 0.00 0.00 -0.75 0.00 0.00 64.21 63.07 2d9f n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2d9f n GLY 4 N 1.43 -1.70 3.71 0.46 0.00 -1.26 -5.12 105.19 102.71 2d9f n GLY 4 Ca -0.40 0.53 -0.36 0.00 0.00 0.00 0.00 46.02 45.79 2d9f n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2d9f s SER 5 N -1.76 6.33 0.00 1.61 1.04 -1.26 -4.95 113.70 114.71 2d9f s SER 5 Ca 0.00 0.38 -0.00 0.00 0.48 0.00 0.00 55.95 56.80 2d9f s SER 5 Cb 0.00 -2.15 -0.00 0.00 0.10 0.00 0.00 66.02 63.97 2d9f s SER 5 CO 0.00 0.10 -0.01 -0.24 0.98 0.00 0.00 173.24 174.07 2d9f n SER 6 N 3.73 0.13 -0.16 7.02 2.88 -1.26 -5.13 113.62 120.84 2d9f n SER 6 Ca -0.13 0.02 0.01 0.00 -1.33 0.00 0.00 58.87 57.44 2d9f n SER 6 Cb 0.52 -0.04 -0.00 0.00 -0.75 0.00 0.00 64.21 63.93 2d9f n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2d9f n GLY 7 N 3.00 -2.82 2.23 0.46 0.00 -1.26 -4.73 105.19 102.06 2d9f n GLY 7 Ca -0.01 -1.33 -0.31 0.00 0.00 0.00 0.00 46.02 44.37 2d9f n GLY 7 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2d9f n GLU 8 N -1.92 3.04 -0.03 1.61 4.71 -1.26 -4.47 120.64 122.32 2d9f n GLU 8 Ca -0.00 -3.63 -0.04 0.00 -0.01 0.00 0.00 57.16 53.47 2d9f n GLU 8 Cb 0.06 -2.29 -0.02 0.00 -1.01 0.00 0.00 31.44 28.18 2d9f n GLU 8 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 2d9f n GLU 9 N -0.83 0.13 -4.25 3.49 1.02 -1.26 -5.09 120.64 113.86 2d9f n GLU 9 Ca 0.56 0.03 -0.14 0.00 -0.02 0.00 0.00 57.16 57.59 2d9f n GLU 9 Cb 0.77 -1.09 -0.10 0.00 -0.02 0.00 0.00 31.44 31.00 2d9f n GLU 9 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 2d9f s TRP 10 N -2.11 1.26 -0.13 -0.32 0.52 -1.26 -4.80 118.94 112.09 2d9f s TRP 10 Ca -0.07 -1.11 0.03 0.00 0.02 0.00 0.00 56.10 54.97 2d9f s TRP 10 Cb 0.02 -0.72 0.01 0.00 -1.15 0.00 0.00 33.47 31.63 2d9f s TRP 10 CO 0.12 -0.30 -0.22 -1.17 0.02 0.00 0.00 176.95 175.40 2d9f s LEU 11 N -3.20 2.11 -0.69 2.99 0.20 -0.31 -4.86 118.68 114.92 2d9f s LEU 11 Ca 0.28 -0.59 -0.27 0.00 0.69 0.00 0.00 54.13 54.24 2d9f s LEU 11 Cb 0.07 -1.44 0.03 0.00 -0.43 0.00 0.00 46.19 44.42 2d9f s LEU 11 CO 0.07 0.10 1.23 1.51 -0.29 0.00 0.00 176.35 178.96 2d9f s ASP 12 N 0.72 6.23 0.13 3.68 1.47 -1.26 -0.78 116.67 126.86 2d9f s ASP 12 Ca -0.09 -0.36 -0.14 0.00 1.18 0.00 0.00 52.55 53.13 2d9f s ASP 12 Cb -0.16 -2.55 -0.00 0.00 -0.34 0.00 0.00 42.92 39.87 2d9f s ASP 12 CO 0.00 -1.72 1.61 0.40 0.68 0.00 0.00 175.17 176.14 2d9f h ILE 13 N 6.05 1.25 0.00 2.11 2.04 -1.78 -3.20 117.51 123.99 2d9f h ILE 13 Ca -0.27 -0.93 -0.21 0.00 1.00 0.00 0.00 64.86 64.45 2d9f h ILE 13 Cb 1.05 1.01 -0.04 0.00 -0.74 0.00 0.00 36.82 38.11 2d9f h ILE 13 CO 1.25 0.32 -1.64 0.18 0.00 0.00 0.00 178.15 178.26 2d9f n LEU 14 N -4.46 0.69 0.00 1.44 4.77 -1.25 -4.99 117.00 113.20 2d9f n LEU 14 Ca -0.00 0.31 0.00 0.00 -0.03 0.00 0.00 56.01 56.29 2d9f n LEU 14 Cb 0.26 0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.49 2d9f n LEU 14 CO 0.40 0.23 0.00 0.61 -1.33 0.00 0.00 177.39 177.30 2d9f n GLY 15 N 1.46 2.80 0.25 -0.72 0.00 -1.21 -4.80 105.19 102.97 2d9f n GLY 15 Ca -0.14 -0.34 -0.04 0.00 0.00 0.00 0.00 46.02 45.50 2d9f n GLY 15 CO 0.00 0.00 0.00 3.45 0.00 0.00 0.00 173.32 176.77 2d9f h ASN 16 N 0.29 0.63 0.00 1.61 7.08 -1.91 -3.47 115.58 119.81 2d9f h ASN 16 Ca 0.00 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.22 2d9f h ASN 16 Cb 0.00 -0.13 0.00 0.00 -2.08 0.00 0.00 38.32 36.11 2d9f h ASN 16 CO 0.00 0.44 0.00 0.61 -2.08 0.00 0.00 177.43 176.40 2d9f n GLY 17 N -1.27 1.52 0.13 9.14 0.00 -1.26 -5.03 105.19 108.43 2d9f n GLY 17 Ca 0.06 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.03 2d9f n GLY 17 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2d9f h LEU 18 N 0.00 -0.28 -8.81 0.99 -0.00 -1.90 -3.41 115.31 101.90 2d9f h LEU 18 Ca 0.00 0.01 -0.59 0.00 -0.00 0.00 0.00 57.88 57.30 2d9f h LEU 18 Cb 0.00 0.07 -0.09 0.00 -0.00 0.00 0.00 40.66 40.64 2d9f h LEU 18 CO 0.00 -0.13 0.63 -0.22 -0.00 0.00 0.00 178.44 178.72 2d9f s LEU 19 N -6.02 3.97 0.44 1.67 2.96 -1.26 -3.71 118.68 116.73 2d9f s LEU 19 Ca -0.05 0.53 0.05 0.00 -0.22 0.00 0.00 54.13 54.44 2d9f s LEU 19 Cb 0.00 -3.29 -0.06 0.00 0.50 0.00 0.00 46.19 43.35 2d9f s LEU 19 CO 0.14 -0.91 0.01 -0.13 -1.32 0.00 0.00 176.35 174.14 2d9f s ARG 20 N 3.59 2.03 -0.05 1.98 0.52 -1.07 -2.21 118.95 123.74 2d9f s ARG 20 Ca 0.39 -2.21 -0.03 0.00 -0.52 0.00 0.00 55.73 53.36 2d9f s ARG 20 Cb -0.11 -1.56 0.03 0.00 0.52 0.00 0.00 34.95 33.82 2d9f s ARG 20 CO 0.20 -0.17 0.12 0.21 0.02 0.00 0.00 175.30 175.69 2d9f s LYS 21 N -3.77 0.10 -0.23 3.54 2.20 0.04 -3.05 119.74 118.57 2d9f s LYS 21 Ca 0.25 0.27 -0.02 0.00 -0.36 0.00 0.00 55.97 56.11 2d9f s LYS 21 Cb 0.07 -0.08 0.07 0.00 -1.51 0.00 0.00 37.83 36.38 2d9f s LYS 21 CO 0.13 -0.10 0.04 0.21 -0.36 0.00 0.00 175.35 175.26 2d9f s LYS 22 N 0.69 0.83 -0.41 4.03 2.20 -0.12 -1.16 119.74 125.79 2d9f s LYS 22 Ca -0.05 -0.67 -0.27 0.00 -0.36 0.00 0.00 55.97 54.61 2d9f s LYS 22 Cb -0.07 -2.15 -0.04 0.00 -1.51 0.00 0.00 37.83 34.06 2d9f s LYS 22 CO -0.03 -0.72 2.07 0.99 -0.36 0.00 0.00 175.35 177.30 2d9f s THR 23 N 1.73 3.22 0.02 3.43 2.01 -1.26 -0.31 115.64 124.47 2d9f s THR 23 Ca 0.01 0.19 -0.20 0.00 0.31 0.00 0.00 61.69 62.00 2d9f s THR 23 Cb -0.17 -3.40 -0.19 0.00 0.01 0.00 0.00 72.50 68.74 2d9f s THR 23 CO -0.12 -0.33 1.19 -0.07 -0.69 0.00 0.00 174.62 174.60 2d9f h LEU 24 N 16.19 0.49 -6.90 4.42 3.38 0.08 -3.45 115.31 129.53 2d9f h LEU 24 Ca -0.31 -0.66 -0.22 0.00 0.09 0.00 0.00 57.88 56.78 2d9f h LEU 24 Cb 1.21 -0.15 -0.32 0.00 0.09 0.00 0.00 40.66 41.49 2d9f h LEU 24 CO 1.09 1.07 -0.53 -0.69 0.09 0.00 0.00 178.44 179.47 2d9f s VAL 25 N -3.60 -0.46 0.48 1.22 1.01 0.49 -4.97 120.40 114.57 2d9f s VAL 25 Ca -0.14 0.07 -0.22 0.00 0.00 0.00 0.00 61.98 61.70 2d9f s VAL 25 Cb 0.04 -0.62 -0.07 0.00 0.00 0.00 0.00 36.38 35.73 2d9f s VAL 25 CO 0.80 -0.04 1.16 -2.16 0.00 0.00 0.00 175.10 174.86 2d9f s PRO 26 N 2.44 3.67 0.79 2.72 0.04 -1.26 0.42 135.00 143.82 2d9f s PRO 26 Ca 0.05 1.74 -0.05 0.00 0.04 0.00 0.00 61.00 62.78 2d9f s PRO 26 Cb -0.14 -2.32 0.17 0.00 0.04 0.00 0.00 34.50 32.25 2d9f s PRO 26 CO -0.12 -0.62 1.09 0.41 0.04 0.00 0.00 177.00 177.80 2d9f n GLY 27 N 0.38 0.02 3.69 0.56 0.00 -1.25 -4.83 105.19 103.75 2d9f n GLY 27 Ca 0.08 -1.94 -0.29 0.00 0.00 0.00 0.00 46.02 43.88 2d9f n GLY 27 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2d9f s PRO 28 N -5.32 0.61 0.53 1.61 0.04 -1.26 -4.94 135.00 126.27 2d9f s PRO 28 Ca 0.68 0.59 0.32 0.00 0.04 0.00 0.00 61.00 62.63 2d9f s PRO 28 Cb -0.03 -1.75 1.32 0.00 0.04 0.00 0.00 34.50 34.08 2d9f s PRO 28 CO 0.46 -2.63 1.97 -1.00 0.04 0.00 0.00 177.00 175.85 2d9f h PRO 29 N -1.82 0.00 -0.03 0.56 0.13 -2.00 -3.15 132.00 125.69 2d9f h PRO 29 Ca -0.53 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.47 2d9f h PRO 29 Cb 1.32 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.46 2d9f h PRO 29 CO 0.57 0.05 -0.48 0.78 -0.23 0.00 0.00 178.00 178.70 2d9f h GLY 30 N 1.90 0.41 -1.77 1.56 0.00 -1.99 -3.46 103.07 99.72 2d9f h GLY 30 Ca -0.00 -0.67 -0.49 0.00 0.00 0.00 0.00 47.33 46.17 2d9f h GLY 30 CO 0.01 0.59 -1.05 -1.14 0.00 0.00 0.00 176.54 174.95 2d9f n SER 31 N -4.31 -2.52 -3.64 0.19 3.41 -1.19 -5.04 113.62 100.52 2d9f n SER 31 Ca -0.10 0.07 -0.08 0.00 -0.26 0.00 0.00 58.87 58.51 2d9f n SER 31 Cb 0.60 -1.01 -0.07 0.00 -0.26 0.00 0.00 64.21 63.47 2d9f n SER 31 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2d9f s SER 32 N -1.80 -0.67 0.18 4.04 1.04 -1.26 -4.88 113.70 110.34 2d9f s SER 32 Ca 0.54 1.16 -0.25 0.00 0.48 0.00 0.00 55.95 57.88 2d9f s SER 32 Cb -0.14 1.23 -0.15 0.00 0.10 0.00 0.00 66.02 67.06 2d9f s SER 32 CO 0.68 -0.19 0.47 0.54 0.98 0.00 0.00 173.24 175.72 2d9f n ARG 33 N 3.27 0.00 -0.02 4.02 1.74 -1.26 -3.72 116.66 120.69 2d9f n ARG 33 Ca -0.16 0.00 -0.01 0.00 -0.77 0.00 0.00 57.85 56.91 2d9f n ARG 33 Cb 0.57 -0.90 0.01 0.00 -1.02 0.00 0.00 32.46 31.12 2d9f n ARG 33 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 2d9f n PRO 34 N 0.90 -1.07 -4.37 5.56 -0.04 -1.26 -4.88 135.00 129.83 2d9f n PRO 34 Ca 0.16 -0.04 -0.26 0.00 -0.04 0.00 0.00 63.50 63.33 2d9f n PRO 34 Cb 0.22 -0.03 -0.12 0.00 -0.04 0.00 0.00 33.50 33.53 2d9f n PRO 34 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2d9f s VAL 35 N -1.04 2.11 -0.05 0.52 0.11 -1.26 -4.99 120.40 115.80 2d9f s VAL 35 Ca 0.01 -1.85 -0.30 0.00 -2.93 0.00 0.00 61.98 56.91 2d9f s VAL 35 Cb -0.00 -1.94 -0.02 0.00 -1.53 0.00 0.00 36.38 32.89 2d9f s VAL 35 CO 0.01 -0.09 1.03 -0.75 -3.33 0.00 0.00 175.10 171.97 2d9f s LYS 36 N -2.40 4.47 0.00 1.54 2.20 -1.26 -3.60 119.74 120.69 2d9f s LYS 36 Ca 0.15 1.45 0.00 0.00 -0.36 0.00 0.00 55.97 57.22 2d9f s LYS 36 Cb -0.08 -3.50 0.00 0.00 -1.51 0.00 0.00 37.83 32.74 2d9f s LYS 36 CO 0.07 -0.22 0.00 0.41 -0.36 0.00 0.00 175.35 175.25 2d9f n GLY 37 N 3.05 1.23 3.68 5.54 0.00 0.27 -4.93 105.19 114.03 2d9f n GLY 37 Ca 0.08 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.80 2d9f n GLY 37 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2d9f s GLN 38 N -0.51 2.06 -0.39 1.61 -0.21 -1.24 -4.86 119.66 116.13 2d9f s GLN 38 Ca 0.00 -2.21 -0.25 0.00 0.02 0.00 0.00 55.36 52.92 2d9f s GLN 38 Cb 0.00 -1.61 0.02 0.00 1.00 0.00 0.00 33.01 32.41 2d9f s GLN 38 CO 0.00 -0.17 0.86 0.08 -2.12 0.00 0.00 175.29 173.94 2d9f s VAL 39 N -2.77 4.63 -0.17 1.09 1.01 0.18 -2.41 120.40 121.95 2d9f s VAL 39 Ca 0.24 0.96 -0.02 0.00 0.00 0.00 0.00 61.98 63.15 2d9f s VAL 39 Cb 0.07 -4.30 -0.01 0.00 0.00 0.00 0.00 36.38 32.13 2d9f s VAL 39 CO 0.13 -0.56 -0.08 0.68 0.00 0.00 0.00 175.10 175.27 2d9f s VAL 40 N 3.37 3.34 -0.19 2.92 -7.23 -0.85 -0.91 120.40 120.84 2d9f s VAL 40 Ca 0.35 -0.54 -0.03 0.00 -1.81 0.00 0.00 61.98 59.95 2d9f s VAL 40 Cb -0.12 -2.46 -0.01 0.00 0.56 0.00 0.00 36.38 34.35 2d9f s VAL 40 CO 0.19 0.48 -0.06 -0.89 -0.31 0.00 0.00 175.10 174.51 2d9f s THR 41 N 0.80 3.33 0.31 5.32 2.01 -0.95 -2.74 115.64 123.73 2d9f s THR 41 Ca -0.03 -0.52 0.07 0.00 0.31 0.00 0.00 61.69 61.52 2d9f s THR 41 Cb -0.15 -2.48 -0.03 0.00 0.01 0.00 0.00 72.50 69.85 2d9f s THR 41 CO 0.01 0.45 0.27 1.33 -0.69 0.00 0.00 174.62 176.00 2d9f n VAL 42 N 4.39 0.00 -3.92 3.82 0.24 -0.20 -1.68 118.33 120.99 2d9f n VAL 42 Ca -0.18 -2.28 -0.33 0.00 -2.04 0.00 0.00 64.34 59.51 2d9f n VAL 42 Cb 0.51 1.14 -0.14 0.00 -1.47 0.00 0.00 33.84 33.89 2d9f n VAL 42 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 2d9f s HIS 43 N -3.27 3.69 -0.17 6.34 2.46 -1.18 -1.26 115.29 121.91 2d9f s HIS 43 Ca 0.37 -2.76 -0.08 0.00 0.47 0.00 0.00 55.06 53.06 2d9f s HIS 43 Cb 0.02 -3.06 -0.05 0.00 -0.13 0.00 0.00 32.58 29.37 2d9f s HIS 43 CO 0.26 -0.96 0.12 -1.17 -2.47 0.00 0.00 174.74 170.52 2d9f s LEU 44 N 0.98 4.17 -0.20 8.88 1.98 -1.15 -4.05 118.68 129.28 2d9f s LEU 44 Ca 0.10 0.27 -0.03 0.00 -2.89 0.00 0.00 54.13 51.58 2d9f s LEU 44 Cb -0.21 -2.05 0.06 0.00 0.66 0.00 0.00 46.19 44.65 2d9f s LEU 44 CO -0.06 0.25 0.04 -1.10 -1.89 0.00 0.00 176.35 173.58 2d9f s GLN 45 N -0.07 0.66 -0.04 1.98 -0.21 -1.26 -2.67 119.66 118.05 2d9f s GLN 45 Ca 0.09 -0.44 -0.24 0.00 0.02 0.00 0.00 55.36 54.79 2d9f s GLN 45 Cb -0.12 -2.12 -0.04 0.00 1.00 0.00 0.00 33.01 31.74 2d9f s GLN 45 CO 0.00 -0.65 0.72 0.99 -2.12 0.00 0.00 175.29 174.24 2d9f s THR 46 N 1.85 4.99 -0.11 -0.19 2.01 -0.14 -3.92 115.64 120.13 2d9f s THR 46 Ca -0.01 1.50 -0.07 0.00 0.31 0.00 0.00 61.69 63.43 2d9f s THR 46 Cb -0.17 -4.07 0.04 0.00 0.01 0.00 0.00 72.50 68.32 2d9f s THR 46 CO -0.08 0.27 0.26 -0.44 -0.69 0.00 0.00 174.62 173.94 2d9f s SER 47 N 0.66 -0.29 0.69 3.53 0.01 -0.97 -0.09 113.70 117.23 2d9f s SER 47 Ca 0.38 0.56 -0.17 0.00 1.31 0.00 0.00 55.95 58.04 2d9f s SER 47 Cb -0.18 0.48 -0.04 0.00 0.21 0.00 0.00 66.02 66.48 2d9f s SER 47 CO 0.19 -0.15 0.65 0.18 0.41 0.00 0.00 173.24 174.53 2d9f n LEU 48 N 3.86 1.62 0.16 2.44 7.99 -0.14 -0.82 117.00 132.12 2d9f n LEU 48 Ca -0.22 0.65 0.09 0.00 -0.01 0.00 0.00 56.01 56.52 2d9f n LEU 48 Cb 0.55 -1.26 0.48 0.00 -0.11 0.00 0.00 43.42 43.07 2d9f n LEU 48 CO 0.15 -2.78 0.81 1.21 -1.51 0.00 0.00 177.39 175.27 2d9f n GLU 49 N -0.87 0.12 0.00 3.23 4.07 -1.24 -0.78 120.64 125.17 2d9f n GLU 49 Ca 0.11 0.60 -0.18 0.00 -0.06 0.00 0.00 57.16 57.63 2d9f n GLU 49 Cb 0.49 -2.01 -0.14 0.00 -0.06 0.00 0.00 31.44 29.73 2d9f n GLU 49 CO 0.00 0.00 0.00 0.27 -0.06 0.00 0.00 177.13 177.34 2d9f n ASN 50 N -2.15 1.84 0.00 4.31 0.23 -1.26 -4.99 115.26 113.24 2d9f n ASN 50 Ca -0.01 0.27 0.00 0.00 -0.53 0.00 0.00 54.58 54.31 2d9f n ASN 50 Cb 0.15 -0.69 0.00 0.00 -2.08 0.00 0.00 39.78 37.16 2d9f n ASN 50 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2d9f n GLY 51 N 1.89 0.46 2.97 4.83 0.00 0.04 -5.13 105.19 110.25 2d9f n GLY 51 Ca -0.28 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.43 2d9f n GLY 51 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2d9f s THR 52 N -0.58 1.97 0.11 2.61 2.01 -1.25 -4.87 115.64 115.65 2d9f s THR 52 Ca 0.00 -2.00 -0.31 0.00 0.31 0.00 0.00 61.69 59.69 2d9f s THR 52 Cb 0.00 -2.39 -0.11 0.00 0.01 0.00 0.00 72.50 70.01 2d9f s THR 52 CO 0.00 -0.49 1.86 0.54 -0.69 0.00 0.00 174.62 175.83 2d9f n ARG 53 N 4.41 2.81 -0.07 4.92 1.74 -1.26 -0.96 116.66 128.24 2d9f n ARG 53 Ca -0.01 1.02 -0.09 0.00 -0.77 0.00 0.00 57.85 58.01 2d9f n ARG 53 Cb 0.42 -2.92 -0.09 0.00 -1.02 0.00 0.00 32.46 28.85 2d9f n ARG 53 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2d9f n VAL 54 N 4.81 0.92 -3.77 1.55 0.31 0.87 -4.94 118.33 118.07 2d9f n VAL 54 Ca 0.18 -0.47 -0.23 0.00 -0.01 0.00 0.00 64.34 63.82 2d9f n VAL 54 Cb 0.38 -0.84 -0.18 0.00 -0.91 0.00 0.00 33.84 32.29 2d9f n VAL 54 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 2d9f s GLN 55 N -2.32 0.56 -0.35 5.55 -1.52 -1.12 -4.82 119.66 115.64 2d9f s GLN 55 Ca -0.13 0.12 0.02 0.00 -1.95 0.00 0.00 55.36 53.42 2d9f s GLN 55 Cb 0.05 -0.94 0.10 0.00 -0.22 0.00 0.00 33.01 32.00 2d9f s GLN 55 CO 0.47 -0.30 0.08 -2.00 -0.25 0.00 0.00 175.29 173.28 2d9f s GLU 56 N 1.98 1.69 -0.31 2.91 2.12 -1.26 -0.96 118.70 124.86 2d9f s GLU 56 Ca 0.05 -1.81 0.03 0.00 0.36 0.00 0.00 54.97 53.60 2d9f s GLU 56 Cb -0.12 -3.29 0.09 0.00 0.26 0.00 0.00 34.13 31.07 2d9f s GLU 56 CO -0.05 -0.94 0.02 -2.00 -0.54 0.00 0.00 175.26 171.75 2d9f s GLU 57 N 0.99 1.52 0.19 4.30 2.56 -1.09 -4.98 118.70 122.19 2d9f s GLU 57 Ca 0.08 -1.60 -0.05 0.00 0.00 0.00 0.00 54.97 53.41 2d9f s GLU 57 Cb -0.20 -2.93 0.12 0.00 2.00 0.00 0.00 34.13 33.12 2d9f s GLU 57 CO -0.07 -0.85 1.55 -1.00 -0.56 0.00 0.00 175.26 174.33 2d9f h PRO 58 N 7.73 0.68 -3.12 4.30 0.13 -1.89 -3.05 132.00 136.78 2d9f h PRO 58 Ca -0.09 -0.36 -0.62 0.00 -0.87 0.00 0.00 66.00 64.06 2d9f h PRO 58 Cb 1.03 0.01 -0.41 0.00 0.13 0.00 0.00 31.00 31.76 2d9f h PRO 58 CO 0.49 0.97 -0.62 -2.00 -0.23 0.00 0.00 178.00 176.62 2d9f s GLU 59 N -4.26 2.20 -0.23 0.86 2.12 -1.26 -4.37 118.70 113.75 2d9f s GLU 59 Ca -0.09 -3.03 -0.15 0.00 0.36 0.00 0.00 54.97 52.07 2d9f s GLU 59 Cb 0.12 -3.24 -0.04 0.00 0.26 0.00 0.00 34.13 31.23 2d9f s GLU 59 CO 0.84 -1.24 0.35 -1.17 -0.54 0.00 0.00 175.26 173.50 2d9f s LEU 60 N -0.99 4.11 0.09 2.70 1.98 -0.39 -4.97 118.68 121.22 2d9f s LEU 60 Ca 0.23 0.37 0.09 0.00 -2.89 0.00 0.00 54.13 51.93 2d9f s LEU 60 Cb -0.11 -2.41 -0.03 0.00 0.66 0.00 0.00 46.19 44.30 2d9f s LEU 60 CO -0.12 -0.08 -0.23 0.54 -1.89 0.00 0.00 176.35 174.57 2d9f s VAL 61 N 1.50 1.87 0.14 1.68 0.11 -1.26 -1.04 120.40 123.41 2d9f s VAL 61 Ca 0.16 -1.50 -0.25 0.00 -2.93 0.00 0.00 61.98 57.46 2d9f s VAL 61 Cb -0.15 -1.66 0.07 0.00 -1.53 0.00 0.00 36.38 33.11 2d9f s VAL 61 CO 0.08 0.08 0.99 0.72 -3.33 0.00 0.00 175.10 173.64 2d9f s PHE 62 N -1.02 -0.11 -0.45 1.54 -0.12 -1.11 -5.01 117.98 111.71 2d9f s PHE 62 Ca 0.09 -0.19 -0.12 0.00 -0.05 0.00 0.00 56.93 56.66 2d9f s PHE 62 Cb -0.10 0.64 0.08 0.00 -0.63 0.00 0.00 43.02 43.01 2d9f s PHE 62 CO 0.04 -0.79 0.33 0.99 -0.05 0.00 0.00 175.22 175.74 2d9f s THR 63 N -3.13 4.69 0.14 -4.49 2.01 -1.26 -2.00 115.64 111.60 2d9f s THR 63 Ca 0.13 -1.27 -0.35 0.00 0.31 0.00 0.00 61.69 60.51 2d9f s THR 63 Cb -0.01 -3.85 -0.15 0.00 0.01 0.00 0.00 72.50 68.50 2d9f s THR 63 CO 0.02 -0.56 1.42 -0.11 -0.69 0.00 0.00 174.62 174.70 2d9f n LEU 64 N 5.05 2.33 0.00 4.42 7.94 -1.01 -2.41 117.00 133.32 2d9f n LEU 64 Ca -0.11 1.11 0.00 0.00 -1.11 0.00 0.00 56.01 55.90 2d9f n LEU 64 Cb 0.43 -1.31 0.00 0.00 0.53 0.00 0.00 43.42 43.07 2d9f n LEU 64 CO 0.43 -0.72 0.00 0.61 -1.11 0.00 0.00 177.39 176.60 2d9f n GLY 65 N 2.79 3.15 0.07 -3.96 0.00 -1.26 0.96 105.19 106.95 2d9f n GLY 65 Ca 0.17 -1.06 0.15 0.00 0.00 0.00 0.00 46.02 45.27 2d9f n GLY 65 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2d9f n ASP 66 N 0.23 0.29 -3.08 1.61 2.03 -1.01 -4.90 116.55 111.71 2d9f n ASP 66 Ca 0.00 -0.49 -0.19 0.00 0.52 0.00 0.00 54.79 54.62 2d9f n ASP 66 Cb 0.00 -0.13 -0.00 0.00 -0.72 0.00 0.00 41.12 40.26 2d9f n ASP 66 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2d9f h ASP 68 N -0.68 0.00 -5.28 0.00 1.82 -1.91 -3.42 116.42 106.95 2d9f h ASP 68 Ca -0.38 0.00 -0.39 0.00 -0.39 0.00 0.00 57.03 55.88 2d9f h ASP 68 Cb 1.26 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 41.25 2d9f h ASP 68 CO 0.46 0.00 -0.16 1.33 -1.61 0.00 0.00 179.24 179.26 2d9f n VAL 69 N -2.64 0.00 -1.48 2.25 0.24 -1.26 -5.08 118.33 110.36 2d9f n VAL 69 Ca -0.02 -1.48 -0.37 0.00 -2.04 0.00 0.00 64.34 60.43 2d9f n VAL 69 Cb 0.15 -0.28 0.05 0.00 -1.47 0.00 0.00 33.84 32.29 2d9f n VAL 69 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 2d9f n ILE 70 N -1.50 2.81 0.44 1.34 2.08 -1.26 -4.74 119.36 118.53 2d9f n ILE 70 Ca 0.01 -0.48 0.12 0.00 0.56 0.00 0.00 62.75 62.97 2d9f n ILE 70 Cb 0.43 -0.89 0.48 0.00 -0.75 0.00 0.00 39.64 38.90 2d9f n ILE 70 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2d9f n GLN 71 N -0.68 0.22 0.04 0.38 6.02 -1.11 -1.56 117.38 120.69 2d9f n GLN 71 Ca 0.12 0.38 0.12 0.00 -0.01 0.00 0.00 57.00 57.61 2d9f n GLN 71 Cb 0.48 -1.87 0.13 0.00 1.02 0.00 0.00 30.24 29.99 2d9f n GLN 71 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2d9f n ALA 72 N -1.79 3.15 -0.13 -1.58 0.00 -1.26 -3.10 120.51 115.80 2d9f n ALA 72 Ca 0.03 -0.31 -0.21 0.00 0.00 0.00 0.00 53.44 52.95 2d9f n ALA 72 Cb 0.28 -1.09 -0.11 0.00 0.00 0.00 0.00 19.45 18.52 2d9f n ALA 72 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2d9f n LEU 73 N -2.00 2.72 0.15 0.00 7.94 -0.95 -3.93 117.00 120.92 2d9f n LEU 73 Ca 0.03 -0.02 -0.00 0.00 -1.11 0.00 0.00 56.01 54.91 2d9f n LEU 73 Cb 0.43 -0.87 0.22 0.00 0.53 0.00 0.00 43.42 43.73 2d9f n LEU 73 CO 0.38 0.84 0.56 -0.78 -1.11 0.00 0.00 177.39 177.27 2d9f h ASP 74 N -0.24 0.00 0.11 1.96 3.58 -1.46 0.30 116.42 120.66 2d9f h ASP 74 Ca -0.60 0.00 0.00 0.00 0.42 0.00 0.00 57.03 56.85 2d9f h ASP 74 Cb 1.81 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.86 2d9f h ASP 74 CO -0.17 0.55 -0.05 0.18 -2.88 0.00 0.00 179.24 176.87 2d9f n LEU 75 N -3.87 0.82 -0.01 2.28 4.32 -1.18 -3.79 117.00 115.57 2d9f n LEU 75 Ca -0.01 -0.22 -0.00 0.00 -0.02 0.00 0.00 56.01 55.75 2d9f n LEU 75 Cb 0.56 -0.06 -0.02 0.00 -1.62 0.00 0.00 43.42 42.28 2d9f n LEU 75 CO 0.41 0.14 -0.58 -1.54 -1.22 0.00 0.00 177.39 174.61 2d9f n SER 76 N -0.48 4.29 0.16 -1.43 3.41 -0.98 -4.62 113.62 113.97 2d9f n SER 76 Ca 0.18 0.00 -0.15 0.00 -0.26 0.00 0.00 58.87 58.64 2d9f n SER 76 Cb 0.27 0.75 -0.08 0.00 -0.26 0.00 0.00 64.21 64.90 2d9f n SER 76 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 2d9f h VAL 77 N 0.00 0.16 0.00 -3.33 2.07 -0.51 -0.44 116.25 114.20 2d9f h VAL 77 Ca -0.05 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.47 2d9f h VAL 77 Cb 0.85 0.16 0.00 0.00 -1.52 0.00 0.00 31.29 30.78 2d9f h VAL 77 CO 0.00 0.00 0.00 -0.81 0.02 0.00 0.00 177.57 176.78 2d9f n PRO 78 N -5.48 0.49 -0.21 1.57 -0.04 -1.26 -1.94 135.00 128.13 2d9f n PRO 78 Ca -0.08 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.46 2d9f n PRO 78 Cb 0.39 -1.34 0.20 0.00 -0.04 0.00 0.00 33.50 32.71 2d9f n PRO 78 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2d9f n LEU 79 N -0.84 3.22 -3.99 1.53 4.77 -0.18 -4.87 117.00 116.64 2d9f n LEU 79 Ca 0.08 -1.78 -0.12 0.00 -0.03 0.00 0.00 56.01 54.16 2d9f n LEU 79 Cb 0.04 -0.28 -0.12 0.00 -2.33 0.00 0.00 43.42 40.72 2d9f n LEU 79 CO 0.06 0.77 -0.38 0.00 -1.33 0.00 0.00 177.39 176.50 2d9f s MET 80 N -1.10 0.36 0.47 3.23 0.23 -0.82 -5.07 119.30 116.61 2d9f s MET 80 Ca 0.33 -0.49 -0.17 0.00 -1.03 0.00 0.00 55.69 54.32 2d9f s MET 80 Cb 0.18 -0.15 -0.09 0.00 -1.53 0.00 0.00 34.83 33.24 2d9f s MET 80 CO 0.24 0.02 0.95 -0.51 -2.03 0.00 0.00 175.02 173.69 2d9f s ASP 81 N -1.04 6.71 -0.29 -1.18 1.01 -1.26 -4.31 116.67 116.31 2d9f s ASP 81 Ca -0.08 1.56 -0.28 0.00 0.71 0.00 0.00 52.55 54.46 2d9f s ASP 81 Cb -0.07 -2.50 -0.05 0.00 1.01 0.00 0.00 42.92 41.31 2d9f s ASP 81 CO -0.00 -0.49 2.19 0.54 0.21 0.00 0.00 175.17 177.61 2d9f s VAL 82 N -2.45 3.08 0.00 -1.27 0.11 -1.24 -1.59 120.40 117.04 2d9f s VAL 82 Ca 0.59 0.08 0.00 0.00 -2.93 0.00 0.00 61.98 59.72 2d9f s VAL 82 Cb -0.10 -3.12 0.00 0.00 -1.53 0.00 0.00 36.38 31.63 2d9f s VAL 82 CO 0.25 -0.09 0.00 0.61 -3.33 0.00 0.00 175.10 172.54 2d9f n GLY 83 N 5.76 1.37 3.29 6.54 0.00 -0.42 -4.54 105.19 117.19 2d9f n GLY 83 Ca 0.30 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.99 2d9f n GLY 83 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2d9f s GLU 84 N -0.30 3.25 -0.25 1.61 2.12 -0.62 -3.93 118.70 120.57 2d9f s GLU 84 Ca 0.00 -0.74 -0.24 0.00 0.36 0.00 0.00 54.97 54.35 2d9f s GLU 84 Cb 0.00 -2.62 -0.01 0.00 0.26 0.00 0.00 34.13 31.76 2d9f s GLU 84 CO 0.00 0.06 0.79 0.99 -0.54 0.00 0.00 175.26 176.56 2d9f s THR 85 N 0.72 4.85 0.03 -1.70 2.01 0.17 -3.82 115.64 117.89 2d9f s THR 85 Ca -0.07 1.44 0.03 0.00 0.31 0.00 0.00 61.69 63.41 2d9f s THR 85 Cb -0.16 -4.09 -0.02 0.00 0.01 0.00 0.00 72.50 68.25 2d9f s THR 85 CO 0.01 -0.08 -0.10 0.00 -0.69 0.00 0.00 174.62 173.77 2d9f s ALA 86 N 2.80 0.79 0.26 7.40 0.00 -0.14 0.82 121.76 133.70 2d9f s ALA 86 Ca 0.33 -0.63 0.07 0.00 0.00 0.00 0.00 51.96 51.73 2d9f s ALA 86 Cb -0.15 -0.10 -0.03 0.00 0.00 0.00 0.00 23.12 22.83 2d9f s ALA 86 CO 0.08 0.12 0.23 1.41 0.00 0.00 0.00 175.76 177.60 2d9f s MET 87 N -0.93 2.94 -0.07 0.00 -2.45 0.57 -0.09 119.30 119.27 2d9f s MET 87 Ca -0.01 -1.06 -0.03 0.00 -1.25 0.00 0.00 55.69 53.33 2d9f s MET 87 Cb -0.07 -2.58 0.04 0.00 1.25 0.00 0.00 34.83 33.47 2d9f s MET 87 CO 0.00 0.36 0.16 0.14 1.05 0.00 0.00 175.02 176.73 2d9f s VAL 88 N -2.15 -0.04 -0.29 10.11 -7.23 0.05 -0.95 120.40 119.90 2d9f s VAL 88 Ca 0.34 0.16 0.01 0.00 -1.81 0.00 0.00 61.98 60.69 2d9f s VAL 88 Cb -0.08 -0.27 0.08 0.00 0.56 0.00 0.00 36.38 36.68 2d9f s VAL 88 CO 0.26 0.07 0.02 0.42 -0.31 0.00 0.00 175.10 175.55 2d9f s THR 89 N 1.12 1.61 0.35 5.32 -4.23 -1.17 -2.33 115.64 116.32 2d9f s THR 89 Ca -0.09 -1.65 0.07 0.00 -1.18 0.00 0.00 61.69 58.84 2d9f s THR 89 Cb -0.11 -2.07 -0.07 0.00 1.34 0.00 0.00 72.50 71.60 2d9f s THR 89 CO -0.06 -0.42 -0.02 0.00 -0.54 0.00 0.00 174.62 173.58 2d9f s ALA 90 N 1.29 2.82 0.47 3.99 0.00 -1.24 -2.61 121.76 126.46 2d9f s ALA 90 Ca 0.04 -2.14 -0.21 0.00 0.00 0.00 0.00 51.96 49.66 2d9f s ALA 90 Cb -0.18 0.21 -0.09 0.00 0.00 0.00 0.00 23.12 23.05 2d9f s ALA 90 CO -0.12 -0.10 1.01 0.34 0.00 0.00 0.00 175.76 176.90 2d9f s ASP 91 N -3.59 6.53 0.55 0.00 2.15 -1.26 -3.62 116.67 117.43 2d9f s ASP 91 Ca 0.34 1.86 0.47 0.00 0.43 0.00 0.00 52.55 55.65 2d9f s ASP 91 Cb 0.07 -2.55 1.70 0.00 -0.30 0.00 0.00 42.92 41.83 2d9f s ASP 91 CO 0.16 -0.65 1.62 -1.28 -0.17 0.00 0.00 175.17 174.85 2d9f h SER 92 N 1.69 0.01 -0.67 -0.34 0.87 -1.85 0.62 113.55 113.88 2d9f h SER 92 Ca -0.49 0.01 0.10 0.00 -1.23 0.00 0.00 61.79 60.18 2d9f h SER 92 Cb 1.21 0.01 -0.08 0.00 -0.44 0.00 0.00 62.40 63.10 2d9f h SER 92 CO 0.60 -0.01 0.28 0.07 -0.53 0.00 0.00 176.83 177.24 2d9f h LYS 93 N 0.00 0.46 0.00 2.24 2.10 -1.90 0.54 116.57 120.01 2d9f h LYS 93 Ca 0.87 -0.03 -0.00 0.00 -2.00 0.00 0.00 60.65 59.49 2d9f h LYS 93 Cb 3.46 -0.10 -0.00 0.00 -0.90 0.00 0.00 32.23 34.69 2d9f h LYS 93 CO -0.03 0.30 -0.28 1.88 -2.00 0.00 0.00 179.45 179.33 2d9f h TYR 94 N 0.47 0.00 0.01 0.07 0.05 -0.10 -3.27 116.97 114.21 2d9f h TYR 94 Ca 0.34 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 59.12 2d9f h TYR 94 Cb 0.43 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.17 2d9f h TYR 94 CO -0.15 0.01 -0.01 0.00 -1.05 0.00 0.00 178.16 176.96 2d9f n TYR 96 N -2.23 0.00 0.00 0.00 4.02 0.76 -4.72 117.16 114.99 2d9f n TYR 96 Ca -0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 2d9f n TYR 96 Cb 0.01 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.33 2d9f n TYR 96 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2d9f n GLY 97 N 2.43 4.10 0.00 2.72 0.00 0.15 -4.78 105.19 109.82 2d9f n GLY 97 Ca 0.00 -1.62 0.08 0.00 0.00 0.00 0.00 46.02 44.48 2d9f n GLY 97 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2d9f n PRO 98 N -1.77 0.46 -0.10 1.61 -0.04 -1.26 -2.48 135.00 131.41 2d9f n PRO 98 Ca 0.00 0.02 -0.14 0.00 -0.04 0.00 0.00 63.50 63.34 2d9f n PRO 98 Cb 0.00 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 31.82 2d9f n PRO 98 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2d9f n GLN 99 N -1.03 0.67 0.00 0.54 10.64 -1.26 -4.47 117.38 122.47 2d9f n GLN 99 Ca 0.11 0.10 0.00 0.00 -1.83 0.00 0.00 57.00 55.38 2d9f n GLN 99 Cb 0.06 -1.56 0.00 0.00 -0.86 0.00 0.00 30.24 27.88 2d9f n GLN 99 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2d9f n GLY 100 N 1.95 -0.73 3.81 2.61 0.00 -1.04 -4.60 105.19 107.18 2d9f n GLY 100 Ca -0.37 -2.26 -0.30 0.00 0.00 0.00 0.00 46.02 43.09 2d9f n GLY 100 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2d9f s SER 101 N -0.19 4.33 -0.05 1.61 0.15 -1.03 -4.73 113.70 113.79 2d9f s SER 101 Ca 0.00 -1.44 -0.06 0.00 0.70 0.00 0.00 55.95 55.14 2d9f s SER 101 Cb 0.00 0.36 -0.02 0.00 -1.71 0.00 0.00 66.02 64.65 2d9f s SER 101 CO 0.00 -0.90 -0.13 0.54 1.20 0.00 0.00 173.24 173.95 2d9f n ARG 102 N -1.44 0.19 -3.40 5.44 5.12 -1.26 -3.94 116.66 117.38 2d9f n ARG 102 Ca -0.11 0.08 -0.07 0.00 -1.93 0.00 0.00 57.85 55.82 2d9f n ARG 102 Cb 0.66 -0.76 -0.07 0.00 -1.16 0.00 0.00 32.46 31.12 2d9f n ARG 102 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 2d9f s SER 103 N -5.10 -0.13 0.20 0.55 0.15 -1.26 -1.77 113.70 106.33 2d9f s SER 103 Ca -0.10 0.52 -0.30 0.00 0.70 0.00 0.00 55.95 56.77 2d9f s SER 103 Cb 0.01 1.35 -0.09 0.00 -1.71 0.00 0.00 66.02 65.58 2d9f s SER 103 CO 0.15 -0.28 1.30 -2.16 1.20 0.00 0.00 173.24 173.46 2d9f s PRO 104 N 2.61 4.40 0.55 5.44 0.04 -1.26 -5.13 135.00 141.65 2d9f s PRO 104 Ca 0.10 2.04 -0.19 0.00 0.04 0.00 0.00 61.00 62.99 2d9f s PRO 104 Cb -0.15 -3.20 -0.06 0.00 0.04 0.00 0.00 34.50 31.14 2d9f s PRO 104 CO -0.16 -0.24 1.13 -0.47 0.04 0.00 0.00 177.00 177.31 2d9f s TYR 105 N 0.06 2.66 -0.11 0.56 6.14 -0.73 -4.74 117.35 121.19 2d9f s TYR 105 Ca 0.56 1.54 -0.12 0.00 0.64 0.00 0.00 57.07 59.70 2d9f s TYR 105 Cb -0.36 -3.29 0.03 0.00 0.42 0.00 0.00 41.96 38.76 2d9f s TYR 105 CO 0.38 -1.59 0.33 0.96 0.64 0.00 0.00 175.55 176.27 2d9f s ILE 106 N -1.79 0.01 0.46 3.14 -5.25 -1.25 -4.88 121.20 111.63 2d9f s ILE 106 Ca 0.73 -0.05 -0.23 0.00 -0.99 0.00 0.00 60.65 60.11 2d9f s ILE 106 Cb -0.24 -0.48 -0.07 0.00 2.95 0.00 0.00 42.46 44.62 2d9f s ILE 106 CO 0.27 -0.03 1.16 -2.16 -1.79 0.00 0.00 174.94 172.40 2d9f s PRO 107 N 0.02 3.74 0.80 0.37 0.04 -1.26 -2.48 135.00 136.23 2d9f s PRO 107 Ca -0.01 1.77 -0.11 0.00 0.04 0.00 0.00 61.00 62.69 2d9f s PRO 107 Cb -0.03 -2.39 0.07 0.00 0.04 0.00 0.00 34.50 32.19 2d9f s PRO 107 CO 0.01 -0.56 1.09 -1.25 0.04 0.00 0.00 177.00 176.33 2d9f s PRO 108 N -2.72 2.07 -0.34 0.56 0.04 -1.26 -3.27 135.00 130.09 2d9f s PRO 108 Ca 0.64 1.11 0.00 0.00 0.04 0.00 0.00 61.00 62.78 2d9f s PRO 108 Cb -0.28 -1.88 0.00 0.00 0.04 0.00 0.00 34.50 32.38 2d9f s PRO 108 CO 0.34 -1.76 0.00 0.72 0.04 0.00 0.00 177.00 176.35 2d9f n HIS 109 N -3.59 -1.57 -3.57 0.56 8.25 -1.26 -4.85 115.22 109.19 2d9f n HIS 109 Ca 0.09 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.14 2d9f n HIS 109 Cb 0.53 -1.51 -0.08 0.00 1.12 0.00 0.00 29.99 30.06 2d9f n HIS 109 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2d9f s ALA 110 N -1.97 3.51 0.97 -1.41 0.00 -1.20 -4.73 121.76 116.94 2d9f s ALA 110 Ca 0.00 -2.79 -0.14 0.00 0.00 0.00 0.00 51.96 49.03 2d9f s ALA 110 Cb 0.00 -2.86 -0.02 0.00 0.00 0.00 0.00 23.12 20.24 2d9f s ALA 110 CO 0.00 -1.99 -0.01 0.00 0.00 0.00 0.00 175.76 173.76 2d9f n ALA 111 N 4.49 -3.61 -3.47 0.00 0.00 -1.26 -4.05 120.51 112.60 2d9f n ALA 111 Ca -0.02 -0.67 -0.12 0.00 0.00 0.00 0.00 53.44 52.63 2d9f n ALA 111 Cb 0.41 -1.57 -0.11 0.00 0.00 0.00 0.00 19.45 18.18 2d9f n ALA 111 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2d9f s LEU 112 N 1.85 0.36 -0.02 0.00 1.43 -1.24 -3.71 118.68 117.35 2d9f s LEU 112 Ca 0.51 0.74 -0.30 0.00 -1.03 0.00 0.00 54.13 54.06 2d9f s LEU 112 Cb -0.19 1.18 -0.03 0.00 0.03 0.00 0.00 46.19 47.18 2d9f s LEU 112 CO 0.72 -0.15 0.97 0.00 0.23 0.00 0.00 176.35 178.12 2d9f s LEU 114 N 1.12 1.09 -0.44 0.00 1.43 -0.98 -2.30 118.68 118.59 2d9f s LEU 114 Ca 0.51 -0.26 -0.16 0.00 -1.03 0.00 0.00 54.13 53.18 2d9f s LEU 114 Cb -0.21 -0.77 0.04 0.00 0.03 0.00 0.00 46.19 45.29 2d9f s LEU 114 CO 0.26 -0.13 0.41 -0.70 0.23 0.00 0.00 176.35 176.42 2d9f s GLU 115 N 1.72 3.03 -0.06 1.70 2.12 -1.25 -0.77 118.70 125.18 2d9f s GLU 115 Ca 0.04 -0.98 -0.19 0.00 0.36 0.00 0.00 54.97 54.20 2d9f s GLU 115 Cb -0.13 -4.02 -0.05 0.00 0.26 0.00 0.00 34.13 30.19 2d9f s GLU 115 CO -0.07 -0.90 0.53 0.08 -0.54 0.00 0.00 175.26 174.35 2d9f s VAL 116 N 1.95 5.06 -0.23 3.70 1.01 0.88 -4.01 120.40 128.76 2d9f s VAL 116 Ca 0.09 1.08 -0.04 0.00 0.00 0.00 0.00 61.98 63.10 2d9f s VAL 116 Cb -0.19 -3.86 0.08 0.00 0.00 0.00 0.00 36.38 32.40 2d9f s VAL 116 CO 0.11 0.38 0.11 -0.89 0.00 0.00 0.00 175.10 174.80 2d9f s THR 117 N 0.17 -0.03 -0.61 3.92 2.01 -1.26 -0.96 115.64 118.88 2d9f s THR 117 Ca 0.28 -0.49 -0.27 0.00 0.31 0.00 0.00 61.69 61.53 2d9f s THR 117 Cb -0.17 -0.81 -0.02 0.00 0.01 0.00 0.00 72.50 71.52 2d9f s THR 117 CO 0.14 -0.50 1.82 -0.22 -0.69 0.00 0.00 174.62 175.17 2d9f s LEU 118 N 2.10 3.29 -0.08 4.42 1.98 -1.25 -3.08 118.68 126.06 2d9f s LEU 118 Ca 0.05 0.34 -0.06 0.00 -2.89 0.00 0.00 54.13 51.57 2d9f s LEU 118 Cb -0.16 -2.58 -0.03 0.00 0.66 0.00 0.00 46.19 44.07 2d9f s LEU 118 CO -0.22 -2.31 0.22 0.11 -1.89 0.00 0.00 176.35 172.25 2d9f h LYS 119 N 14.55 -0.16 -2.03 1.98 1.79 -1.70 -1.11 116.57 129.89 2d9f h LYS 119 Ca -0.26 0.01 -0.04 0.00 -2.18 0.00 0.00 60.65 58.18 2d9f h LYS 119 Cb 1.16 0.04 -0.21 0.00 -1.58 0.00 0.00 32.23 31.63 2d9f h LYS 119 CO 1.21 -0.07 0.10 0.95 -1.08 0.00 0.00 179.45 180.56 2d9f s THR 120 N -2.12 -0.00 -0.22 -0.16 -4.23 -1.19 -4.61 115.64 103.11 2d9f s THR 120 Ca -0.03 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 60.48 2d9f s THR 120 Cb 0.00 -0.98 0.03 0.00 1.34 0.00 0.00 72.50 72.89 2d9f s THR 120 CO 0.10 0.00 -0.13 0.00 -0.54 0.00 0.00 174.62 174.05 2d9f s ALA 121 N 0.50 2.52 0.20 3.99 0.00 -1.26 -2.23 121.76 125.48 2d9f s ALA 121 Ca -0.01 -1.41 0.03 0.00 0.00 0.00 0.00 51.96 50.56 2d9f s ALA 121 Cb -0.05 -1.46 -0.01 0.00 0.00 0.00 0.00 23.12 21.60 2d9f s ALA 121 CO -0.01 -0.68 0.10 1.33 0.00 0.00 0.00 175.76 176.49 2d9f n VAL 122 N 4.60 0.00 -0.11 0.00 0.24 -0.09 -4.97 118.33 118.00 2d9f n VAL 122 Ca -0.18 -1.25 -0.15 0.00 -2.04 0.00 0.00 64.34 60.73 2d9f n VAL 122 Cb 0.47 0.50 -0.14 0.00 -1.47 0.00 0.00 33.84 33.20 2d9f n VAL 122 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 2d9f n ASP 123 N -1.93 1.24 -4.85 -1.34 2.03 -1.26 0.48 116.55 110.93 2d9f n ASP 123 Ca -0.01 -0.07 -0.34 0.00 0.52 0.00 0.00 54.79 54.89 2d9f n ASP 123 Cb 0.32 0.10 -0.06 0.00 -0.72 0.00 0.00 41.12 40.76 2d9f n ASP 123 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 2d9f s ARG 124 N -2.51 3.96 0.43 -0.67 3.00 -1.26 -4.47 118.95 117.43 2d9f s ARG 124 Ca -0.25 0.49 -0.24 0.00 0.00 0.00 0.00 55.73 55.73 2d9f s ARG 124 Cb 0.08 -2.78 -0.08 0.00 0.00 0.00 0.00 34.95 32.17 2d9f s ARG 124 CO 0.69 0.38 1.18 -1.25 0.00 0.00 0.00 175.30 176.30 2d9f s PRO 125 N -2.35 3.91 0.41 3.54 0.04 -1.26 -4.90 135.00 134.40 2d9f s PRO 125 Ca 0.43 1.83 0.24 0.00 0.04 0.00 0.00 61.00 63.55 2d9f s PRO 125 Cb -0.13 -2.56 1.30 0.00 0.04 0.00 0.00 34.50 33.14 2d9f s PRO 125 CO 0.20 -0.44 1.65 0.38 0.04 0.00 0.00 177.00 178.83 2d9f h ASP 126 N 2.38 0.34 -2.48 6.66 3.04 -1.98 -3.34 116.42 121.03 2d9f h ASP 126 Ca -0.49 0.15 -0.53 0.00 -3.24 0.00 0.00 57.03 52.91 2d9f h ASP 126 Cb 1.24 0.12 -0.05 0.00 -1.04 0.00 0.00 39.33 39.60 2d9f h ASP 126 CO 0.61 -0.14 1.21 -0.22 -2.04 0.00 0.00 179.24 178.66 2d9f s LEU 127 N -9.75 3.36 0.85 0.15 2.96 -1.26 -4.99 118.68 110.00 2d9f s LEU 127 Ca -0.08 0.38 -0.11 0.00 -0.22 0.00 0.00 54.13 54.09 2d9f s LEU 127 Cb 0.29 -2.90 0.10 0.00 0.50 0.00 0.00 46.19 44.19 2d9f s LEU 127 CO 0.81 -1.94 1.09 -1.61 -1.32 0.00 0.00 176.35 173.38 2d9f s GLU 128 N 6.06 1.60 -1.51 1.98 2.02 -1.26 -3.69 118.70 123.91 2d9f s GLU 128 Ca 0.59 0.95 -0.11 0.00 0.02 0.00 0.00 54.97 56.43 2d9f s GLU 128 Cb -0.13 -1.84 0.07 0.00 0.10 0.00 0.00 34.13 32.34 2d9f s GLU 128 CO 0.24 -2.04 0.86 -1.33 0.02 0.00 0.00 175.26 173.01 2d9f n MET 129 N -3.76 -4.91 -0.55 1.61 2.81 -1.26 -4.92 117.12 106.13 2d9f n MET 129 Ca 0.08 0.55 -0.28 0.00 -1.81 0.00 0.00 57.70 56.24 2d9f n MET 129 Cb 0.54 -5.30 0.19 0.00 -0.71 0.00 0.00 33.22 27.95 2d9f n MET 129 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 2d9f n SER 130 N -2.86 -2.71 -4.69 7.83 3.41 -1.24 -4.89 113.62 108.46 2d9f n SER 130 Ca -0.04 -0.30 -0.42 0.00 -0.26 0.00 0.00 58.87 57.84 2d9f n SER 130 Cb 0.56 -0.94 -0.03 0.00 -0.26 0.00 0.00 64.21 63.54 2d9f n SER 130 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2d9f s GLY 131 N -2.09 2.45 0.59 5.00 0.00 -1.26 -5.03 107.32 106.98 2d9f s GLY 131 Ca 0.54 0.44 -0.18 0.00 0.00 0.00 0.00 44.72 45.52 2d9f s GLY 131 CO 0.56 1.90 1.12 2.56 0.00 0.00 0.00 173.10 179.24 2d9f s PRO 132 N 1.81 3.14 -0.09 2.90 0.04 -1.26 -5.07 135.00 136.47 2d9f s PRO 132 Ca 0.50 1.53 -0.07 0.00 0.04 0.00 0.00 61.00 62.99 2d9f s PRO 132 Cb -0.20 -1.98 0.03 0.00 0.04 0.00 0.00 34.50 32.39 2d9f s PRO 132 CO 0.20 -1.00 0.23 0.45 0.04 0.00 0.00 177.00 176.93 2d9f s SER 133 N -2.08 -0.25 0.12 6.66 0.15 -1.26 -5.15 113.70 111.89 2d9f s SER 133 Ca 0.71 0.48 -0.28 0.00 0.70 0.00 0.00 55.95 57.56 2d9f s SER 133 Cb -0.23 0.46 -0.06 0.00 -1.71 0.00 0.00 66.02 64.48 2d9f s SER 133 CO 0.33 -0.10 0.87 -0.44 1.20 0.00 0.00 173.24 175.10 2d9f s SER 134 N 0.35 7.42 0.00 5.45 0.01 -1.26 -5.33 113.70 120.35 2d9f s SER 134 Ca -0.02 1.69 0.30 0.00 1.31 0.00 0.00 55.95 59.24 2d9f s SER 134 Cb -0.03 -2.54 1.53 0.00 0.21 0.00 0.00 66.02 65.19 2d9f s SER 134 CO -0.01 0.03 2.02 0.61 0.41 0.00 0.00 173.24 176.29