#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d9f n SER 2 N 0.00 0.82 -3.57 1.61 2.88 -1.26 -4.83 113.62 109.27 2d9f n SER 2 Ca 0.00 0.48 -0.07 0.00 -1.33 0.00 0.00 58.87 57.96 2d9f n SER 2 Cb 0.00 -0.96 -0.03 0.00 -0.75 0.00 0.00 64.21 62.47 2d9f n SER 2 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2d9f s SER 3 N 7.12 -0.25 0.00 -3.46 1.04 -1.26 -5.14 113.70 111.75 2d9f s SER 3 Ca 1.23 0.11 0.00 0.00 0.48 0.00 0.00 55.95 57.77 2d9f s SER 3 Cb -1.33 0.24 0.00 0.00 0.10 0.00 0.00 66.02 65.03 2d9f s SER 3 CO 0.58 -0.34 0.00 0.61 0.98 0.00 0.00 173.24 175.07 2d9f n GLY 4 N 0.16 -1.26 3.37 7.32 0.00 -1.26 -5.12 105.19 108.39 2d9f n GLY 4 Ca -0.05 0.67 -0.34 0.00 0.00 0.00 0.00 46.02 46.30 2d9f n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2d9f s SER 5 N -4.00 4.39 0.57 1.61 0.01 -1.26 -5.11 113.70 109.90 2d9f s SER 5 Ca 0.00 -0.31 0.09 0.00 1.31 0.00 0.00 55.95 57.04 2d9f s SER 5 Cb 0.00 -1.73 0.08 0.00 0.21 0.00 0.00 66.02 64.58 2d9f s SER 5 CO 0.00 0.06 0.78 -0.44 0.41 0.00 0.00 173.24 174.05 2d9f s SER 6 N 1.02 5.12 0.00 2.44 0.01 -1.26 -5.04 113.70 115.98 2d9f s SER 6 Ca 0.00 -0.78 0.00 0.00 1.31 0.00 0.00 55.95 56.48 2d9f s SER 6 Cb -0.15 0.19 0.00 0.00 0.21 0.00 0.00 66.02 66.28 2d9f s SER 6 CO 0.00 -1.31 0.00 0.61 0.41 0.00 0.00 173.24 172.95 2d9f n GLY 7 N -2.23 -0.13 1.93 3.44 0.00 -1.26 -4.96 105.19 101.98 2d9f n GLY 7 Ca 0.15 -1.32 -0.14 0.00 0.00 0.00 0.00 46.02 44.71 2d9f n GLY 7 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2d9f n GLU 8 N 1.13 2.82 0.06 1.61 2.13 -1.26 -4.78 120.64 122.35 2d9f n GLU 8 Ca 0.00 -3.83 -0.08 0.00 0.66 0.00 0.00 57.16 53.91 2d9f n GLU 8 Cb 0.00 -1.96 0.07 0.00 0.27 0.00 0.00 31.44 29.82 2d9f n GLU 8 CO 0.00 0.00 0.00 1.05 -0.41 0.00 0.00 177.13 177.77 2d9f h GLU 9 N 2.03 0.35 0.00 5.31 9.09 -2.01 -3.46 114.58 125.89 2d9f h GLU 9 Ca 0.20 -0.26 -0.44 0.00 0.05 0.00 0.00 59.36 58.91 2d9f h GLU 9 Cb 1.43 0.05 -0.10 0.00 -1.65 0.00 0.00 28.75 28.47 2d9f h GLU 9 CO 0.51 0.88 -0.37 0.91 0.05 0.00 0.00 179.01 181.00 2d9f n TRP 10 N -3.86 0.08 -4.79 2.06 7.02 -1.26 -4.98 117.44 111.70 2d9f n TRP 10 Ca -0.03 -2.10 -0.33 0.00 -1.02 0.00 0.00 57.50 54.02 2d9f n TRP 10 Cb 0.66 0.01 -0.14 0.00 -2.42 0.00 0.00 31.31 29.42 2d9f n TRP 10 CO 0.00 0.00 0.00 -1.17 -2.02 0.00 0.00 177.69 174.50 2d9f s LEU 11 N 0.00 2.77 -0.62 -0.99 0.20 -1.11 -4.97 118.68 113.96 2d9f s LEU 11 Ca 0.17 -0.26 -0.22 0.00 0.69 0.00 0.00 54.13 54.52 2d9f s LEU 11 Cb 0.01 -1.61 0.08 0.00 -0.43 0.00 0.00 46.19 44.24 2d9f s LEU 11 CO 0.12 0.23 0.87 -1.81 -0.29 0.00 0.00 176.35 175.48 2d9f s ASP 12 N -0.06 6.19 0.18 3.68 1.01 -1.26 -2.68 116.67 123.73 2d9f s ASP 12 Ca -0.02 -1.04 -0.06 0.00 0.71 0.00 0.00 52.55 52.14 2d9f s ASP 12 Cb -0.14 -2.38 0.07 0.00 1.01 0.00 0.00 42.92 41.48 2d9f s ASP 12 CO 0.04 -1.30 1.51 0.40 0.21 0.00 0.00 175.17 176.03 2d9f h ILE 13 N 5.96 1.29 0.00 0.77 2.04 -1.91 -3.28 117.51 122.37 2d9f h ILE 13 Ca -0.29 -1.64 -0.33 0.00 1.00 0.00 0.00 64.86 63.60 2d9f h ILE 13 Cb 1.08 1.56 -0.06 0.00 -0.74 0.00 0.00 36.82 38.65 2d9f h ILE 13 CO 1.14 0.53 -2.17 0.18 0.00 0.00 0.00 178.15 177.82 2d9f n LEU 14 N -4.02 0.25 0.00 1.44 4.77 -1.26 -5.01 117.00 113.17 2d9f n LEU 14 Ca -0.03 0.12 0.00 0.00 -0.03 0.00 0.00 56.01 56.07 2d9f n LEU 14 Cb 0.56 0.39 0.00 0.00 -2.33 0.00 0.00 43.42 42.04 2d9f n LEU 14 CO 0.47 0.44 0.00 0.61 -1.33 0.00 0.00 177.39 177.59 2d9f n GLY 15 N 1.67 2.17 0.15 -0.72 0.00 -1.24 -4.92 105.19 102.31 2d9f n GLY 15 Ca -0.27 -0.21 -0.13 0.00 0.00 0.00 0.00 46.02 45.41 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 0.83 -0.25 0.00 1.61 7.08 -1.93 -3.48 115.58 119.44 2d9f h ASN 16 Ca 0.00 -0.17 0.00 0.00 -3.08 0.00 0.00 56.30 53.05 2d9f h ASN 16 Cb 0.00 0.06 0.00 0.00 -2.08 0.00 0.00 38.32 36.30 2d9f h ASN 16 CO 0.00 0.04 0.00 0.61 -2.08 0.00 0.00 177.43 176.00 2d9f n GLY 17 N -0.51 0.99 0.00 9.14 0.00 -1.26 -5.05 105.19 108.50 2d9f n GLY 17 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.93 2d9f n GLY 17 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2d9f n LEU 18 N 0.00 0.01 -4.66 0.99 7.99 -1.26 -4.57 117.00 115.50 2d9f n LEU 18 Ca 0.00 0.94 -0.43 0.00 -0.01 0.00 0.00 56.01 56.51 2d9f n LEU 18 Cb 0.00 -0.49 -0.02 0.00 -0.11 0.00 0.00 43.42 42.80 2d9f n LEU 18 CO 0.00 -0.49 1.02 -0.22 -1.51 0.00 0.00 177.39 176.19 2d9f s LEU 19 N -3.92 4.10 0.16 2.23 2.96 -1.26 -3.87 118.68 119.09 2d9f s LEU 19 Ca 0.00 1.48 0.03 0.00 -0.22 0.00 0.00 54.13 55.42 2d9f s LEU 19 Cb 0.00 -3.54 -0.05 0.00 0.50 0.00 0.00 46.19 43.11 2d9f s LEU 19 CO 0.00 -0.77 -0.06 -0.13 -1.32 0.00 0.00 176.35 174.07 2d9f s ARG 20 N 3.47 1.08 -0.01 1.98 0.52 -1.12 -2.98 118.95 121.89 2d9f s ARG 20 Ca 0.50 -1.49 0.02 0.00 -0.52 0.00 0.00 55.73 54.24 2d9f s ARG 20 Cb -0.18 -0.47 -0.00 0.00 0.52 0.00 0.00 34.95 34.82 2d9f s ARG 20 CO 0.12 -0.02 -0.05 0.21 0.02 0.00 0.00 175.30 175.59 2d9f s LYS 21 N -3.82 0.44 -0.23 3.54 2.20 -1.09 -2.22 119.74 118.56 2d9f s LYS 21 Ca 0.19 -0.18 -0.03 0.00 -0.36 0.00 0.00 55.97 55.60 2d9f s LYS 21 Cb 0.04 -0.43 0.07 0.00 -1.51 0.00 0.00 37.83 36.01 2d9f s LYS 21 CO 0.02 0.10 0.06 0.21 -0.36 0.00 0.00 175.35 175.38 2d9f s LYS 22 N -0.06 0.61 -0.44 4.03 2.20 0.57 -2.77 119.74 123.89 2d9f s LYS 22 Ca 0.01 -0.57 -0.27 0.00 -0.36 0.00 0.00 55.97 54.78 2d9f s LYS 22 Cb -0.03 -1.99 -0.05 0.00 -1.51 0.00 0.00 37.83 34.25 2d9f s LYS 22 CO -0.00 -0.76 2.19 0.99 -0.36 0.00 0.00 175.35 177.41 2d9f s THR 23 N 1.83 3.13 0.01 3.43 2.01 -1.26 -0.84 115.64 123.95 2d9f s THR 23 Ca 0.02 0.10 -0.20 0.00 0.31 0.00 0.00 61.69 61.93 2d9f s THR 23 Cb -0.17 -3.27 -0.20 0.00 0.01 0.00 0.00 72.50 68.87 2d9f s THR 23 CO -0.15 -0.23 1.17 -0.07 -0.69 0.00 0.00 174.62 174.65 2d9f h LEU 24 N 17.33 0.49 -6.68 4.42 3.38 -0.64 -3.44 115.31 130.17 2d9f h LEU 24 Ca -0.29 -0.68 -0.31 0.00 0.09 0.00 0.00 57.88 56.69 2d9f h LEU 24 Cb 1.23 -0.15 -0.35 0.00 0.09 0.00 0.00 40.66 41.49 2d9f h LEU 24 CO 1.11 1.10 -0.62 -0.69 0.09 0.00 0.00 178.44 179.44 2d9f s VAL 25 N -3.51 -0.37 0.50 1.22 1.01 0.22 -4.99 120.40 114.48 2d9f s VAL 25 Ca -0.14 -0.21 -0.21 0.00 0.00 0.00 0.00 61.98 61.42 2d9f s VAL 25 Cb 0.04 -0.77 -0.07 0.00 0.00 0.00 0.00 36.38 35.58 2d9f s VAL 25 CO 0.80 -0.27 1.15 -2.16 0.00 0.00 0.00 175.10 174.62 2d9f s PRO 26 N 2.35 3.58 0.57 2.72 0.04 -1.26 -0.45 135.00 142.55 2d9f s PRO 26 Ca 0.08 1.70 -0.05 0.00 0.04 0.00 0.00 61.00 62.77 2d9f s PRO 26 Cb -0.15 -2.22 0.12 0.00 0.04 0.00 0.00 34.50 32.29 2d9f s PRO 26 CO -0.18 -0.69 0.78 0.41 0.04 0.00 0.00 177.00 177.37 2d9f n GLY 27 N 0.31 -0.28 3.74 0.56 0.00 -1.26 -4.87 105.19 103.39 2d9f n GLY 27 Ca 0.09 -1.86 -0.30 0.00 0.00 0.00 0.00 46.02 43.95 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 -4.56 1.63 0.00 1.61 0.04 -1.26 -4.92 135.00 127.54 2d9f s PRO 28 Ca 0.48 0.95 0.15 0.00 0.04 0.00 0.00 61.00 62.61 2d9f s PRO 28 Cb -0.02 -1.84 0.76 0.00 0.04 0.00 0.00 34.50 33.43 2d9f s PRO 28 CO 0.32 -2.02 1.41 -0.35 0.04 0.00 0.00 177.00 176.40 2d9f n PRO 29 N -3.75 0.22 -0.00 0.56 -0.04 -1.26 -2.57 135.00 128.16 2d9f n PRO 29 Ca 0.08 0.14 -0.08 0.00 -0.04 0.00 0.00 63.50 63.59 2d9f n PRO 29 Cb 0.54 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.37 2d9f n PRO 29 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 2d9f h GLY 30 N 2.45 0.00 -0.98 0.55 0.00 -1.99 -3.47 103.07 99.62 2d9f h GLY 30 Ca 0.00 -0.01 -0.40 0.00 0.00 0.00 0.00 47.33 46.92 2d9f h GLY 30 CO 0.00 0.01 -0.06 -1.35 0.00 0.00 0.00 176.54 175.14 2d9f s SER 31 N -6.23 -0.33 -0.29 0.19 1.04 -1.06 -5.07 113.70 101.94 2d9f s SER 31 Ca -0.04 0.99 -0.22 0.00 0.48 0.00 0.00 55.95 57.17 2d9f s SER 31 Cb 0.08 -1.46 0.15 0.00 0.10 0.00 0.00 66.02 64.90 2d9f s SER 31 CO 0.82 -4.94 1.13 -0.94 0.98 0.00 0.00 173.24 170.30 2d9f s SER 32 N -3.07 -0.34 0.14 7.02 1.04 -1.26 -4.94 113.70 112.29 2d9f s SER 32 Ca 0.69 0.61 -0.30 0.00 0.48 0.00 0.00 55.95 57.43 2d9f s SER 32 Cb -0.16 0.81 -0.17 0.00 0.10 0.00 0.00 66.02 66.61 2d9f s SER 32 CO 0.59 -0.10 0.64 0.54 0.98 0.00 0.00 173.24 175.89 2d9f n ARG 33 N 2.57 0.00 0.00 4.02 1.74 -1.26 -4.05 116.66 119.68 2d9f n ARG 33 Ca -0.14 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.94 2d9f n ARG 33 Cb 0.57 -1.08 0.00 0.00 -1.02 0.00 0.00 32.46 30.92 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 1.08 0.18 -4.37 5.56 -0.04 -1.26 -4.95 135.00 131.20 2d9f n PRO 34 Ca 0.18 0.00 -0.25 0.00 -0.04 0.00 0.00 63.50 63.39 2d9f n PRO 34 Cb 0.20 0.00 -0.12 0.00 -0.04 0.00 0.00 33.50 33.54 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 -0.40 2.07 -0.36 0.52 0.11 -1.26 -5.03 120.40 116.04 2d9f s VAL 35 Ca 0.00 -1.89 -0.24 0.00 -2.93 0.00 0.00 61.98 56.92 2d9f s VAL 35 Cb 0.00 -1.93 0.01 0.00 -1.53 0.00 0.00 36.38 32.93 2d9f s VAL 35 CO 0.00 -0.15 0.80 -0.75 -3.33 0.00 0.00 175.10 171.67 2d9f s LYS 36 N -2.53 3.77 0.00 1.54 2.20 -1.26 -3.78 119.74 119.67 2d9f s LYS 36 Ca 0.16 0.36 0.00 0.00 -0.36 0.00 0.00 55.97 56.13 2d9f s LYS 36 Cb -0.08 -3.81 0.00 0.00 -1.51 0.00 0.00 37.83 32.44 2d9f s LYS 36 CO 0.08 -0.86 0.00 0.41 -0.36 0.00 0.00 175.35 174.62 2d9f n GLY 37 N 4.50 0.68 3.71 5.54 0.00 -0.03 -4.90 105.19 114.69 2d9f n GLY 37 Ca 0.04 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.82 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 0.00 2.30 -0.46 1.61 -0.21 -1.25 -4.85 119.66 116.80 2d9f s GLN 38 Ca 0.00 -1.59 -0.29 0.00 0.02 0.00 0.00 55.36 53.50 2d9f s GLN 38 Cb 0.00 -2.11 0.02 0.00 1.00 0.00 0.00 33.01 31.91 2d9f s GLN 38 CO 0.00 0.12 1.35 0.08 -2.12 0.00 0.00 175.29 174.72 2d9f s VAL 39 N -2.45 3.95 -0.12 1.09 1.01 0.20 -3.27 120.40 120.82 2d9f s VAL 39 Ca 0.37 0.94 -0.04 0.00 0.00 0.00 0.00 61.98 63.25 2d9f s VAL 39 Cb -0.02 -4.35 -0.03 0.00 0.00 0.00 0.00 36.38 31.98 2d9f s VAL 39 CO 0.22 -0.90 0.02 0.68 0.00 0.00 0.00 175.10 175.11 2d9f s VAL 40 N 5.34 4.44 -0.20 2.92 -7.23 -0.93 -1.62 120.40 123.12 2d9f s VAL 40 Ca 0.56 -0.18 0.01 0.00 -1.81 0.00 0.00 61.98 60.57 2d9f s VAL 40 Cb -0.11 -2.92 0.03 0.00 0.56 0.00 0.00 36.38 33.94 2d9f s VAL 40 CO 0.31 0.56 -0.18 -0.89 -0.31 0.00 0.00 175.10 174.59 2d9f s THR 41 N -0.43 2.07 0.39 5.32 2.01 -0.98 -2.57 115.64 121.45 2d9f s THR 41 Ca 0.08 -1.09 0.06 0.00 0.31 0.00 0.00 61.69 61.05 2d9f s THR 41 Cb -0.12 -1.94 -0.02 0.00 0.01 0.00 0.00 72.50 70.42 2d9f s THR 41 CO 0.02 0.40 0.21 0.68 -0.69 0.00 0.00 174.62 175.24 2d9f s VAL 42 N 1.25 0.28 -0.34 3.82 -7.23 -0.18 -1.81 120.40 116.20 2d9f s VAL 42 Ca 0.02 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.21 2d9f s VAL 42 Cb -0.15 -2.37 0.09 0.00 0.56 0.00 0.00 36.38 34.51 2d9f s VAL 42 CO -0.11 0.00 0.05 -2.28 -0.31 0.00 0.00 175.10 172.45 2d9f s HIS 43 N -3.28 3.60 -0.14 2.82 2.46 -1.17 -1.54 115.29 118.04 2d9f s HIS 43 Ca 0.30 -2.66 -0.05 0.00 0.47 0.00 0.00 55.06 53.11 2d9f s HIS 43 Cb 0.02 -2.75 -0.04 0.00 -0.13 0.00 0.00 32.58 29.67 2d9f s HIS 43 CO 0.21 -0.93 0.05 -1.17 -2.47 0.00 0.00 174.74 170.43 2d9f s LEU 44 N 1.02 3.81 -0.16 8.88 1.98 -1.08 -3.83 118.68 129.30 2d9f s LEU 44 Ca 0.06 0.15 -0.03 0.00 -2.89 0.00 0.00 54.13 51.42 2d9f s LEU 44 Cb -0.20 -1.93 0.05 0.00 0.66 0.00 0.00 46.19 44.77 2d9f s LEU 44 CO -0.06 0.27 0.03 -1.10 -1.89 0.00 0.00 176.35 173.60 2d9f s GLN 45 N -0.24 0.60 -0.04 1.98 -0.21 -1.26 -1.98 119.66 118.50 2d9f s GLN 45 Ca 0.08 -0.25 -0.23 0.00 0.02 0.00 0.00 55.36 54.97 2d9f s GLN 45 Cb -0.12 -1.77 -0.04 0.00 1.00 0.00 0.00 33.01 32.07 2d9f s GLN 45 CO 0.02 -0.55 0.70 0.99 -2.12 0.00 0.00 175.29 174.33 2d9f s THR 46 N 1.91 4.98 -0.12 -0.19 2.01 0.81 -3.85 115.64 121.20 2d9f s THR 46 Ca 0.01 1.46 -0.08 0.00 0.31 0.00 0.00 61.69 63.39 2d9f s THR 46 Cb -0.16 -4.04 0.04 0.00 0.01 0.00 0.00 72.50 68.35 2d9f s THR 46 CO -0.07 0.29 0.29 -0.94 -0.69 0.00 0.00 174.62 173.50 2d9f s SER 47 N 0.55 -0.32 0.52 3.53 1.04 -0.95 -0.80 113.70 117.27 2d9f s SER 47 Ca 0.37 0.61 -0.22 0.00 0.48 0.00 0.00 55.95 57.19 2d9f s SER 47 Cb -0.18 0.54 -0.06 0.00 0.10 0.00 0.00 66.02 66.42 2d9f s SER 47 CO 0.19 -0.14 1.23 0.18 0.98 0.00 0.00 173.24 175.68 2d9f n LEU 48 N 3.69 4.57 -0.26 2.42 7.99 -0.86 -0.60 117.00 133.95 2d9f n LEU 48 Ca -0.20 0.98 0.33 0.00 -0.01 0.00 0.00 56.01 57.11 2d9f n LEU 48 Cb 0.55 -1.50 0.71 0.00 -0.11 0.00 0.00 43.42 43.07 2d9f n LEU 48 CO 0.14 -0.93 1.30 -0.08 -1.51 0.00 0.00 177.39 176.31 2d9f h GLU 49 N 1.40 0.00 0.05 3.23 4.22 -1.92 0.29 114.58 121.84 2d9f h GLU 49 Ca -0.49 0.00 -0.13 0.00 0.08 0.00 0.00 59.36 58.82 2d9f h GLU 49 Cb 1.32 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.58 2d9f h GLU 49 CO 0.56 0.00 -0.54 -2.95 -2.18 0.00 0.00 179.01 173.90 2d9f h ASN 50 N 0.00 0.40 0.00 1.04 7.08 -1.92 -3.48 115.58 118.69 2d9f h ASN 50 Ca 0.51 -0.85 0.00 0.00 -3.08 0.00 0.00 56.30 52.89 2d9f h ASN 50 Cb 2.28 -0.12 0.00 0.00 -2.08 0.00 0.00 38.32 38.40 2d9f h ASN 50 CO -0.01 1.20 0.00 0.61 -2.08 0.00 0.00 177.43 177.16 2d9f n GLY 51 N 1.31 0.14 3.05 9.14 0.00 0.10 -5.12 105.19 113.81 2d9f n GLY 51 Ca -0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.25 3.18 0.10 2.61 2.01 -1.24 -4.86 115.64 117.18 2d9f s THR 52 Ca 0.00 -2.80 -0.36 0.00 0.31 0.00 0.00 61.69 58.84 2d9f s THR 52 Cb 0.00 -3.15 -0.16 0.00 0.01 0.00 0.00 72.50 69.21 2d9f s THR 52 CO 0.00 -0.79 1.45 0.54 -0.69 0.00 0.00 174.62 175.14 2d9f n ARG 53 N 3.70 1.54 -0.07 4.92 1.74 -1.26 -2.02 116.66 125.22 2d9f n ARG 53 Ca 0.05 0.56 -0.12 0.00 -0.77 0.00 0.00 57.85 57.56 2d9f n ARG 53 Cb 0.38 -2.25 -0.05 0.00 -1.02 0.00 0.00 32.46 29.51 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 2.98 0.73 -4.36 1.55 0.31 0.02 -4.92 118.33 114.64 2d9f n VAL 54 Ca 0.18 -0.22 -0.22 0.00 -0.01 0.00 0.00 64.34 64.07 2d9f n VAL 54 Cb 0.23 -1.38 -0.16 0.00 -0.91 0.00 0.00 33.84 31.61 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 -2.25 1.15 -0.31 5.55 -1.52 -1.15 -4.90 119.66 116.24 2d9f s GLN 55 Ca -0.18 -0.26 0.01 0.00 -1.95 0.00 0.00 55.36 52.99 2d9f s GLN 55 Cb 0.06 -1.04 0.10 0.00 -0.22 0.00 0.00 33.01 31.91 2d9f s GLN 55 CO 0.26 0.00 0.07 -2.00 -0.25 0.00 0.00 175.29 173.36 2d9f s GLU 56 N 0.65 1.09 -0.38 2.91 2.12 -1.26 -0.13 118.70 123.69 2d9f s GLU 56 Ca -0.11 -1.37 -0.03 0.00 0.36 0.00 0.00 54.97 53.82 2d9f s GLU 56 Cb -0.14 -2.51 0.09 0.00 0.26 0.00 0.00 34.13 31.83 2d9f s GLU 56 CO 0.02 -0.93 0.15 -2.00 -0.54 0.00 0.00 175.26 171.95 2d9f s GLU 57 N 1.32 2.10 0.00 4.30 2.12 -0.84 -4.97 118.70 122.74 2d9f s GLU 57 Ca 0.09 -1.67 -0.23 0.00 0.36 0.00 0.00 54.97 53.51 2d9f s GLU 57 Cb -0.18 -3.48 -0.18 0.00 0.26 0.00 0.00 34.13 30.55 2d9f s GLU 57 CO -0.17 -0.95 1.30 -1.00 -0.54 0.00 0.00 175.26 173.90 2d9f h PRO 58 N 8.03 0.15 -2.86 4.30 0.13 -1.89 -2.87 132.00 137.00 2d9f h PRO 58 Ca -0.15 -0.08 -0.71 0.00 -0.87 0.00 0.00 66.00 64.19 2d9f h PRO 58 Cb 1.05 0.00 -0.35 0.00 0.13 0.00 0.00 31.00 31.83 2d9f h PRO 58 CO 0.65 0.60 0.03 -1.91 -0.23 0.00 0.00 178.00 177.14 2d9f n GLU 59 N -4.73 3.17 -2.91 0.86 2.13 -1.26 -4.31 120.64 113.59 2d9f n GLU 59 Ca -0.07 -4.56 -0.41 0.00 0.66 0.00 0.00 57.16 52.77 2d9f n GLU 59 Cb 0.30 -2.40 -0.04 0.00 0.27 0.00 0.00 31.44 29.57 2d9f n GLU 59 CO 0.00 0.00 0.00 -1.17 -0.41 0.00 0.00 177.13 175.55 2d9f s LEU 60 N -2.14 4.18 0.03 4.31 1.98 -0.59 -4.95 118.68 121.49 2d9f s LEU 60 Ca 0.32 1.14 0.05 0.00 -2.89 0.00 0.00 54.13 52.76 2d9f s LEU 60 Cb 0.03 -3.20 -0.02 0.00 0.66 0.00 0.00 46.19 43.66 2d9f s LEU 60 CO -0.02 -0.38 -0.15 0.54 -1.89 0.00 0.00 176.35 174.44 2d9f s VAL 61 N 2.09 1.22 0.21 1.68 0.11 -1.26 -1.01 120.40 123.44 2d9f s VAL 61 Ca 0.37 -0.95 -0.23 0.00 -2.93 0.00 0.00 61.98 58.25 2d9f s VAL 61 Cb -0.17 -1.07 0.05 0.00 -1.53 0.00 0.00 36.38 33.66 2d9f s VAL 61 CO 0.12 0.11 0.87 0.72 -3.33 0.00 0.00 175.10 173.59 2d9f s PHE 62 N -0.72 -0.13 -0.72 1.54 -0.12 -1.06 -5.01 117.98 111.75 2d9f s PHE 62 Ca 0.04 -0.25 -0.12 0.00 -0.05 0.00 0.00 56.93 56.55 2d9f s PHE 62 Cb -0.07 0.68 0.19 0.00 -0.63 0.00 0.00 43.02 43.18 2d9f s PHE 62 CO 0.01 -1.02 0.63 0.99 -0.05 0.00 0.00 175.22 175.78 2d9f s THR 63 N -3.44 5.06 0.14 -4.49 2.01 -1.26 -2.20 115.64 111.45 2d9f s THR 63 Ca 0.12 -2.38 -0.33 0.00 0.31 0.00 0.00 61.69 59.42 2d9f s THR 63 Cb -0.03 -4.18 -0.18 0.00 0.01 0.00 0.00 72.50 68.12 2d9f s THR 63 CO 0.05 -0.96 0.80 -0.11 -0.69 0.00 0.00 174.62 173.71 2d9f n LEU 64 N 4.13 -0.35 0.00 4.42 7.94 -1.20 -2.11 117.00 129.82 2d9f n LEU 64 Ca 0.07 1.14 0.00 0.00 -1.11 0.00 0.00 56.01 56.11 2d9f n LEU 64 Cb 0.44 -0.99 0.00 0.00 0.53 0.00 0.00 43.42 43.40 2d9f n LEU 64 CO 0.37 -2.35 0.00 0.61 -1.11 0.00 0.00 177.39 174.91 2d9f n GLY 65 N 1.80 2.32 0.15 -3.96 0.00 -1.26 -0.85 105.19 103.40 2d9f n GLY 65 Ca 0.18 -0.48 0.10 0.00 0.00 0.00 0.00 46.02 45.81 2d9f n GLY 65 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2d9f h ASP 66 N 1.05 0.00 -5.04 1.61 3.58 -1.86 -3.48 116.42 112.28 2d9f h ASP 66 Ca 0.00 0.00 -0.30 0.00 0.42 0.00 0.00 57.03 57.15 2d9f h ASP 66 Cb 0.00 0.00 0.13 0.00 1.72 0.00 0.00 39.33 41.18 2d9f h ASP 66 CO 0.00 0.11 -0.60 0.00 -2.88 0.00 0.00 179.24 175.87 2d9f h ASP 68 N -1.93 0.00 -6.02 0.00 1.82 -1.93 -3.45 116.42 104.90 2d9f h ASP 68 Ca -0.48 0.00 -0.39 0.00 -0.39 0.00 0.00 57.03 55.77 2d9f h ASP 68 Cb 1.30 0.00 0.02 0.00 0.68 0.00 0.00 39.33 41.33 2d9f h ASP 68 CO 0.44 0.11 -0.06 1.33 -1.61 0.00 0.00 179.24 179.45 2d9f n VAL 69 N -3.18 0.00 -1.52 2.25 0.24 -1.26 -5.05 118.33 109.81 2d9f n VAL 69 Ca 0.02 -1.55 -0.41 0.00 -2.04 0.00 0.00 64.34 60.35 2d9f n VAL 69 Cb 0.46 -0.59 0.01 0.00 -1.47 0.00 0.00 33.84 32.26 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 -1.98 2.16 0.36 1.34 2.08 -1.26 -4.73 119.36 117.33 2d9f n ILE 70 Ca 0.12 -0.50 0.13 0.00 0.56 0.00 0.00 62.75 63.07 2d9f n ILE 70 Cb 0.48 -0.79 0.56 0.00 -0.75 0.00 0.00 39.64 39.13 2d9f n ILE 70 CO 0.00 0.00 0.00 1.56 0.56 0.00 0.00 176.55 178.67 2d9f h GLN 71 N 0.99 0.00 0.00 0.38 4.20 -1.76 -1.40 115.11 117.52 2d9f h GLN 71 Ca -0.42 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.29 2d9f h GLN 71 Cb 1.38 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.16 2d9f h GLN 71 CO 0.53 0.00 -0.67 0.00 -0.67 0.00 0.00 178.83 178.02 2d9f n ALA 72 N -1.85 3.53 -0.13 3.87 0.00 -1.26 -3.17 120.51 121.50 2d9f n ALA 72 Ca 0.01 -0.37 -0.24 0.00 0.00 0.00 0.00 53.44 52.85 2d9f n ALA 72 Cb 0.23 -1.07 -0.11 0.00 0.00 0.00 0.00 19.45 18.51 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 -1.69 2.42 0.05 0.00 7.94 -0.75 -4.06 117.00 120.91 2d9f n LEU 73 Ca 0.04 0.11 -0.04 0.00 -1.11 0.00 0.00 56.01 55.01 2d9f n LEU 73 Cb 0.37 -0.84 0.17 0.00 0.53 0.00 0.00 43.42 43.65 2d9f n LEU 73 CO 0.37 0.74 0.62 -0.78 -1.11 0.00 0.00 177.39 177.22 2d9f h ASP 74 N -0.51 0.41 0.17 1.96 3.58 -1.47 0.35 116.42 120.90 2d9f h ASP 74 Ca -0.63 -0.18 0.00 0.00 0.42 0.00 0.00 57.03 56.64 2d9f h ASP 74 Cb 1.73 -0.11 0.00 0.00 1.72 0.00 0.00 39.33 42.67 2d9f h ASP 74 CO -0.26 0.78 0.00 0.18 -2.88 0.00 0.00 179.24 177.06 2d9f n LEU 75 N -4.02 0.00 -0.02 2.28 4.32 -1.19 -3.48 117.00 114.89 2d9f n LEU 75 Ca -0.02 0.09 -0.02 0.00 -0.02 0.00 0.00 56.01 56.04 2d9f n LEU 75 Cb 0.50 -0.09 -0.02 0.00 -1.62 0.00 0.00 43.42 42.19 2d9f n LEU 75 CO 0.43 -0.00 -0.61 -1.54 -1.22 0.00 0.00 177.39 174.45 2d9f n SER 76 N -1.09 4.14 -0.13 -1.43 3.41 -0.90 -4.66 113.62 112.95 2d9f n SER 76 Ca 0.21 -0.00 -0.08 0.00 -0.26 0.00 0.00 58.87 58.74 2d9f n SER 76 Cb 0.15 0.49 -0.02 0.00 -0.26 0.00 0.00 64.21 64.57 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 0.20 0.00 -3.33 2.07 -0.35 0.52 116.25 115.36 2d9f h VAL 77 Ca -0.09 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.43 2d9f h VAL 77 Cb 1.19 0.20 0.00 0.00 -1.52 0.00 0.00 31.29 31.16 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 -5.42 0.49 -0.23 1.57 -0.04 -1.26 -2.04 135.00 128.08 2d9f n PRO 78 Ca 0.01 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.56 2d9f n PRO 78 Cb 0.34 -1.29 0.18 0.00 -0.04 0.00 0.00 33.50 32.70 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 -0.79 3.00 -3.81 1.53 4.77 0.18 -4.89 117.00 116.99 2d9f n LEU 79 Ca 0.07 -2.94 -0.13 0.00 -0.03 0.00 0.00 56.01 52.98 2d9f n LEU 79 Cb 0.03 -0.44 -0.13 0.00 -2.33 0.00 0.00 43.42 40.55 2d9f n LEU 79 CO 0.05 0.68 -0.23 0.00 -1.33 0.00 0.00 177.39 176.56 2d9f s MET 80 N -2.65 0.12 0.68 3.23 0.23 -0.86 -5.05 119.30 115.00 2d9f s MET 80 Ca 0.34 0.21 -0.12 0.00 -1.03 0.00 0.00 55.69 55.10 2d9f s MET 80 Cb 0.28 0.00 0.01 0.00 -1.53 0.00 0.00 34.83 33.59 2d9f s MET 80 CO 0.06 -0.06 1.06 -0.51 -2.03 0.00 0.00 175.02 173.55 2d9f s ASP 81 N 0.35 5.35 -0.18 -1.18 1.11 -1.26 -4.43 116.67 116.42 2d9f s ASP 81 Ca -0.02 1.69 -0.29 0.00 0.18 0.00 0.00 52.55 54.10 2d9f s ASP 81 Cb -0.04 -2.51 -0.04 0.00 1.07 0.00 0.00 42.92 41.41 2d9f s ASP 81 CO -0.01 -1.47 1.76 0.54 1.18 0.00 0.00 175.17 177.17 2d9f s VAL 82 N -2.90 3.50 0.00 -1.27 0.11 -1.26 -2.00 120.40 116.58 2d9f s VAL 82 Ca 0.60 0.56 0.00 0.00 -2.93 0.00 0.00 61.98 60.20 2d9f s VAL 82 Cb -0.15 -3.50 0.00 0.00 -1.53 0.00 0.00 36.38 31.20 2d9f s VAL 82 CO 0.51 -0.20 0.00 0.61 -3.33 0.00 0.00 175.10 172.69 2d9f n GLY 83 N 4.79 0.97 3.55 6.54 0.00 0.96 -4.72 105.19 117.29 2d9f n GLY 83 Ca 0.21 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.83 3.78 -0.36 1.61 2.12 -0.85 -4.23 118.70 119.95 2d9f s GLU 84 Ca 0.00 -0.45 -0.17 0.00 0.36 0.00 0.00 54.97 54.70 2d9f s GLU 84 Cb 0.00 -3.03 -0.00 0.00 0.26 0.00 0.00 34.13 31.36 2d9f s GLU 84 CO 0.00 0.25 0.47 0.99 -0.54 0.00 0.00 175.26 176.43 2d9f s THR 85 N 0.38 5.06 0.01 -1.70 2.01 0.41 -3.38 115.64 118.42 2d9f s THR 85 Ca -0.01 0.21 0.05 0.00 0.31 0.00 0.00 61.69 62.24 2d9f s THR 85 Cb -0.13 -3.94 -0.02 0.00 0.01 0.00 0.00 72.50 68.42 2d9f s THR 85 CO 0.02 -0.21 -0.15 0.00 -0.69 0.00 0.00 174.62 173.59 2d9f s ALA 86 N 2.29 1.25 0.15 7.40 0.00 -0.45 0.14 121.76 132.53 2d9f s ALA 86 Ca 0.16 -0.72 0.02 0.00 0.00 0.00 0.00 51.96 51.43 2d9f s ALA 86 Cb -0.16 -0.28 -0.04 0.00 0.00 0.00 0.00 23.12 22.65 2d9f s ALA 86 CO 0.13 0.29 0.29 1.41 0.00 0.00 0.00 175.76 177.88 2d9f s MET 87 N -0.62 3.45 -0.03 0.00 -2.45 -0.02 -0.80 119.30 118.83 2d9f s MET 87 Ca 0.05 -0.55 0.01 0.00 -1.25 0.00 0.00 55.69 53.95 2d9f s MET 87 Cb -0.06 -2.96 0.02 0.00 1.25 0.00 0.00 34.83 33.08 2d9f s MET 87 CO 0.00 0.51 -0.03 0.14 1.05 0.00 0.00 175.02 176.70 2d9f s VAL 88 N -1.74 0.34 -0.32 10.11 -7.23 0.47 -0.32 120.40 121.71 2d9f s VAL 88 Ca 0.35 -0.05 0.02 0.00 -1.81 0.00 0.00 61.98 60.49 2d9f s VAL 88 Cb -0.11 -0.38 0.10 0.00 0.56 0.00 0.00 36.38 36.55 2d9f s VAL 88 CO 0.28 0.16 0.06 0.42 -0.31 0.00 0.00 175.10 175.71 2d9f s THR 89 N 0.71 1.69 0.34 5.32 -4.23 -0.94 -2.17 115.64 116.37 2d9f s THR 89 Ca -0.08 -1.89 0.10 0.00 -1.18 0.00 0.00 61.69 58.63 2d9f s THR 89 Cb -0.11 -2.23 -0.06 0.00 1.34 0.00 0.00 72.50 71.43 2d9f s THR 89 CO -0.01 -0.58 -0.10 0.00 -0.54 0.00 0.00 174.62 173.39 2d9f s ALA 90 N 1.21 2.95 0.35 3.99 0.00 -1.25 -2.79 121.76 126.22 2d9f s ALA 90 Ca 0.09 -2.09 -0.26 0.00 0.00 0.00 0.00 51.96 49.70 2d9f s ALA 90 Cb -0.18 -0.05 -0.09 0.00 0.00 0.00 0.00 23.12 22.80 2d9f s ALA 90 CO -0.14 0.08 1.07 0.34 0.00 0.00 0.00 175.76 177.11 2d9f s ASP 91 N -3.61 6.96 0.37 0.00 2.15 -1.26 -3.50 116.67 117.78 2d9f s ASP 91 Ca 0.32 2.14 0.27 0.00 0.43 0.00 0.00 52.55 55.71 2d9f s ASP 91 Cb 0.02 -2.60 1.25 0.00 -0.30 0.00 0.00 42.92 41.29 2d9f s ASP 91 CO 0.16 -0.36 1.32 -0.24 -0.17 0.00 0.00 175.17 175.89 2d9f n SER 92 N 0.46 0.19 -0.20 -0.34 2.88 -1.25 0.10 113.62 115.46 2d9f n SER 92 Ca 0.02 1.19 -0.00 0.00 -1.33 0.00 0.00 58.87 58.75 2d9f n SER 92 Cb 0.47 -0.58 0.07 0.00 -0.75 0.00 0.00 64.21 63.43 2d9f n SER 92 CO 0.00 0.00 0.00 0.07 -1.23 0.00 0.00 175.04 173.88 2d9f h LYS 93 N 0.00 0.05 0.00 -1.46 2.10 -1.90 0.61 116.57 115.97 2d9f h LYS 93 Ca 0.74 -0.00 -0.04 0.00 -2.00 0.00 0.00 60.65 59.34 2d9f h LYS 93 Cb 2.35 -0.01 -0.01 0.00 -0.90 0.00 0.00 32.23 33.67 2d9f h LYS 93 CO -0.41 0.03 -0.21 1.88 -2.00 0.00 0.00 179.45 178.74 2d9f h TYR 94 N 0.05 0.00 0.00 0.07 0.05 0.34 -3.17 116.97 114.32 2d9f h TYR 94 Ca 0.30 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.08 2d9f h TYR 94 Cb 0.47 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.21 2d9f h TYR 94 CO -0.42 0.21 0.00 0.00 -1.05 0.00 0.00 178.16 176.90 2d9f n TYR 96 N -1.62 0.00 0.00 0.00 4.02 0.18 -4.64 117.16 115.10 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 0.00 -0.09 0.00 0.00 -0.02 0.00 0.00 39.34 39.23 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 3.37 3.99 0.00 2.72 0.00 0.74 -4.81 105.19 111.20 2d9f n GLY 97 Ca -0.04 -1.64 0.08 0.00 0.00 0.00 0.00 46.02 44.42 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 -1.78 0.39 -0.04 1.61 -0.04 -1.26 -2.25 135.00 131.63 2d9f n PRO 98 Ca 0.00 0.05 -0.04 0.00 -0.04 0.00 0.00 63.50 63.47 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 -1.10 0.66 0.00 0.54 10.64 -1.26 -4.50 117.38 122.36 2d9f n GLN 99 Ca 0.10 0.08 0.00 0.00 -1.83 0.00 0.00 57.00 55.35 2d9f n GLN 99 Cb 0.08 -1.64 0.00 0.00 -0.86 0.00 0.00 30.24 27.82 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 1.56 -2.86 3.34 2.61 0.00 -0.95 -4.66 105.19 104.22 2d9f n GLY 100 Ca -0.20 -2.11 -0.27 0.00 0.00 0.00 0.00 46.02 43.44 2d9f n GLY 100 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2d9f n SER 101 N 0.00 3.04 0.01 1.61 2.88 -0.55 -4.75 113.62 115.86 2d9f n SER 101 Ca 0.00 -2.91 -0.01 0.00 -1.33 0.00 0.00 58.87 54.62 2d9f n SER 101 Cb 0.00 0.20 -0.00 0.00 -0.75 0.00 0.00 64.21 63.66 2d9f n SER 101 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 2d9f n ARG 102 N -1.32 0.03 -3.15 -1.46 3.00 -1.26 -3.89 116.66 108.61 2d9f n ARG 102 Ca -0.13 0.01 0.04 0.00 -0.00 0.00 0.00 57.85 57.77 2d9f n ARG 102 Cb 0.58 -0.55 -0.01 0.00 0.00 0.00 0.00 32.46 32.48 2d9f n ARG 102 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 2d9f s SER 103 N -5.35 -1.50 0.20 6.15 0.15 -1.26 -2.34 113.70 109.76 2d9f s SER 103 Ca -0.02 0.56 -0.30 0.00 0.70 0.00 0.00 55.95 56.89 2d9f s SER 103 Cb 0.01 2.10 -0.09 0.00 -1.71 0.00 0.00 66.02 66.33 2d9f s SER 103 CO 0.02 -0.28 1.30 -2.16 1.20 0.00 0.00 173.24 173.33 2d9f s PRO 104 N 2.85 4.39 0.28 5.44 0.04 -1.26 -5.12 135.00 141.61 2d9f s PRO 104 Ca 0.16 2.05 -0.29 0.00 0.04 0.00 0.00 61.00 62.95 2d9f s PRO 104 Cb -0.13 -3.20 -0.10 0.00 0.04 0.00 0.00 34.50 31.12 2d9f s PRO 104 CO -0.23 -0.24 1.12 -0.47 0.04 0.00 0.00 177.00 177.22 2d9f s TYR 105 N 0.09 3.52 -0.01 0.56 6.14 -0.99 -4.69 117.35 121.98 2d9f s TYR 105 Ca 0.56 1.66 -0.01 0.00 0.64 0.00 0.00 57.07 59.93 2d9f s TYR 105 Cb -0.36 -3.33 0.00 0.00 0.42 0.00 0.00 41.96 38.69 2d9f s TYR 105 CO 0.38 -0.70 0.02 0.96 0.64 0.00 0.00 175.55 176.86 2d9f s ILE 106 N -1.11 0.01 0.41 3.14 -5.25 -1.25 -4.86 121.20 112.29 2d9f s ILE 106 Ca 0.45 -0.09 -0.25 0.00 -0.99 0.00 0.00 60.65 59.77 2d9f s ILE 106 Cb -0.33 -0.07 -0.08 0.00 2.95 0.00 0.00 42.46 44.93 2d9f s ILE 106 CO 0.42 -0.05 1.19 -2.16 -1.79 0.00 0.00 174.94 172.54 2d9f s PRO 107 N -0.14 4.01 0.80 0.37 0.04 -1.26 -1.48 135.00 137.33 2d9f s PRO 107 Ca -0.02 1.87 -0.11 0.00 0.04 0.00 0.00 61.00 62.79 2d9f s PRO 107 Cb -0.01 -2.66 0.07 0.00 0.04 0.00 0.00 34.50 31.94 2d9f s PRO 107 CO -0.00 -0.37 1.09 -1.25 0.04 0.00 0.00 177.00 176.51 2d9f s PRO 108 N -2.33 2.05 -0.55 0.56 0.04 -1.26 -3.24 135.00 130.27 2d9f s PRO 108 Ca 0.58 1.10 0.00 0.00 0.04 0.00 0.00 61.00 62.72 2d9f s PRO 108 Cb -0.31 -1.88 0.00 0.00 0.04 0.00 0.00 34.50 32.35 2d9f s PRO 108 CO 0.39 -1.77 0.00 0.72 0.04 0.00 0.00 177.00 176.39 2d9f n HIS 109 N -3.60 -1.25 -3.48 0.56 8.25 -1.26 -4.86 115.22 109.58 2d9f n HIS 109 Ca 0.09 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.12 2d9f n HIS 109 Cb 0.53 -1.75 -0.07 0.00 1.12 0.00 0.00 29.99 29.82 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 -1.90 3.54 0.93 -1.41 0.00 -1.20 -4.71 121.76 117.02 2d9f s ALA 110 Ca 0.00 -2.68 -0.15 0.00 0.00 0.00 0.00 51.96 49.13 2d9f s ALA 110 Cb 0.00 -2.99 -0.05 0.00 0.00 0.00 0.00 23.12 20.07 2d9f s ALA 110 CO 0.00 -1.99 -0.11 0.00 0.00 0.00 0.00 175.76 173.66 2d9f n ALA 111 N 4.78 -3.75 -3.64 0.00 0.00 -1.26 -3.86 120.51 112.78 2d9f n ALA 111 Ca -0.06 -0.59 -0.12 0.00 0.00 0.00 0.00 53.44 52.68 2d9f n ALA 111 Cb 0.41 -1.51 -0.12 0.00 0.00 0.00 0.00 19.45 18.23 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 3.01 0.21 -0.08 0.00 1.43 -1.23 -3.66 118.68 118.37 2d9f s LEU 112 Ca 0.51 0.72 -0.29 0.00 -1.03 0.00 0.00 54.13 54.04 2d9f s LEU 112 Cb -0.22 1.09 -0.02 0.00 0.03 0.00 0.00 46.19 47.07 2d9f s LEU 112 CO 0.73 -0.17 0.96 0.00 0.23 0.00 0.00 176.35 178.10 2d9f s LEU 114 N 1.63 1.21 -0.45 0.00 1.43 -0.92 -2.24 118.68 119.33 2d9f s LEU 114 Ca 0.48 -0.29 -0.15 0.00 -1.03 0.00 0.00 54.13 53.14 2d9f s LEU 114 Cb -0.19 -0.81 0.06 0.00 0.03 0.00 0.00 46.19 45.28 2d9f s LEU 114 CO 0.21 -0.11 0.36 -0.70 0.23 0.00 0.00 176.35 176.34 2d9f s GLU 115 N 1.60 2.96 0.12 1.70 2.12 -1.25 -0.40 118.70 125.55 2d9f s GLU 115 Ca 0.03 -1.26 -0.15 0.00 0.36 0.00 0.00 54.97 53.94 2d9f s GLU 115 Cb -0.13 -4.07 -0.07 0.00 0.26 0.00 0.00 34.13 30.12 2d9f s GLU 115 CO -0.07 -0.95 0.54 0.08 -0.54 0.00 0.00 175.26 174.32 2d9f s VAL 116 N 1.64 4.85 -0.25 3.70 1.01 0.02 -4.10 120.40 127.28 2d9f s VAL 116 Ca 0.04 0.89 -0.03 0.00 0.00 0.00 0.00 61.98 62.89 2d9f s VAL 116 Cb -0.23 -3.76 0.11 0.00 0.00 0.00 0.00 36.38 32.50 2d9f s VAL 116 CO 0.07 0.33 0.25 -0.89 0.00 0.00 0.00 175.10 174.86 2d9f s THR 117 N -1.37 -0.35 -0.36 3.92 2.01 -1.25 -1.35 115.64 116.90 2d9f s THR 117 Ca 0.35 -0.31 -0.28 0.00 0.31 0.00 0.00 61.69 61.76 2d9f s THR 117 Cb -0.16 -0.83 -0.02 0.00 0.01 0.00 0.00 72.50 71.50 2d9f s THR 117 CO 0.19 -0.34 1.78 -0.22 -0.69 0.00 0.00 174.62 175.33 2d9f s LEU 118 N 2.33 3.50 -0.09 4.42 1.98 -1.22 -3.07 118.68 126.54 2d9f s LEU 118 Ca 0.08 1.20 -0.03 0.00 -2.89 0.00 0.00 54.13 52.49 2d9f s LEU 118 Cb -0.15 -3.44 -0.01 0.00 0.66 0.00 0.00 46.19 43.25 2d9f s LEU 118 CO -0.22 -1.74 -0.07 0.11 -1.89 0.00 0.00 176.35 172.54 2d9f h LYS 119 N 12.91 0.00 -2.85 1.98 1.79 -1.73 0.27 116.57 128.94 2d9f h LYS 119 Ca -0.33 0.00 -0.08 0.00 -2.18 0.00 0.00 60.65 58.06 2d9f h LYS 119 Cb 1.16 0.00 -0.18 0.00 -1.58 0.00 0.00 32.23 31.64 2d9f h LYS 119 CO 1.05 0.00 -0.09 0.95 -1.08 0.00 0.00 179.45 180.28 2d9f s THR 120 N -1.65 0.05 -0.17 -0.16 -4.23 -1.22 -4.46 115.64 103.80 2d9f s THR 120 Ca -0.06 -0.37 -0.00 0.00 -1.18 0.00 0.00 61.69 60.08 2d9f s THR 120 Cb 0.01 -0.87 0.04 0.00 1.34 0.00 0.00 72.50 73.02 2d9f s THR 120 CO 0.08 -0.21 -0.06 0.00 -0.54 0.00 0.00 174.62 173.90 2d9f s ALA 121 N -1.96 1.58 0.12 3.99 0.00 -1.26 -2.31 121.76 121.92 2d9f s ALA 121 Ca -0.08 -0.90 -0.01 0.00 0.00 0.00 0.00 51.96 50.96 2d9f s ALA 121 Cb -0.02 -1.15 -0.04 0.00 0.00 0.00 0.00 23.12 21.91 2d9f s ALA 121 CO 0.01 -0.79 0.05 0.14 0.00 0.00 0.00 175.76 175.18 2d9f s VAL 122 N 1.59 0.12 -0.01 0.00 -7.23 -0.64 -4.98 120.40 109.24 2d9f s VAL 122 Ca 0.00 -1.87 -0.12 0.00 -1.81 0.00 0.00 61.98 58.19 2d9f s VAL 122 Cb -0.15 -1.95 -0.32 0.00 0.56 0.00 0.00 36.38 34.51 2d9f s VAL 122 CO -0.08 -0.54 0.82 -0.78 -0.31 0.00 0.00 175.10 174.21 2d9f h ASP 123 N 2.89 0.68 -3.96 4.85 1.82 -1.94 0.57 116.42 121.34 2d9f h ASP 123 Ca -0.35 -0.88 -0.53 0.00 -0.39 0.00 0.00 57.03 54.88 2d9f h ASP 123 Cb 1.19 -0.22 0.09 0.00 0.68 0.00 0.00 39.33 41.07 2d9f h ASP 123 CO 0.60 1.72 0.64 -0.13 -1.61 0.00 0.00 179.24 180.46 2d9f s ARG 124 N -2.59 3.90 0.67 0.28 0.52 -1.26 -4.38 118.95 116.09 2d9f s ARG 124 Ca -0.13 2.25 -0.14 0.00 -0.52 0.00 0.00 55.73 57.19 2d9f s ARG 124 Cb 0.05 -2.74 0.01 0.00 0.52 0.00 0.00 34.95 32.78 2d9f s ARG 124 CO 0.89 -0.58 1.11 -1.25 0.02 0.00 0.00 175.30 175.49 2d9f s PRO 125 N -2.28 2.74 -0.16 3.54 0.04 -1.26 -4.78 135.00 132.83 2d9f s PRO 125 Ca 0.58 1.37 -0.03 0.00 0.04 0.00 0.00 61.00 62.95 2d9f s PRO 125 Cb -0.40 -1.94 -0.09 0.00 0.04 0.00 0.00 34.50 32.11 2d9f s PRO 125 CO 0.52 -1.29 -0.18 -3.47 0.04 0.00 0.00 177.00 172.62 2d9f n ASP 126 N -2.54 2.03 -4.49 6.66 2.03 -1.26 -4.85 116.55 114.12 2d9f n ASP 126 Ca 0.10 0.05 -0.43 0.00 0.52 0.00 0.00 54.79 55.04 2d9f n ASP 126 Cb 0.52 -0.37 -0.03 0.00 -0.72 0.00 0.00 41.12 40.52 2d9f n ASP 126 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 2d9f s LEU 127 N -6.40 4.25 -0.96 -2.67 2.96 -1.26 -4.93 118.68 109.68 2d9f s LEU 127 Ca -0.23 -1.47 -0.25 0.00 -0.22 0.00 0.00 54.13 51.96 2d9f s LEU 127 Cb 0.07 -2.47 -0.19 0.00 0.50 0.00 0.00 46.19 44.11 2d9f s LEU 127 CO 0.34 -1.36 1.95 -1.84 -1.32 0.00 0.00 176.35 174.12 2d9f n GLU 128 N 7.78 0.87 -3.96 1.98 0.00 -1.26 -4.81 120.64 121.25 2d9f n GLU 128 Ca 0.18 -1.95 -0.30 0.00 0.00 0.00 0.00 57.16 55.09 2d9f n GLU 128 Cb 0.49 -3.56 -0.14 0.00 0.00 0.00 0.00 31.44 28.23 2d9f n GLU 128 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.13 178.54 2d9f s MET 129 N 7.07 1.68 0.20 3.44 1.75 -1.26 -5.09 119.30 127.09 2d9f s MET 129 Ca 0.72 -2.21 -0.30 0.00 -1.25 0.00 0.00 55.69 52.64 2d9f s MET 129 Cb 0.02 -3.18 -0.09 0.00 2.84 0.00 0.00 34.83 34.42 2d9f s MET 129 CO 0.18 -1.03 1.42 -1.12 -0.65 0.00 0.00 175.02 173.81 2d9f s SER 130 N 0.33 6.74 0.00 1.11 0.01 -1.26 -4.98 113.70 115.65 2d9f s SER 130 Ca 0.14 2.53 0.00 0.00 1.31 0.00 0.00 55.95 59.93 2d9f s SER 130 Cb -0.23 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.40 2d9f s SER 130 CO -0.04 -0.67 0.00 0.61 0.41 0.00 0.00 173.24 173.55 2d9f n GLY 131 N 2.72 1.84 3.64 3.44 0.00 -1.26 -5.17 105.19 110.41 2d9f n GLY 131 Ca 0.09 -0.30 -0.29 0.00 0.00 0.00 0.00 46.02 45.51 2d9f n GLY 131 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2d9f s PRO 132 N -1.82 -0.25 0.02 1.61 0.04 -1.26 -5.05 135.00 128.29 2d9f s PRO 132 Ca 0.00 0.28 -0.05 0.00 0.04 0.00 0.00 61.00 61.27 2d9f s PRO 132 Cb 0.00 -1.68 -0.02 0.00 0.04 0.00 0.00 34.50 32.84 2d9f s PRO 132 CO 0.00 -3.14 -0.10 0.45 0.04 0.00 0.00 177.00 174.26 2d9f n SER 133 N -4.42 1.34 -4.68 6.66 2.88 -1.26 -5.10 113.62 109.05 2d9f n SER 133 Ca 0.08 0.19 -0.26 0.00 -1.33 0.00 0.00 58.87 57.55 2d9f n SER 133 Cb 0.58 -0.45 -0.09 0.00 -0.75 0.00 0.00 64.21 63.50 2d9f n SER 133 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2d9f s SER 134 N -5.97 4.15 0.00 -3.46 1.04 -1.26 -5.37 113.70 102.83 2d9f s SER 134 Ca -0.08 -1.24 0.00 0.00 0.48 0.00 0.00 55.95 55.11 2d9f s SER 134 Cb 0.01 -0.41 0.00 0.00 0.10 0.00 0.00 66.02 65.72 2d9f s SER 134 CO 0.12 -0.51 0.00 0.61 0.98 0.00 0.00 173.24 174.44