#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 1.12 -3.68 1.61 7.64 -1.26 -5.03 113.62 114.03 2d9f n SER 2 Ca 0.00 0.14 -0.25 0.00 1.01 0.00 0.00 58.87 59.77 2d9f n SER 2 Cb 0.00 -0.36 0.06 0.00 -1.01 0.00 0.00 64.21 62.90 2d9f n SER 2 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2d9f n SER 3 N -3.51 -4.99 -4.37 6.43 2.88 -1.26 -4.99 113.62 103.80 2d9f n SER 3 Ca -0.25 -0.64 -0.21 0.00 -1.33 0.00 0.00 58.87 56.44 2d9f n SER 3 Cb 0.69 -4.65 -0.11 0.00 -0.75 0.00 0.00 64.21 59.39 2d9f n SER 3 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2d9f s GLY 4 N -3.53 1.54 -0.23 0.46 0.00 -1.26 -5.15 107.32 99.14 2d9f s GLY 4 Ca 0.49 -1.65 -0.26 0.00 0.00 0.00 0.00 44.72 43.30 2d9f s GLY 4 CO 0.76 -1.72 0.73 -0.45 0.00 0.00 0.00 173.10 172.42 2d9f s SER 5 N -3.09 -0.72 -0.18 1.64 0.15 -1.26 -5.15 113.70 105.09 2d9f s SER 5 Ca 0.22 1.29 -0.03 0.00 0.70 0.00 0.00 55.95 58.13 2d9f s SER 5 Cb -0.04 1.28 -0.02 0.00 -1.71 0.00 0.00 66.02 65.53 2d9f s SER 5 CO 0.09 -0.31 -0.05 -0.55 1.20 0.00 0.00 173.24 173.62 2d9f s SER 6 N 0.10 4.50 0.00 5.45 0.15 -1.26 -4.94 113.70 117.70 2d9f s SER 6 Ca -0.02 -0.26 0.00 0.00 0.70 0.00 0.00 55.95 56.38 2d9f s SER 6 Cb -0.04 -1.74 0.00 0.00 -1.71 0.00 0.00 66.02 62.53 2d9f s SER 6 CO 0.02 0.10 0.00 0.61 1.20 0.00 0.00 173.24 175.17 2d9f n GLY 7 N 4.02 1.46 2.05 9.45 0.00 -1.26 -4.95 105.19 115.96 2d9f n GLY 7 Ca -0.18 -0.86 -0.17 0.00 0.00 0.00 0.00 46.02 44.81 2d9f n GLY 7 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2d9f n GLU 8 N 1.00 1.92 -1.91 1.61 0.28 -1.26 -4.90 120.64 117.39 2d9f n GLU 8 Ca 0.00 -1.54 -0.09 0.00 -0.16 0.00 0.00 57.16 55.36 2d9f n GLU 8 Cb 0.00 -1.76 0.03 0.00 1.43 0.00 0.00 31.44 31.14 2d9f n GLU 8 CO 0.00 0.00 0.00 -0.85 -0.16 0.00 0.00 177.13 176.12 2d9f n GLU 9 N 0.97 0.77 -0.95 3.44 0.28 -1.26 -5.07 120.64 118.82 2d9f n GLU 9 Ca 0.34 -1.47 -0.37 0.00 -0.16 0.00 0.00 57.16 55.50 2d9f n GLU 9 Cb 0.61 -0.13 0.06 0.00 1.43 0.00 0.00 31.44 33.40 2d9f n GLU 9 CO 0.00 0.00 0.00 0.91 -0.16 0.00 0.00 177.13 177.88 2d9f n TRP 10 N -1.64 -2.74 -3.83 -1.84 7.02 -1.26 -4.93 117.44 108.22 2d9f n TRP 10 Ca 0.08 0.32 -0.35 0.00 -1.02 0.00 0.00 57.50 56.53 2d9f n TRP 10 Cb 0.29 -1.45 -0.08 0.00 -2.42 0.00 0.00 31.31 27.64 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 6.17 4.09 -0.64 -0.99 0.20 -0.91 -4.93 118.68 121.67 2d9f s LEU 11 Ca 0.41 0.19 -0.25 0.00 0.69 0.00 0.00 54.13 55.18 2d9f s LEU 11 Cb -0.05 -2.05 0.04 0.00 -0.43 0.00 0.00 46.19 43.71 2d9f s LEU 11 CO 0.72 0.19 1.09 1.51 -0.29 0.00 0.00 176.35 179.58 2d9f s ASP 12 N 0.28 6.27 0.12 3.68 1.47 -1.26 -2.09 116.67 125.13 2d9f s ASP 12 Ca 0.07 -0.45 -0.10 0.00 1.18 0.00 0.00 52.55 53.25 2d9f s ASP 12 Cb -0.11 -2.49 -0.11 0.00 -0.34 0.00 0.00 42.92 39.87 2d9f s ASP 12 CO -0.01 -1.50 1.34 0.40 0.68 0.00 0.00 175.17 176.08 2d9f h ILE 13 N 6.04 1.29 0.00 2.11 2.04 -1.93 -3.33 117.51 123.73 2d9f h ILE 13 Ca -0.27 -1.98 -0.36 0.00 1.00 0.00 0.00 64.86 63.24 2d9f h ILE 13 Cb 1.06 1.98 -0.07 0.00 -0.74 0.00 0.00 36.82 39.05 2d9f h ILE 13 CO 1.18 0.63 -2.31 0.18 0.00 0.00 0.00 178.15 177.83 2d9f n LEU 14 N -3.92 0.23 0.00 1.44 4.77 -1.26 -5.01 117.00 113.24 2d9f n LEU 14 Ca -0.07 0.04 0.00 0.00 -0.03 0.00 0.00 56.01 55.96 2d9f n LEU 14 Cb 0.73 0.40 0.00 0.00 -2.33 0.00 0.00 43.42 42.22 2d9f n LEU 14 CO 0.52 0.51 0.00 0.61 -1.33 0.00 0.00 177.39 177.69 2d9f n GLY 15 N 1.75 2.72 0.25 -0.72 0.00 -1.25 -4.92 105.19 103.03 2d9f n GLY 15 Ca -0.32 -0.65 -0.14 0.00 0.00 0.00 0.00 46.02 44.91 2d9f n GLY 15 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2d9f h ASN 16 N 0.78 -0.56 0.00 1.61 2.35 -1.93 -3.47 115.58 114.35 2d9f h ASN 16 Ca 0.00 0.05 0.00 0.00 -0.55 0.00 0.00 56.30 55.80 2d9f h ASN 16 Cb 0.00 0.19 0.00 0.00 0.05 0.00 0.00 38.32 38.56 2d9f h ASN 16 CO 0.00 -0.33 0.00 0.61 -1.65 0.00 0.00 177.43 176.06 2d9f n GLY 17 N -1.34 1.00 0.03 2.83 0.00 -1.26 -5.04 105.19 101.40 2d9f n GLY 17 Ca -0.09 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.06 -9.26 0.99 -0.00 -1.91 -3.42 115.31 101.65 2d9f h LEU 18 Ca 0.00 0.00 -0.56 0.00 -0.00 0.00 0.00 57.88 57.32 2d9f h LEU 18 Cb 0.00 0.02 -0.03 0.00 -0.00 0.00 0.00 40.66 40.65 2d9f h LEU 18 CO 0.00 -0.04 0.73 -0.22 -0.00 0.00 0.00 178.44 178.92 2d9f s LEU 19 N -4.36 4.24 0.10 1.67 2.96 -1.26 -3.73 118.68 118.31 2d9f s LEU 19 Ca -0.01 1.73 0.04 0.00 -0.22 0.00 0.00 54.13 55.67 2d9f s LEU 19 Cb 0.00 -3.55 -0.04 0.00 0.50 0.00 0.00 46.19 43.10 2d9f s LEU 19 CO 0.03 -0.61 -0.11 -0.13 -1.32 0.00 0.00 176.35 174.21 2d9f s ARG 20 N 2.53 0.88 -0.04 1.98 0.52 -1.17 -3.39 118.95 120.26 2d9f s ARG 20 Ca 0.54 -1.15 0.04 0.00 -0.52 0.00 0.00 55.73 54.64 2d9f s ARG 20 Cb -0.23 -0.65 -0.00 0.00 0.52 0.00 0.00 34.95 34.59 2d9f s ARG 20 CO 0.19 0.11 -0.15 0.21 0.02 0.00 0.00 175.30 175.69 2d9f s LYS 21 N -2.63 1.55 -0.20 3.54 2.20 -0.89 -2.59 119.74 120.73 2d9f s LYS 21 Ca 0.05 -0.52 -0.03 0.00 -0.36 0.00 0.00 55.97 55.11 2d9f s LYS 21 Cb -0.04 -1.37 0.06 0.00 -1.51 0.00 0.00 37.83 34.98 2d9f s LYS 21 CO 0.01 0.20 0.06 0.21 -0.36 0.00 0.00 175.35 175.47 2d9f s LYS 22 N 0.09 0.46 -0.49 4.03 2.20 0.29 -2.15 119.74 124.18 2d9f s LYS 22 Ca -0.04 -0.36 -0.27 0.00 -0.36 0.00 0.00 55.97 54.95 2d9f s LYS 22 Cb -0.11 -1.98 -0.03 0.00 -1.51 0.00 0.00 37.83 34.20 2d9f s LYS 22 CO 0.02 -0.68 1.99 0.99 -0.36 0.00 0.00 175.35 177.31 2d9f s THR 23 N 1.94 3.28 0.03 3.43 2.01 -1.26 -0.67 115.64 124.40 2d9f s THR 23 Ca 0.01 0.21 -0.17 0.00 0.31 0.00 0.00 61.69 62.05 2d9f s THR 23 Cb -0.17 -3.60 -0.26 0.00 0.01 0.00 0.00 72.50 68.48 2d9f s THR 23 CO -0.10 -0.53 1.10 -0.07 -0.69 0.00 0.00 174.62 174.33 2d9f h LEU 24 N 16.44 0.73 -6.70 4.42 3.38 -0.37 -3.44 115.31 129.77 2d9f h LEU 24 Ca -0.28 -0.79 -0.32 0.00 0.09 0.00 0.00 57.88 56.57 2d9f h LEU 24 Cb 1.19 -0.23 -0.35 0.00 0.09 0.00 0.00 40.66 41.36 2d9f h LEU 24 CO 1.14 1.44 -0.63 -0.69 0.09 0.00 0.00 178.44 179.80 2d9f s VAL 25 N -3.09 -0.34 0.42 1.22 1.01 0.11 -4.96 120.40 114.76 2d9f s VAL 25 Ca -0.11 -0.24 -0.25 0.00 0.00 0.00 0.00 61.98 61.38 2d9f s VAL 25 Cb 0.05 -0.78 -0.08 0.00 0.00 0.00 0.00 36.38 35.57 2d9f s VAL 25 CO 0.88 -0.30 1.18 -2.16 0.00 0.00 0.00 175.10 174.71 2d9f s PRO 26 N 2.33 3.95 0.85 2.72 0.04 -1.26 0.33 135.00 143.96 2d9f s PRO 26 Ca 0.08 1.85 -0.12 0.00 0.04 0.00 0.00 61.00 62.85 2d9f s PRO 26 Cb -0.15 -2.60 0.19 0.00 0.04 0.00 0.00 34.50 31.98 2d9f s PRO 26 CO -0.19 -0.41 1.16 0.41 0.04 0.00 0.00 177.00 178.01 2d9f n GLY 27 N 0.58 -1.01 3.73 0.56 0.00 -1.26 -4.83 105.19 102.97 2d9f n GLY 27 Ca 0.05 -1.78 -0.30 0.00 0.00 0.00 0.00 46.02 43.99 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 -5.52 1.57 0.00 1.61 0.04 -1.26 -4.91 135.00 126.53 2d9f s PRO 28 Ca 0.68 0.93 0.15 0.00 0.04 0.00 0.00 61.00 62.80 2d9f s PRO 28 Cb -0.02 -1.84 0.77 0.00 0.04 0.00 0.00 34.50 33.45 2d9f s PRO 28 CO 0.47 -2.05 1.40 -0.35 0.04 0.00 0.00 177.00 176.51 2d9f n PRO 29 N -3.77 0.24 -0.03 0.56 -0.04 -1.26 -2.81 135.00 127.89 2d9f n PRO 29 Ca 0.08 0.13 -0.18 0.00 -0.04 0.00 0.00 63.50 63.49 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 0.41 -0.04 0.00 0.00 175.50 175.87 2d9f n GLY 30 N -0.03 -0.62 3.31 0.55 0.00 -1.26 -4.96 105.19 102.18 2d9f n GLY 30 Ca 0.08 -0.23 -0.29 0.00 0.00 0.00 0.00 46.02 45.58 2d9f n GLY 30 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2d9f n SER 31 N -3.34 -2.49 -3.64 1.61 3.41 -1.12 -5.06 113.62 103.00 2d9f n SER 31 Ca -0.32 -0.28 -0.08 0.00 -0.26 0.00 0.00 58.87 57.93 2d9f n SER 31 Cb 1.05 -1.05 -0.07 0.00 -0.26 0.00 0.00 64.21 63.88 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 -2.20 -0.59 0.17 4.04 1.04 -1.26 -4.91 113.70 109.98 2d9f s SER 32 Ca 0.60 1.05 -0.24 0.00 0.48 0.00 0.00 55.95 57.84 2d9f s SER 32 Cb -0.16 1.14 -0.15 0.00 0.10 0.00 0.00 66.02 66.95 2d9f s SER 32 CO 0.62 -0.17 0.45 0.54 0.98 0.00 0.00 173.24 175.66 2d9f n ARG 33 N 3.00 0.00 0.00 4.02 1.74 -1.26 -3.95 116.66 120.21 2d9f n ARG 33 Ca -0.15 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.93 2d9f n ARG 33 Cb 0.57 -0.86 0.00 0.00 -1.02 0.00 0.00 32.46 31.14 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 0.86 -0.79 -4.35 5.56 -0.04 -1.26 -4.91 135.00 130.07 2d9f n PRO 34 Ca 0.15 0.00 -0.26 0.00 -0.04 0.00 0.00 63.50 63.35 2d9f n PRO 34 Cb 0.21 0.00 -0.10 0.00 -0.04 0.00 0.00 33.50 33.57 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 -0.88 2.91 -0.32 0.52 0.11 -1.26 -5.01 120.40 116.47 2d9f s VAL 35 Ca 0.00 -1.86 -0.23 0.00 -2.93 0.00 0.00 61.98 56.96 2d9f s VAL 35 Cb 0.00 -2.45 0.00 0.00 -1.53 0.00 0.00 36.38 32.40 2d9f s VAL 35 CO 0.00 -0.17 0.77 -0.75 -3.33 0.00 0.00 175.10 171.62 2d9f s LYS 36 N -2.94 3.91 0.00 1.54 2.20 -1.26 -3.80 119.74 119.39 2d9f s LYS 36 Ca 0.25 0.49 0.00 0.00 -0.36 0.00 0.00 55.97 56.35 2d9f s LYS 36 Cb -0.08 -3.74 0.00 0.00 -1.51 0.00 0.00 37.83 32.50 2d9f s LYS 36 CO 0.14 -0.70 0.00 0.41 -0.36 0.00 0.00 175.35 174.84 2d9f n GLY 37 N 4.30 1.39 3.68 5.54 0.00 -0.35 -4.95 105.19 114.80 2d9f n GLY 37 Ca 0.03 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.10 2.18 -0.62 1.61 -0.21 -1.25 -4.86 119.66 116.41 2d9f s GLN 38 Ca 0.00 -1.74 -0.28 0.00 0.02 0.00 0.00 55.36 53.36 2d9f s GLN 38 Cb 0.00 -1.99 0.03 0.00 1.00 0.00 0.00 33.01 32.05 2d9f s GLN 38 CO 0.00 0.05 1.22 0.08 -2.12 0.00 0.00 175.29 174.52 2d9f s VAL 39 N -2.53 3.93 -0.19 1.09 1.01 0.42 -3.17 120.40 120.96 2d9f s VAL 39 Ca 0.37 0.78 -0.09 0.00 0.00 0.00 0.00 61.98 63.03 2d9f s VAL 39 Cb 0.01 -4.77 -0.05 0.00 0.00 0.00 0.00 36.38 31.57 2d9f s VAL 39 CO 0.21 -1.47 0.12 0.68 0.00 0.00 0.00 175.10 174.64 2d9f s VAL 40 N 5.19 5.35 -0.25 2.92 -7.23 -0.95 -1.62 120.40 123.80 2d9f s VAL 40 Ca 0.41 0.16 -0.02 0.00 -1.81 0.00 0.00 61.98 60.72 2d9f s VAL 40 Cb -0.08 -3.43 0.02 0.00 0.56 0.00 0.00 36.38 33.46 2d9f s VAL 40 CO 0.23 0.46 -0.04 -0.89 -0.31 0.00 0.00 175.10 174.55 2d9f s THR 41 N 0.22 3.03 0.37 5.32 2.01 -0.69 -2.71 115.64 123.19 2d9f s THR 41 Ca 0.08 -0.95 0.05 0.00 0.31 0.00 0.00 61.69 61.18 2d9f s THR 41 Cb -0.11 -2.53 -0.02 0.00 0.01 0.00 0.00 72.50 69.85 2d9f s THR 41 CO -0.01 0.20 0.16 1.33 -0.69 0.00 0.00 174.62 175.61 2d9f n VAL 42 N 4.70 0.00 -4.01 3.82 0.24 0.43 -1.92 118.33 121.59 2d9f n VAL 42 Ca -0.16 -2.24 -0.31 0.00 -2.04 0.00 0.00 64.34 59.59 2d9f n VAL 42 Cb 0.47 0.87 -0.15 0.00 -1.47 0.00 0.00 33.84 33.57 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 -3.05 3.70 -0.14 6.34 2.46 -1.17 -0.70 115.29 122.72 2d9f s HIS 43 Ca 0.23 -2.96 -0.09 0.00 0.47 0.00 0.00 55.06 52.71 2d9f s HIS 43 Cb 0.01 -2.87 -0.05 0.00 -0.13 0.00 0.00 32.58 29.55 2d9f s HIS 43 CO 0.16 -0.95 0.17 -1.17 -2.47 0.00 0.00 174.74 170.49 2d9f s LEU 44 N 0.93 4.32 -0.17 8.88 1.98 -0.84 -4.00 118.68 129.77 2d9f s LEU 44 Ca 0.10 0.43 -0.01 0.00 -2.89 0.00 0.00 54.13 51.76 2d9f s LEU 44 Cb -0.19 -2.15 0.05 0.00 0.66 0.00 0.00 46.19 44.56 2d9f s LEU 44 CO -0.08 0.30 -0.01 -1.10 -1.89 0.00 0.00 176.35 173.57 2d9f s GLN 45 N -0.44 1.02 -0.04 1.98 -0.21 -1.26 -0.11 119.66 120.61 2d9f s GLN 45 Ca 0.14 -0.44 -0.25 0.00 0.02 0.00 0.00 55.36 54.82 2d9f s GLN 45 Cb -0.12 -1.97 -0.04 0.00 1.00 0.00 0.00 33.01 31.88 2d9f s GLN 45 CO 0.03 -0.52 0.77 0.99 -2.12 0.00 0.00 175.29 174.44 2d9f s THR 46 N 1.75 4.98 -0.14 -0.19 2.01 0.92 -3.69 115.64 121.28 2d9f s THR 46 Ca -0.00 1.59 -0.12 0.00 0.31 0.00 0.00 61.69 63.47 2d9f s THR 46 Cb -0.16 -4.11 0.04 0.00 0.01 0.00 0.00 72.50 68.28 2d9f s THR 46 CO -0.07 0.24 0.36 -0.94 -0.69 0.00 0.00 174.62 173.52 2d9f s SER 47 N 0.77 -0.39 0.58 3.53 1.04 -0.92 -1.27 113.70 117.05 2d9f s SER 47 Ca 0.41 0.74 -0.20 0.00 0.48 0.00 0.00 55.95 57.38 2d9f s SER 47 Cb -0.19 0.73 -0.04 0.00 0.10 0.00 0.00 66.02 66.63 2d9f s SER 47 CO 0.21 -0.13 1.28 -0.76 0.98 0.00 0.00 173.24 174.81 2d9f s LEU 48 N 0.32 3.73 0.45 2.42 2.01 -1.03 0.12 118.68 126.71 2d9f s LEU 48 Ca -0.01 2.58 0.26 0.00 0.01 0.00 0.00 54.13 56.97 2d9f s LEU 48 Cb -0.03 -4.47 1.30 0.00 0.01 0.00 0.00 46.19 43.00 2d9f s LEU 48 CO -0.01 -1.66 1.76 -0.08 1.01 0.00 0.00 176.35 177.37 2d9f h GLU 49 N 1.07 0.21 -0.09 1.70 4.81 -1.93 0.14 114.58 120.49 2d9f h GLU 49 Ca -0.51 -0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 58.66 2d9f h GLU 49 Cb 1.31 -0.05 -0.00 0.00 0.63 0.00 0.00 28.75 30.64 2d9f h GLU 49 CO 0.56 0.14 -0.15 -0.91 -0.73 0.00 0.00 179.01 177.91 2d9f h ASN 50 N 0.22 0.29 0.00 1.04 2.35 -1.93 -3.48 115.58 114.08 2d9f h ASN 50 Ca 0.62 -0.54 0.00 0.00 -0.55 0.00 0.00 56.30 55.83 2d9f h ASN 50 Cb 1.94 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 40.23 2d9f h ASN 50 CO -0.22 0.78 0.00 0.61 -1.65 0.00 0.00 177.43 176.95 2d9f n GLY 51 N 0.38 0.14 3.09 2.83 0.00 0.49 -5.11 105.19 107.01 2d9f n GLY 51 Ca -0.07 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.23 3.78 -0.11 2.61 2.01 -1.24 -4.86 115.64 117.60 2d9f s THR 52 Ca 0.00 -3.19 -0.38 0.00 0.31 0.00 0.00 61.69 58.43 2d9f s THR 52 Cb 0.00 -3.44 -0.15 0.00 0.01 0.00 0.00 72.50 68.92 2d9f s THR 52 CO 0.00 -0.92 1.65 0.54 -0.69 0.00 0.00 174.62 175.20 2d9f n ARG 53 N 3.20 1.42 -0.10 4.92 1.74 -1.26 -2.46 116.66 124.11 2d9f n ARG 53 Ca 0.11 0.52 -0.23 0.00 -0.77 0.00 0.00 57.85 57.47 2d9f n ARG 53 Cb 0.37 -2.23 -0.12 0.00 -1.02 0.00 0.00 32.46 29.47 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 4.05 1.57 -3.71 1.55 0.31 -0.40 -4.93 118.33 116.77 2d9f n VAL 54 Ca 0.23 -0.43 -0.13 0.00 -0.01 0.00 0.00 64.34 63.99 2d9f n VAL 54 Cb 0.19 -1.74 -0.09 0.00 -0.91 0.00 0.00 33.84 31.29 2d9f n VAL 54 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2d9f s GLN 55 N -2.50 0.57 -0.11 5.55 1.03 -1.17 -5.00 119.66 118.03 2d9f s GLN 55 Ca -0.33 0.67 0.02 0.00 0.04 0.00 0.00 55.36 55.76 2d9f s GLN 55 Cb 0.10 0.28 0.01 0.00 0.03 0.00 0.00 33.01 33.43 2d9f s GLN 55 CO 0.60 -0.07 -0.18 -2.00 -2.54 0.00 0.00 175.29 171.10 2d9f s GLU 56 N 0.23 2.46 -0.36 9.60 -6.30 -1.26 -0.06 118.70 123.01 2d9f s GLU 56 Ca -0.00 -0.66 -0.01 0.00 -2.50 0.00 0.00 54.97 51.80 2d9f s GLU 56 Cb -0.03 -2.01 0.09 0.00 0.00 0.00 0.00 34.13 32.18 2d9f s GLU 56 CO 0.01 0.01 0.11 -2.00 0.02 0.00 0.00 175.26 173.40 2d9f s GLU 57 N 0.79 1.96 0.03 4.30 2.56 0.85 -4.98 118.70 124.21 2d9f s GLU 57 Ca -0.10 -1.70 -0.21 0.00 0.00 0.00 0.00 54.97 52.95 2d9f s GLU 57 Cb -0.16 -3.37 -0.15 0.00 2.00 0.00 0.00 34.13 32.45 2d9f s GLU 57 CO 0.01 -0.92 1.33 -1.00 -0.56 0.00 0.00 175.26 174.12 2d9f h PRO 58 N 7.91 0.29 -2.72 4.30 0.13 -1.87 -2.25 132.00 137.78 2d9f h PRO 58 Ca -0.13 -0.15 -0.67 0.00 -0.87 0.00 0.00 66.00 64.19 2d9f h PRO 58 Cb 1.04 0.00 -0.38 0.00 0.13 0.00 0.00 31.00 31.80 2d9f h PRO 58 CO 0.61 0.69 -0.19 -1.91 -0.23 0.00 0.00 178.00 176.97 2d9f n GLU 59 N -4.62 2.88 -2.90 0.86 2.13 -1.26 -4.30 120.64 113.42 2d9f n GLU 59 Ca -0.07 -4.58 -0.42 0.00 0.66 0.00 0.00 57.16 52.75 2d9f n GLU 59 Cb 0.34 -2.35 -0.04 0.00 0.27 0.00 0.00 31.44 29.65 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 -2.16 4.08 0.05 4.31 1.98 0.12 -4.94 118.68 122.11 2d9f s LEU 60 Ca 0.33 1.02 0.07 0.00 -2.89 0.00 0.00 54.13 52.66 2d9f s LEU 60 Cb 0.05 -3.17 -0.02 0.00 0.66 0.00 0.00 46.19 43.71 2d9f s LEU 60 CO -0.03 -0.51 -0.19 0.54 -1.89 0.00 0.00 176.35 174.27 2d9f s VAL 61 N 2.81 1.53 0.18 1.68 0.11 -1.26 -0.42 120.40 125.02 2d9f s VAL 61 Ca 0.34 -1.17 -0.23 0.00 -2.93 0.00 0.00 61.98 57.99 2d9f s VAL 61 Cb -0.15 -1.34 0.07 0.00 -1.53 0.00 0.00 36.38 33.42 2d9f s VAL 61 CO 0.07 0.14 0.98 0.72 -3.33 0.00 0.00 175.10 173.68 2d9f s PHE 62 N -0.84 -0.03 -0.53 1.54 -0.12 -1.10 -5.01 117.98 111.89 2d9f s PHE 62 Ca 0.06 -0.33 -0.10 0.00 -0.05 0.00 0.00 56.93 56.50 2d9f s PHE 62 Cb -0.09 0.68 0.13 0.00 -0.63 0.00 0.00 43.02 43.11 2d9f s PHE 62 CO 0.02 -0.91 0.42 0.99 -0.05 0.00 0.00 175.22 175.68 2d9f s THR 63 N -2.78 4.45 0.13 -4.49 2.01 -1.26 -2.23 115.64 111.47 2d9f s THR 63 Ca 0.16 -1.90 -0.34 0.00 0.31 0.00 0.00 61.69 59.92 2d9f s THR 63 Cb -0.02 -3.90 -0.16 0.00 0.01 0.00 0.00 72.50 68.43 2d9f s THR 63 CO 0.04 -0.82 1.18 -0.11 -0.69 0.00 0.00 174.62 174.22 2d9f n LEU 64 N 4.76 1.31 0.00 4.42 7.94 -1.19 -2.05 117.00 132.20 2d9f n LEU 64 Ca -0.06 1.14 0.00 0.00 -1.11 0.00 0.00 56.01 55.98 2d9f n LEU 64 Cb 0.41 -1.17 0.00 0.00 0.53 0.00 0.00 43.42 43.19 2d9f n LEU 64 CO 0.43 -1.35 0.00 0.61 -1.11 0.00 0.00 177.39 175.97 2d9f n GLY 65 N 2.11 2.51 0.06 -3.96 0.00 -1.26 -1.21 105.19 103.44 2d9f n GLY 65 Ca 0.17 -0.67 0.13 0.00 0.00 0.00 0.00 46.02 45.65 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 0.27 0.56 -3.67 1.61 -0.08 -0.87 -4.94 116.55 109.43 2d9f n ASP 66 Ca 0.00 0.32 -0.24 0.00 -1.51 0.00 0.00 54.79 53.36 2d9f n ASP 66 Cb 0.00 -0.33 0.06 0.00 2.34 0.00 0.00 41.12 43.19 2d9f n ASP 66 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2d9f h ASP 68 N -2.26 0.00 -5.93 0.00 3.58 -1.92 -3.45 116.42 106.44 2d9f h ASP 68 Ca -0.58 0.00 -0.40 0.00 0.42 0.00 0.00 57.03 56.47 2d9f h ASP 68 Cb 1.36 0.00 0.01 0.00 1.72 0.00 0.00 39.33 42.43 2d9f h ASP 68 CO 0.58 0.23 -0.08 1.33 -2.88 0.00 0.00 179.24 178.42 2d9f n VAL 69 N -3.34 0.00 -1.51 2.25 0.24 -1.26 -5.06 118.33 109.65 2d9f n VAL 69 Ca 0.01 -1.57 -0.41 0.00 -2.04 0.00 0.00 64.34 60.32 2d9f n VAL 69 Cb 0.46 -0.52 0.01 0.00 -1.47 0.00 0.00 33.84 32.32 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 -1.92 2.13 0.44 1.34 2.08 -1.26 -4.73 119.36 117.44 2d9f n ILE 70 Ca 0.10 -0.50 0.09 0.00 0.56 0.00 0.00 62.75 63.00 2d9f n ILE 70 Cb 0.48 -0.77 0.38 0.00 -0.75 0.00 0.00 39.64 38.98 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 0.31 0.08 0.01 0.38 6.02 -0.96 -1.77 117.38 121.46 2d9f n GLN 71 Ca 0.11 0.34 0.11 0.00 -0.01 0.00 0.00 57.00 57.55 2d9f n GLN 71 Cb 0.40 -1.66 0.02 0.00 1.02 0.00 0.00 30.24 30.02 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 -1.62 3.91 -0.13 -1.58 0.00 -1.26 -3.41 120.51 116.43 2d9f n ALA 72 Ca 0.03 -0.47 -0.25 0.00 0.00 0.00 0.00 53.44 52.75 2d9f n ALA 72 Cb 0.19 -0.92 -0.11 0.00 0.00 0.00 0.00 19.45 18.60 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 2.38 0.11 0.00 7.94 -0.73 -4.01 117.00 120.99 2d9f n LEU 73 Ca 0.03 0.15 -0.02 0.00 -1.11 0.00 0.00 56.01 55.06 2d9f n LEU 73 Cb 0.38 -0.87 0.20 0.00 0.53 0.00 0.00 43.42 43.65 2d9f n LEU 73 CO 0.40 0.72 0.59 -0.78 -1.11 0.00 0.00 177.39 177.20 2d9f h ASP 74 N -0.57 0.20 0.09 1.96 1.82 -1.56 0.20 116.42 118.56 2d9f h ASP 74 Ca -0.63 -0.10 0.00 0.00 -0.39 0.00 0.00 57.03 55.91 2d9f h ASP 74 Cb 1.73 -0.06 0.00 0.00 0.68 0.00 0.00 39.33 41.68 2d9f h ASP 74 CO -0.27 0.66 -0.01 0.18 -1.61 0.00 0.00 179.24 178.20 2d9f n LEU 75 N -3.96 0.17 -0.02 2.28 4.32 -1.22 -3.62 117.00 114.95 2d9f n LEU 75 Ca -0.02 -0.01 -0.02 0.00 -0.02 0.00 0.00 56.01 55.94 2d9f n LEU 75 Cb 0.53 -0.05 -0.02 0.00 -1.62 0.00 0.00 43.42 42.26 2d9f n LEU 75 CO 0.42 0.03 -0.62 -1.54 -1.22 0.00 0.00 177.39 174.46 2d9f n SER 76 N -0.92 4.00 -0.13 -1.43 3.41 -0.93 -4.64 113.62 112.98 2d9f n SER 76 Ca 0.22 -0.01 -0.08 0.00 -0.26 0.00 0.00 58.87 58.74 2d9f n SER 76 Cb 0.16 0.36 -0.02 0.00 -0.26 0.00 0.00 64.21 64.45 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 0.22 0.00 -3.33 2.07 -0.67 0.51 116.25 115.04 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 0.22 0.00 0.00 -1.52 0.00 0.00 31.29 31.17 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 -1.98 135.00 128.14 2d9f n PRO 78 Ca 0.01 0.00 0.07 0.00 -0.04 0.00 0.00 63.50 63.54 2d9f n PRO 78 Cb 0.34 -1.34 0.17 0.00 -0.04 0.00 0.00 33.50 32.63 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 3.01 -3.85 1.53 4.77 0.18 -4.92 117.00 116.87 2d9f n LEU 79 Ca 0.08 -2.71 -0.12 0.00 -0.03 0.00 0.00 56.01 53.24 2d9f n LEU 79 Cb 0.04 -0.38 -0.12 0.00 -2.33 0.00 0.00 43.42 40.63 2d9f n LEU 79 CO 0.06 0.67 -0.21 0.00 -1.33 0.00 0.00 177.39 176.58 2d9f s MET 80 N -2.25 0.27 0.59 3.23 0.23 -0.84 -5.05 119.30 115.48 2d9f s MET 80 Ca 0.30 -0.04 -0.14 0.00 -1.03 0.00 0.00 55.69 54.77 2d9f s MET 80 Cb 0.24 0.12 -0.05 0.00 -1.53 0.00 0.00 34.83 33.60 2d9f s MET 80 CO 0.07 -0.05 1.02 -0.51 -2.03 0.00 0.00 175.02 173.53 2d9f s ASP 81 N -0.47 6.16 -0.12 -1.18 1.01 -1.26 -4.35 116.67 116.46 2d9f s ASP 81 Ca -0.06 1.59 -0.29 0.00 0.71 0.00 0.00 52.55 54.50 2d9f s ASP 81 Cb -0.04 -2.50 -0.05 0.00 1.01 0.00 0.00 42.92 41.34 2d9f s ASP 81 CO 0.01 -0.91 1.74 0.54 0.21 0.00 0.00 175.17 176.76 2d9f s VAL 82 N -2.81 3.48 0.00 -1.27 0.11 -1.25 -2.15 120.40 116.51 2d9f s VAL 82 Ca 0.59 0.56 0.00 0.00 -2.93 0.00 0.00 61.98 60.20 2d9f s VAL 82 Cb -0.12 -3.44 0.00 0.00 -1.53 0.00 0.00 36.38 31.29 2d9f s VAL 82 CO 0.42 -0.13 0.00 0.61 -3.33 0.00 0.00 175.10 172.67 2d9f n GLY 83 N 4.55 1.02 3.54 6.54 0.00 0.15 -4.65 105.19 116.33 2d9f n GLY 83 Ca 0.19 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.72 3.15 -0.34 1.61 2.12 -0.91 -4.17 118.70 119.45 2d9f s GLU 84 Ca 0.00 -0.54 -0.13 0.00 0.36 0.00 0.00 54.97 54.65 2d9f s GLU 84 Cb 0.00 -2.72 -0.02 0.00 0.26 0.00 0.00 34.13 31.65 2d9f s GLU 84 CO 0.00 0.47 0.26 0.99 -0.54 0.00 0.00 175.26 176.44 2d9f s THR 85 N -0.28 5.27 0.01 -1.70 2.01 0.15 -3.14 115.64 117.95 2d9f s THR 85 Ca 0.04 -0.14 0.05 0.00 0.31 0.00 0.00 61.69 61.96 2d9f s THR 85 Cb -0.13 -3.72 -0.02 0.00 0.01 0.00 0.00 72.50 68.64 2d9f s THR 85 CO 0.02 -0.01 -0.16 0.00 -0.69 0.00 0.00 174.62 173.78 2d9f s ALA 86 N 1.78 1.37 0.03 7.40 0.00 0.57 0.42 121.76 133.33 2d9f s ALA 86 Ca 0.07 -0.79 0.01 0.00 0.00 0.00 0.00 51.96 51.25 2d9f s ALA 86 Cb -0.17 -0.30 -0.04 0.00 0.00 0.00 0.00 23.12 22.61 2d9f s ALA 86 CO 0.11 0.31 0.07 1.41 0.00 0.00 0.00 175.76 177.66 2d9f s MET 87 N -0.71 2.96 -0.03 0.00 -2.45 0.15 -0.08 119.30 119.14 2d9f s MET 87 Ca 0.05 -0.58 0.04 0.00 -1.25 0.00 0.00 55.69 53.94 2d9f s MET 87 Cb -0.07 -2.78 -0.00 0.00 1.25 0.00 0.00 34.83 33.22 2d9f s MET 87 CO 0.00 0.61 -0.13 0.14 1.05 0.00 0.00 175.02 176.70 2d9f s VAL 88 N -1.27 1.05 -0.31 10.11 -7.23 0.06 -0.54 120.40 122.27 2d9f s VAL 88 Ca 0.25 -0.53 0.01 0.00 -1.81 0.00 0.00 61.98 59.90 2d9f s VAL 88 Cb -0.12 -0.91 0.10 0.00 0.56 0.00 0.00 36.38 36.01 2d9f s VAL 88 CO 0.17 0.31 0.08 0.42 -0.31 0.00 0.00 175.10 175.77 2d9f s THR 89 N -0.01 1.29 0.39 5.32 -4.23 -1.07 -2.17 115.64 115.18 2d9f s THR 89 Ca -0.01 -1.65 0.06 0.00 -1.18 0.00 0.00 61.69 58.92 2d9f s THR 89 Cb -0.08 -1.95 -0.08 0.00 1.34 0.00 0.00 72.50 71.73 2d9f s THR 89 CO 0.01 -0.63 0.02 0.00 -0.54 0.00 0.00 174.62 173.48 2d9f s ALA 90 N 1.41 2.99 0.46 3.99 0.00 -1.24 -3.04 121.76 126.33 2d9f s ALA 90 Ca 0.09 -2.25 -0.21 0.00 0.00 0.00 0.00 51.96 49.59 2d9f s ALA 90 Cb -0.18 0.28 -0.09 0.00 0.00 0.00 0.00 23.12 23.13 2d9f s ALA 90 CO -0.19 -0.16 1.04 0.34 0.00 0.00 0.00 175.76 176.79 2d9f s ASP 91 N -3.66 6.45 0.50 0.00 2.15 -1.26 -3.61 116.67 117.25 2d9f s ASP 91 Ca 0.35 1.97 0.40 0.00 0.43 0.00 0.00 52.55 55.70 2d9f s ASP 91 Cb 0.10 -2.57 1.58 0.00 -0.30 0.00 0.00 42.92 41.73 2d9f s ASP 91 CO 0.17 -0.71 1.62 -1.28 -0.17 0.00 0.00 175.17 174.81 2d9f h SER 92 N 1.83 0.11 -0.84 -0.34 0.87 -1.88 0.60 113.55 113.90 2d9f h SER 92 Ca -0.49 0.06 0.17 0.00 -1.23 0.00 0.00 61.79 60.30 2d9f h SER 92 Cb 1.22 0.06 -0.10 0.00 -0.44 0.00 0.00 62.40 63.13 2d9f h SER 92 CO 0.60 -0.08 0.38 0.07 -0.53 0.00 0.00 176.83 177.27 2d9f h LYS 93 N 0.04 0.49 0.00 2.24 2.10 -1.90 0.59 116.57 120.12 2d9f h LYS 93 Ca 0.84 -0.03 -0.03 0.00 -2.00 0.00 0.00 60.65 59.44 2d9f h LYS 93 Cb 3.06 -0.11 -0.00 0.00 -0.90 0.00 0.00 32.23 34.27 2d9f h LYS 93 CO -0.19 0.32 -0.46 1.88 -2.00 0.00 0.00 179.45 179.01 2d9f h TYR 94 N 0.51 0.00 0.01 0.07 0.05 -0.14 -3.26 116.97 114.22 2d9f h TYR 94 Ca 0.48 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 59.26 2d9f h TYR 94 Cb 0.77 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.51 2d9f h TYR 94 CO -0.13 0.11 -0.01 0.00 -1.05 0.00 0.00 178.16 177.08 2d9f n TYR 96 N -2.52 0.00 0.00 0.00 4.02 0.13 -4.63 117.16 114.17 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 2.36 3.78 0.00 2.72 0.00 0.16 -4.74 105.19 109.47 2d9f n GLY 97 Ca 0.00 -1.75 0.07 0.00 0.00 0.00 0.00 46.02 44.33 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 -1.48 0.49 -0.07 1.61 -0.04 -1.26 -2.21 135.00 132.03 2d9f n PRO 98 Ca 0.00 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.42 2d9f n PRO 98 Cb 0.00 -1.43 -0.16 0.00 -0.04 0.00 0.00 33.50 31.87 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 -0.93 0.77 0.00 0.54 10.64 -1.26 -4.50 117.38 122.64 2d9f n GLN 99 Ca 0.10 -0.06 0.00 0.00 -1.83 0.00 0.00 57.00 55.21 2d9f n GLN 99 Cb 0.05 -1.50 0.00 0.00 -0.86 0.00 0.00 30.24 27.93 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 1.67 1.25 3.83 2.61 0.00 -0.94 -4.64 105.19 108.97 2d9f n GLY 100 Ca -0.25 -2.14 -0.24 0.00 0.00 0.00 0.00 46.02 43.40 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 0.00 4.71 -0.17 1.61 0.15 -0.72 -4.71 113.70 114.56 2d9f s SER 101 Ca 0.00 -1.00 -0.03 0.00 0.70 0.00 0.00 55.95 55.61 2d9f s SER 101 Cb 0.00 -0.27 -0.09 0.00 -1.71 0.00 0.00 66.02 63.95 2d9f s SER 101 CO 0.00 -0.74 -0.18 -1.14 1.20 0.00 0.00 173.24 172.38 2d9f n ARG 102 N -1.49 0.40 -3.15 5.44 3.00 -1.26 -3.77 116.66 115.83 2d9f n ARG 102 Ca 0.00 0.13 0.05 0.00 -0.00 0.00 0.00 57.85 58.03 2d9f n ARG 102 Cb 0.63 -1.24 -0.01 0.00 0.00 0.00 0.00 32.46 31.84 2d9f n ARG 102 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.63 176.51 2d9f s SER 103 N -6.06 -0.63 0.15 6.15 0.01 -1.26 -3.32 113.70 108.74 2d9f s SER 103 Ca -0.23 0.34 -0.31 0.00 1.31 0.00 0.00 55.95 57.06 2d9f s SER 103 Cb 0.07 1.51 -0.08 0.00 0.21 0.00 0.00 66.02 67.73 2d9f s SER 103 CO 0.35 -0.12 1.34 -2.16 0.41 0.00 0.00 173.24 173.06 2d9f s PRO 104 N 2.94 4.36 0.35 12.44 0.04 -1.26 -5.12 135.00 148.74 2d9f s PRO 104 Ca 0.06 2.04 -0.28 0.00 0.04 0.00 0.00 61.00 62.86 2d9f s PRO 104 Cb -0.10 -3.23 -0.09 0.00 0.04 0.00 0.00 34.50 31.11 2d9f s PRO 104 CO -0.14 -0.34 1.23 -0.47 0.04 0.00 0.00 177.00 177.31 2d9f s TYR 105 N 0.66 3.13 -0.01 0.56 6.14 -1.21 -4.66 117.35 121.96 2d9f s TYR 105 Ca 0.61 1.51 -0.01 0.00 0.64 0.00 0.00 57.07 59.81 2d9f s TYR 105 Cb -0.36 -3.52 0.00 0.00 0.42 0.00 0.00 41.96 38.50 2d9f s TYR 105 CO 0.34 -1.49 0.03 0.96 0.64 0.00 0.00 175.55 176.03 2d9f s ILE 106 N -1.23 0.01 0.45 3.14 -5.25 -1.25 -4.83 121.20 112.24 2d9f s ILE 106 Ca 0.51 -0.11 -0.23 0.00 -0.99 0.00 0.00 60.65 59.83 2d9f s ILE 106 Cb -0.36 -0.09 -0.08 0.00 2.95 0.00 0.00 42.46 44.89 2d9f s ILE 106 CO 0.46 -0.06 1.17 -2.16 -1.79 0.00 0.00 174.94 172.56 2d9f s PRO 107 N -0.18 3.79 0.52 0.37 0.04 -1.26 -1.76 135.00 136.52 2d9f s PRO 107 Ca -0.02 1.79 -0.20 0.00 0.04 0.00 0.00 61.00 62.60 2d9f s PRO 107 Cb -0.01 -2.44 -0.06 0.00 0.04 0.00 0.00 34.50 32.02 2d9f s PRO 107 CO -0.00 -0.53 1.14 -1.25 0.04 0.00 0.00 177.00 176.40 2d9f s PRO 108 N -2.65 3.47 -1.39 0.56 0.04 -1.26 -3.21 135.00 130.57 2d9f s PRO 108 Ca 0.63 1.66 -0.03 0.00 0.04 0.00 0.00 61.00 63.30 2d9f s PRO 108 Cb -0.29 -2.12 0.02 0.00 0.04 0.00 0.00 34.50 32.14 2d9f s PRO 108 CO 0.35 -0.76 0.24 0.72 0.04 0.00 0.00 177.00 177.59 2d9f n HIS 109 N -1.06 -1.53 -3.88 0.56 8.25 -1.26 -4.93 115.22 111.36 2d9f n HIS 109 Ca 0.10 0.22 -0.34 0.00 -0.26 0.00 0.00 57.72 57.44 2d9f n HIS 109 Cb 0.50 -3.49 -0.13 0.00 1.12 0.00 0.00 29.99 27.99 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 -2.91 3.10 0.93 -1.41 0.00 -1.20 -4.83 121.76 115.45 2d9f s ALA 110 Ca 0.15 -2.66 -0.15 0.00 0.00 0.00 0.00 51.96 49.30 2d9f s ALA 110 Cb -0.07 -2.24 -0.04 0.00 0.00 0.00 0.00 23.12 20.77 2d9f s ALA 110 CO 0.19 -1.80 -0.03 0.00 0.00 0.00 0.00 175.76 174.12 2d9f n ALA 111 N 4.24 -3.54 -3.66 0.00 0.00 -1.26 -4.03 120.51 112.26 2d9f n ALA 111 Ca 0.02 -0.59 -0.11 0.00 0.00 0.00 0.00 53.44 52.76 2d9f n ALA 111 Cb 0.41 -1.56 -0.12 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 2.37 0.15 -0.06 0.00 1.43 -1.24 -3.72 118.68 117.61 2d9f s LEU 112 Ca 0.52 0.75 -0.28 0.00 -1.03 0.00 0.00 54.13 54.08 2d9f s LEU 112 Cb -0.22 1.13 -0.02 0.00 0.03 0.00 0.00 46.19 47.10 2d9f s LEU 112 CO 0.72 -0.18 0.93 0.00 0.23 0.00 0.00 176.35 178.06 2d9f s LEU 114 N 1.40 1.51 -0.49 0.00 1.43 -0.92 -2.16 118.68 119.44 2d9f s LEU 114 Ca 0.47 -0.38 -0.17 0.00 -1.03 0.00 0.00 54.13 53.03 2d9f s LEU 114 Cb -0.19 -0.99 0.07 0.00 0.03 0.00 0.00 46.19 45.11 2d9f s LEU 114 CO 0.22 -0.05 0.49 -0.70 0.23 0.00 0.00 176.35 176.54 2d9f s GLU 115 N 1.33 3.03 -0.03 1.70 2.12 -1.24 -0.76 118.70 124.85 2d9f s GLU 115 Ca -0.00 -1.18 -0.19 0.00 0.36 0.00 0.00 54.97 53.96 2d9f s GLU 115 Cb -0.14 -4.12 -0.05 0.00 0.26 0.00 0.00 34.13 30.08 2d9f s GLU 115 CO -0.06 -1.11 0.52 0.08 -0.54 0.00 0.00 175.26 174.15 2d9f s VAL 116 N 2.03 5.01 -0.24 3.70 1.01 0.88 -3.96 120.40 128.81 2d9f s VAL 116 Ca 0.08 1.07 -0.03 0.00 0.00 0.00 0.00 61.98 63.10 2d9f s VAL 116 Cb -0.22 -3.85 0.10 0.00 0.00 0.00 0.00 36.38 32.41 2d9f s VAL 116 CO 0.09 0.43 0.19 -0.89 0.00 0.00 0.00 175.10 174.92 2d9f s THR 117 N -0.19 -0.23 -0.40 3.92 2.01 -1.26 -0.31 115.64 119.18 2d9f s THR 117 Ca 0.28 -0.38 -0.28 0.00 0.31 0.00 0.00 61.69 61.61 2d9f s THR 117 Cb -0.17 -0.81 -0.01 0.00 0.01 0.00 0.00 72.50 71.52 2d9f s THR 117 CO 0.14 -0.42 1.67 -0.22 -0.69 0.00 0.00 174.62 175.10 2d9f s LEU 118 N 2.24 3.50 -0.08 4.42 1.98 -1.19 -3.05 118.68 126.49 2d9f s LEU 118 Ca 0.07 0.98 -0.04 0.00 -2.89 0.00 0.00 54.13 52.25 2d9f s LEU 118 Cb -0.15 -3.37 -0.01 0.00 0.66 0.00 0.00 46.19 43.31 2d9f s LEU 118 CO -0.23 -1.71 -0.07 0.11 -1.89 0.00 0.00 176.35 172.55 2d9f h LYS 119 N 12.39 0.00 -3.38 1.98 1.79 -1.75 0.42 116.57 128.02 2d9f h LYS 119 Ca -0.30 0.00 -0.13 0.00 -2.18 0.00 0.00 60.65 58.04 2d9f h LYS 119 Cb 1.14 0.00 -0.20 0.00 -1.58 0.00 0.00 32.23 31.60 2d9f h LYS 119 CO 1.08 0.00 -0.40 0.95 -1.08 0.00 0.00 179.45 180.00 2d9f s THR 120 N -1.63 0.08 -0.10 -0.16 -4.23 -1.18 -4.44 115.64 103.98 2d9f s THR 120 Ca -0.06 -0.67 -0.00 0.00 -1.18 0.00 0.00 61.69 59.77 2d9f s THR 120 Cb 0.01 -0.60 0.02 0.00 1.34 0.00 0.00 72.50 73.27 2d9f s THR 120 CO 0.09 -0.37 -0.06 0.00 -0.54 0.00 0.00 174.62 173.74 2d9f s ALA 121 N -1.65 1.13 0.14 3.99 0.00 -1.26 -1.70 121.76 122.41 2d9f s ALA 121 Ca -0.12 -0.41 -0.08 0.00 0.00 0.00 0.00 51.96 51.35 2d9f s ALA 121 Cb -0.05 -0.83 -0.01 0.00 0.00 0.00 0.00 23.12 22.23 2d9f s ALA 121 CO 0.01 -0.39 0.24 0.14 0.00 0.00 0.00 175.76 175.76 2d9f s VAL 122 N 1.70 0.09 0.03 0.00 -7.23 -0.64 -4.98 120.40 109.37 2d9f s VAL 122 Ca 0.03 -1.35 -0.18 0.00 -1.81 0.00 0.00 61.98 58.67 2d9f s VAL 122 Cb -0.13 -1.69 -0.24 0.00 0.56 0.00 0.00 36.38 34.88 2d9f s VAL 122 CO -0.07 -0.42 1.12 -0.78 -0.31 0.00 0.00 175.10 174.64 2d9f h ASP 123 N 2.63 0.67 -4.06 4.85 3.58 -1.93 1.21 116.42 123.37 2d9f h ASP 123 Ca -0.33 -0.77 -0.47 0.00 0.42 0.00 0.00 57.03 55.89 2d9f h ASP 123 Cb 1.22 -0.21 0.02 0.00 1.72 0.00 0.00 39.33 42.08 2d9f h ASP 123 CO 0.52 1.36 0.38 0.00 -2.88 0.00 0.00 179.24 178.62 2d9f s ARG 124 N -3.18 3.87 0.54 0.28 1.70 -1.26 -4.19 118.95 116.71 2d9f s ARG 124 Ca -0.12 1.35 -0.20 0.00 -0.47 0.00 0.00 55.73 56.29 2d9f s ARG 124 Cb 0.05 -2.14 -0.06 0.00 -0.57 0.00 0.00 34.95 32.23 2d9f s ARG 124 CO 0.86 -0.37 1.13 -1.25 -1.08 0.00 0.00 175.30 174.59 2d9f s PRO 125 N -3.17 3.39 -0.24 3.89 0.04 -1.26 -4.74 135.00 132.91 2d9f s PRO 125 Ca 0.66 1.62 -0.14 0.00 0.04 0.00 0.00 61.00 63.18 2d9f s PRO 125 Cb -0.16 -2.03 -0.16 0.00 0.04 0.00 0.00 34.50 32.19 2d9f s PRO 125 CO 0.20 -0.82 -0.10 -3.47 0.04 0.00 0.00 177.00 172.84 2d9f n ASP 126 N -1.25 1.94 -3.54 6.66 -0.08 -1.26 -4.56 116.55 114.47 2d9f n ASP 126 Ca 0.11 0.30 -0.40 0.00 -1.51 0.00 0.00 54.79 53.29 2d9f n ASP 126 Cb 0.51 -0.82 -0.01 0.00 2.34 0.00 0.00 41.12 43.14 2d9f n ASP 126 CO 0.00 0.00 0.00 -0.11 0.12 0.00 0.00 177.20 177.21 2d9f n LEU 127 N -4.13 7.84 -3.98 -2.67 7.94 -1.26 -4.88 117.00 115.86 2d9f n LEU 127 Ca -0.45 -4.63 -0.09 0.00 -1.11 0.00 0.00 56.01 49.72 2d9f n LEU 127 Cb 0.85 -1.46 -0.06 0.00 0.53 0.00 0.00 43.42 43.28 2d9f n LEU 127 CO 0.14 1.83 0.11 -1.61 -1.11 0.00 0.00 177.39 176.75 2d9f s GLU 128 N 0.43 1.42 0.07 1.96 2.02 -1.26 -5.09 118.70 118.25 2d9f s GLU 128 Ca 0.54 -1.23 0.00 0.00 0.02 0.00 0.00 54.97 54.30 2d9f s GLU 128 Cb 0.16 0.44 0.00 0.00 0.10 0.00 0.00 34.13 34.83 2d9f s GLU 128 CO -0.06 -0.57 0.00 0.00 0.02 0.00 0.00 175.26 174.65 2d9f n MET 129 N -0.33 0.00 -0.04 1.61 0.00 -1.26 -4.96 117.12 112.14 2d9f n MET 129 Ca -0.03 0.00 -0.01 0.00 0.00 0.00 0.00 57.70 57.66 2d9f n MET 129 Cb 0.63 -0.26 -0.00 0.00 0.00 0.00 0.00 33.22 33.58 2d9f n MET 129 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 175.97 176.74 2d9f h SER 130 N 0.00 0.00 0.00 3.17 0.02 -2.02 -3.51 113.55 111.21 2d9f h SER 130 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2d9f h SER 130 Cb 0.34 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.88 2d9f h SER 130 CO 0.00 0.39 0.00 0.61 -1.14 0.00 0.00 176.83 176.69 2d9f n GLY 131 N 1.80 0.61 3.69 -3.77 0.00 -1.26 -5.10 105.19 101.16 2d9f n GLY 131 Ca -0.01 -1.82 -0.29 0.00 0.00 0.00 0.00 46.02 43.90 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 -1.25 0.70 -0.61 1.61 0.04 -1.26 -5.02 135.00 129.21 2d9f s PRO 132 Ca 0.00 0.63 -0.01 0.00 0.04 0.00 0.00 61.00 61.65 2d9f s PRO 132 Cb 0.00 -1.76 0.16 0.00 0.04 0.00 0.00 34.50 32.94 2d9f s PRO 132 CO 0.00 -2.57 0.41 0.45 0.04 0.00 0.00 177.00 175.33 2d9f s SER 133 N -3.43 5.04 -1.78 6.66 0.15 -1.26 -4.78 113.70 114.29 2d9f s SER 133 Ca 0.65 -2.93 -0.16 0.00 0.70 0.00 0.00 55.95 54.20 2d9f s SER 133 Cb -0.18 -1.81 0.16 0.00 -1.71 0.00 0.00 66.02 62.48 2d9f s SER 133 CO 0.57 -0.33 0.41 -0.24 1.20 0.00 0.00 173.24 174.86 2d9f n SER 134 N 3.34 -0.95 0.00 5.45 2.88 -1.26 -5.36 113.62 117.72 2d9f n SER 134 Ca 0.08 -1.26 0.03 0.00 -1.33 0.00 0.00 58.87 56.39 2d9f n SER 134 Cb 0.36 -1.60 0.18 0.00 -0.75 0.00 0.00 64.21 62.40 2d9f n SER 134 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42