#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 6.83 0.04 1.61 0.01 -1.26 -5.06 113.70 115.87 2d9f s SER 2 Ca 0.00 1.00 -0.09 0.00 1.31 0.00 0.00 55.95 58.16 2d9f s SER 2 Cb 0.00 -2.37 0.00 0.00 0.21 0.00 0.00 66.02 63.87 2d9f s SER 2 CO 0.00 -0.15 0.19 -0.44 0.41 0.00 0.00 173.24 173.25 2d9f s SER 3 N 0.89 0.04 -0.47 2.44 0.01 -1.26 -5.11 113.70 110.24 2d9f s SER 3 Ca 0.32 -0.36 0.05 0.00 1.31 0.00 0.00 55.95 57.27 2d9f s SER 3 Cb -0.16 0.28 0.24 0.00 0.21 0.00 0.00 66.02 66.59 2d9f s SER 3 CO 0.14 -0.55 0.92 0.61 0.41 0.00 0.00 173.24 174.77 2d9f n GLY 4 N 0.73 -0.24 3.25 3.44 0.00 -1.26 -5.15 105.19 105.96 2d9f n GLY 4 Ca -0.19 0.28 -0.17 0.00 0.00 0.00 0.00 46.02 45.94 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 -1.34 1.96 0.21 1.61 1.04 -1.26 -5.11 113.70 110.81 2d9f s SER 5 Ca 0.31 -0.89 -0.31 0.00 0.48 0.00 0.00 55.95 55.54 2d9f s SER 5 Cb 0.21 -0.05 -0.15 0.00 0.10 0.00 0.00 66.02 66.13 2d9f s SER 5 CO -0.22 -0.21 1.15 -1.20 0.98 0.00 0.00 173.24 173.75 2d9f n SER 6 N 0.22 1.52 -4.32 7.02 7.64 -1.26 -4.98 113.62 119.46 2d9f n SER 6 Ca -0.13 1.15 -0.23 0.00 1.01 0.00 0.00 58.87 60.67 2d9f n SER 6 Cb 0.58 -1.26 -0.10 0.00 -1.01 0.00 0.00 64.21 62.42 2d9f n SER 6 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2d9f s GLY 7 N -0.11 2.26 0.00 0.23 0.00 -1.26 -5.04 107.32 103.40 2d9f s GLY 7 Ca 0.69 -1.70 0.25 0.00 0.00 0.00 0.00 44.72 43.95 2d9f s GLY 7 CO 0.54 -1.81 1.38 -2.21 0.00 0.00 0.00 173.10 171.00 2d9f n GLU 8 N -0.76 0.47 -2.03 2.90 4.07 -1.26 -4.94 120.64 119.09 2d9f n GLU 8 Ca -0.04 -0.31 -0.20 0.00 -0.06 0.00 0.00 57.16 56.55 2d9f n GLU 8 Cb 0.66 -1.49 -0.04 0.00 -0.06 0.00 0.00 31.44 30.50 2d9f n GLU 8 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 177.13 177.46 2d9f n GLU 9 N -1.00 -1.52 -3.73 5.31 1.02 -1.26 -4.96 120.64 114.50 2d9f n GLU 9 Ca 0.08 1.08 -0.20 0.00 -0.02 0.00 0.00 57.16 58.11 2d9f n GLU 9 Cb 0.35 -5.59 -0.05 0.00 -0.02 0.00 0.00 31.44 26.14 2d9f n GLU 9 CO 0.00 0.00 0.00 0.91 1.18 0.00 0.00 177.13 179.22 2d9f n TRP 10 N -3.32 0.45 -3.88 -0.32 7.02 -1.26 -5.07 117.44 111.07 2d9f n TRP 10 Ca -0.22 -1.74 -0.36 0.00 -1.02 0.00 0.00 57.50 54.16 2d9f n TRP 10 Cb 0.67 -0.12 -0.12 0.00 -2.42 0.00 0.00 31.31 29.33 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 3.52 -0.64 -0.99 0.20 -1.00 -4.93 118.68 114.83 2d9f s LEU 11 Ca 0.07 -0.13 -0.25 0.00 0.69 0.00 0.00 54.13 54.51 2d9f s LEU 11 Cb 0.00 -1.92 0.05 0.00 -0.43 0.00 0.00 46.19 43.89 2d9f s LEU 11 CO 0.05 0.03 1.08 1.51 -0.29 0.00 0.00 176.35 178.73 2d9f s ASP 12 N 1.21 6.25 0.12 3.68 1.47 -1.26 -0.98 116.67 127.16 2d9f s ASP 12 Ca 0.04 -0.51 -0.16 0.00 1.18 0.00 0.00 52.55 53.11 2d9f s ASP 12 Cb -0.14 -2.48 -0.03 0.00 -0.34 0.00 0.00 42.92 39.92 2d9f s ASP 12 CO 0.03 -1.50 1.56 0.40 0.68 0.00 0.00 175.17 176.35 2d9f h ILE 13 N 6.03 1.26 0.00 2.11 2.04 -1.73 -3.24 117.51 123.97 2d9f h ILE 13 Ca -0.27 -0.96 -0.30 0.00 1.00 0.00 0.00 64.86 64.33 2d9f h ILE 13 Cb 1.06 1.16 -0.05 0.00 -0.74 0.00 0.00 36.82 38.26 2d9f h ILE 13 CO 1.18 0.32 -1.74 0.18 0.00 0.00 0.00 178.15 178.10 2d9f n LEU 14 N -4.50 0.86 0.00 1.44 4.77 -1.25 -4.99 117.00 113.32 2d9f n LEU 14 Ca -0.01 0.40 0.00 0.00 -0.03 0.00 0.00 56.01 56.37 2d9f n LEU 14 Cb 0.27 0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.53 2d9f n LEU 14 CO 0.40 0.40 0.00 0.61 -1.33 0.00 0.00 177.39 177.46 2d9f n GLY 15 N 1.57 1.86 0.10 -0.72 0.00 -1.22 -4.93 105.19 101.84 2d9f n GLY 15 Ca -0.18 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.71 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 0.88 -0.13 0.00 1.61 2.35 -1.92 -3.48 115.58 114.88 2d9f h ASN 16 Ca 0.00 -0.20 0.00 0.00 -0.55 0.00 0.00 56.30 55.55 2d9f h ASN 16 Cb 0.00 0.03 0.00 0.00 0.05 0.00 0.00 38.32 38.40 2d9f h ASN 16 CO 0.00 0.13 0.00 0.61 -1.65 0.00 0.00 177.43 176.52 2d9f n GLY 17 N -0.50 1.20 0.03 2.83 0.00 -1.26 -5.04 105.19 102.45 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 -8.68 0.99 -0.00 -1.92 -3.40 115.31 102.25 2d9f h LEU 18 Ca 0.00 0.00 -0.55 0.00 -0.00 0.00 0.00 57.88 57.33 2d9f h LEU 18 Cb 0.00 0.01 -0.05 0.00 -0.00 0.00 0.00 40.66 40.62 2d9f h LEU 18 CO 0.00 -0.04 1.11 -0.22 -0.00 0.00 0.00 178.44 179.29 2d9f s LEU 19 N -4.32 3.48 0.44 1.67 2.96 -1.26 -3.78 118.68 117.87 2d9f s LEU 19 Ca -0.01 0.56 0.07 0.00 -0.22 0.00 0.00 54.13 54.52 2d9f s LEU 19 Cb 0.00 -3.25 -0.03 0.00 0.50 0.00 0.00 46.19 43.41 2d9f s LEU 19 CO 0.03 -1.63 0.22 -0.13 -1.32 0.00 0.00 176.35 173.52 2d9f s ARG 20 N 5.36 2.25 -0.09 1.98 0.52 -1.18 -2.02 118.95 125.77 2d9f s ARG 20 Ca 0.58 -1.90 -0.05 0.00 -0.52 0.00 0.00 55.73 53.84 2d9f s ARG 20 Cb -0.12 -1.99 0.04 0.00 0.52 0.00 0.00 34.95 33.39 2d9f s ARG 20 CO 0.28 -0.22 0.21 0.21 0.02 0.00 0.00 175.30 175.80 2d9f s LYS 21 N -3.98 0.19 -0.21 3.54 2.20 -0.15 -3.54 119.74 117.78 2d9f s LYS 21 Ca 0.38 0.41 -0.04 0.00 -0.36 0.00 0.00 55.97 56.36 2d9f s LYS 21 Cb 0.02 -0.05 0.07 0.00 -1.51 0.00 0.00 37.83 36.36 2d9f s LYS 21 CO 0.21 -0.12 0.08 0.21 -0.36 0.00 0.00 175.35 175.37 2d9f s LYS 22 N 0.83 0.34 -0.46 4.03 2.20 -0.37 -2.38 119.74 123.93 2d9f s LYS 22 Ca -0.06 -0.36 -0.27 0.00 -0.36 0.00 0.00 55.97 54.92 2d9f s LYS 22 Cb -0.07 -1.82 -0.04 0.00 -1.51 0.00 0.00 37.83 34.39 2d9f s LYS 22 CO -0.05 -0.75 2.03 0.99 -0.36 0.00 0.00 175.35 177.21 2d9f s THR 23 N 1.99 3.26 0.08 3.43 2.01 -1.26 -0.44 115.64 124.71 2d9f s THR 23 Ca 0.03 0.21 -0.17 0.00 0.31 0.00 0.00 61.69 62.07 2d9f s THR 23 Cb -0.16 -3.52 -0.11 0.00 0.01 0.00 0.00 72.50 68.72 2d9f s THR 23 CO -0.15 -0.44 1.39 -0.07 -0.69 0.00 0.00 174.62 174.66 2d9f h LEU 24 N 16.37 0.61 -7.11 4.42 3.38 -0.05 -3.44 115.31 129.51 2d9f h LEU 24 Ca -0.29 -0.47 -0.32 0.00 0.09 0.00 0.00 57.88 56.89 2d9f h LEU 24 Cb 1.20 -0.17 -0.36 0.00 0.09 0.00 0.00 40.66 41.41 2d9f h LEU 24 CO 1.12 0.96 -0.65 -0.69 0.09 0.00 0.00 178.44 179.28 2d9f s VAL 25 N -4.34 -0.26 0.50 1.22 1.01 -0.07 -4.96 120.40 113.49 2d9f s VAL 25 Ca -0.13 0.17 -0.21 0.00 0.00 0.00 0.00 61.98 61.80 2d9f s VAL 25 Cb 0.07 -0.43 -0.07 0.00 0.00 0.00 0.00 36.38 35.96 2d9f s VAL 25 CO 0.80 0.00 1.15 -2.16 0.00 0.00 0.00 175.10 174.90 2d9f s PRO 26 N 2.29 3.58 0.68 2.72 0.04 -1.26 -0.46 135.00 142.59 2d9f s PRO 26 Ca 0.04 1.71 0.02 0.00 0.04 0.00 0.00 61.00 62.81 2d9f s PRO 26 Cb -0.13 -2.23 0.12 0.00 0.04 0.00 0.00 34.50 32.29 2d9f s PRO 26 CO -0.08 -0.68 0.94 0.20 0.04 0.00 0.00 177.00 177.42 2d9f s GLY 27 N -1.53 1.75 0.85 0.56 0.00 -1.26 -4.79 107.32 102.90 2d9f s GLY 27 Ca 0.68 -1.86 -0.11 0.00 0.00 0.00 0.00 44.72 43.42 2d9f s GLY 27 CO 0.31 -1.32 1.09 2.56 0.00 0.00 0.00 173.10 175.75 2d9f s PRO 28 N -5.01 1.61 0.00 2.90 0.04 -1.26 -4.91 135.00 128.37 2d9f s PRO 28 Ca 0.65 0.94 0.15 0.00 0.04 0.00 0.00 61.00 62.79 2d9f s PRO 28 Cb -0.05 -1.84 0.91 0.00 0.04 0.00 0.00 34.50 33.56 2d9f s PRO 28 CO 0.43 -2.03 1.35 -0.35 0.04 0.00 0.00 177.00 176.43 2d9f n PRO 29 N -3.76 0.46 -0.08 0.56 -0.04 -1.26 -2.58 135.00 128.31 2d9f n PRO 29 Ca 0.08 0.01 -0.11 0.00 -0.04 0.00 0.00 63.50 63.44 2d9f n PRO 29 Cb 0.54 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 32.36 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 -0.90 3.47 0.55 0.00 -1.26 -4.98 105.19 102.04 2d9f n GLY 30 Ca 0.11 -0.23 -0.30 0.00 0.00 0.00 0.00 46.02 45.60 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 -2.93 -1.46 -3.64 1.61 3.41 -1.07 -5.05 113.62 104.49 2d9f n SER 31 Ca -0.30 0.05 -0.09 0.00 -0.26 0.00 0.00 58.87 58.27 2d9f n SER 31 Cb 1.10 -1.24 -0.07 0.00 -0.26 0.00 0.00 64.21 63.75 2d9f n SER 31 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2d9f s SER 32 N -2.28 -0.62 0.21 4.04 0.01 -1.26 -4.90 113.70 108.90 2d9f s SER 32 Ca 0.64 1.11 -0.29 0.00 1.31 0.00 0.00 55.95 58.71 2d9f s SER 32 Cb -0.21 1.17 -0.16 0.00 0.21 0.00 0.00 66.02 67.03 2d9f s SER 32 CO 0.64 -0.18 0.76 0.54 0.41 0.00 0.00 173.24 175.40 2d9f n ARG 33 N 2.98 0.50 -0.39 12.44 1.74 -1.26 -4.04 116.66 128.62 2d9f n ARG 33 Ca -0.15 0.18 -0.11 0.00 -0.77 0.00 0.00 57.85 56.99 2d9f n ARG 33 Cb 0.57 -1.36 0.09 0.00 -1.02 0.00 0.00 32.46 30.74 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 1.02 -1.83 -4.19 5.56 -0.04 -1.26 -4.97 135.00 129.29 2d9f n PRO 34 Ca 0.15 -0.66 -0.22 0.00 -0.04 0.00 0.00 63.50 62.73 2d9f n PRO 34 Cb 0.26 -0.62 -0.06 0.00 -0.04 0.00 0.00 33.50 33.04 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 -1.75 3.82 -0.37 0.52 0.11 -1.26 -4.99 120.40 116.48 2d9f s VAL 35 Ca 0.27 -1.67 -0.21 0.00 -2.93 0.00 0.00 61.98 57.44 2d9f s VAL 35 Cb -0.03 -3.09 0.01 0.00 -1.53 0.00 0.00 36.38 31.74 2d9f s VAL 35 CO 0.21 -0.34 0.67 -0.75 -3.33 0.00 0.00 175.10 171.55 2d9f s LYS 36 N -3.77 3.62 0.00 1.54 2.20 -1.26 -3.90 119.74 118.17 2d9f s LYS 36 Ca 0.33 0.03 0.00 0.00 -0.36 0.00 0.00 55.97 55.96 2d9f s LYS 36 Cb -0.07 -3.84 0.00 0.00 -1.51 0.00 0.00 37.83 32.42 2d9f s LYS 36 CO 0.22 -0.81 0.00 0.41 -0.36 0.00 0.00 175.35 174.81 2d9f n GLY 37 N 4.72 1.35 3.68 5.54 0.00 -0.10 -4.92 105.19 115.46 2d9f n GLY 37 Ca -0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 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 2.14 -0.42 1.61 -0.21 -1.25 -4.86 119.66 116.67 2d9f s GLN 38 Ca 0.00 -1.83 -0.29 0.00 0.02 0.00 0.00 55.36 53.26 2d9f s GLN 38 Cb 0.00 -1.92 0.02 0.00 1.00 0.00 0.00 33.01 32.11 2d9f s GLN 38 CO 0.00 0.00 1.12 0.08 -2.12 0.00 0.00 175.29 174.37 2d9f s VAL 39 N -2.58 4.31 -0.18 1.09 1.01 0.19 -3.12 120.40 121.13 2d9f s VAL 39 Ca 0.38 1.41 -0.04 0.00 0.00 0.00 0.00 61.98 63.73 2d9f s VAL 39 Cb 0.03 -4.53 -0.02 0.00 0.00 0.00 0.00 36.38 31.86 2d9f s VAL 39 CO 0.21 -0.81 -0.04 0.68 0.00 0.00 0.00 175.10 175.14 2d9f s VAL 40 N 4.18 3.75 -0.27 2.92 -7.23 -0.99 -1.35 120.40 121.41 2d9f s VAL 40 Ca 0.47 -0.40 -0.05 0.00 -1.81 0.00 0.00 61.98 60.20 2d9f s VAL 40 Cb -0.09 -2.66 0.01 0.00 0.56 0.00 0.00 36.38 34.20 2d9f s VAL 40 CO 0.26 0.47 0.02 -0.89 -0.31 0.00 0.00 175.10 174.65 2d9f s THR 41 N 0.71 3.58 0.38 5.32 2.01 -0.89 -2.81 115.64 123.95 2d9f s THR 41 Ca -0.02 -0.74 0.04 0.00 0.31 0.00 0.00 61.69 61.28 2d9f s THR 41 Cb -0.14 -2.81 -0.02 0.00 0.01 0.00 0.00 72.50 69.54 2d9f s THR 41 CO 0.02 0.17 0.16 1.33 -0.69 0.00 0.00 174.62 175.61 2d9f n VAL 42 N 4.80 0.00 -3.99 3.82 0.24 0.41 -1.75 118.33 121.86 2d9f n VAL 42 Ca -0.16 -2.28 -0.31 0.00 -2.04 0.00 0.00 64.34 59.56 2d9f n VAL 42 Cb 0.48 0.87 -0.15 0.00 -1.47 0.00 0.00 33.84 33.58 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 -3.06 3.54 -0.12 6.34 2.46 -1.04 -0.88 115.29 122.52 2d9f s HIS 43 Ca 0.23 -2.86 -0.09 0.00 0.47 0.00 0.00 55.06 52.81 2d9f s HIS 43 Cb 0.01 -2.79 -0.04 0.00 -0.13 0.00 0.00 32.58 29.63 2d9f s HIS 43 CO 0.16 -0.94 0.17 -1.17 -2.47 0.00 0.00 174.74 170.49 2d9f s LEU 44 N 0.98 4.36 -0.18 8.88 1.98 -1.01 -3.51 118.68 130.18 2d9f s LEU 44 Ca 0.11 0.49 -0.03 0.00 -2.89 0.00 0.00 54.13 51.81 2d9f s LEU 44 Cb -0.19 -2.14 0.06 0.00 0.66 0.00 0.00 46.19 44.57 2d9f s LEU 44 CO -0.10 0.35 0.03 -1.10 -1.89 0.00 0.00 176.35 173.64 2d9f s GLN 45 N -0.74 0.64 -0.04 1.98 -0.21 -1.24 -1.72 119.66 118.33 2d9f s GLN 45 Ca 0.15 -0.35 -0.24 0.00 0.02 0.00 0.00 55.36 54.95 2d9f s GLN 45 Cb -0.12 -1.96 -0.04 0.00 1.00 0.00 0.00 33.01 31.88 2d9f s GLN 45 CO 0.04 -0.60 0.72 0.99 -2.12 0.00 0.00 175.29 174.32 2d9f s THR 46 N 1.88 4.99 -0.08 -0.19 2.01 -0.47 -3.28 115.64 120.49 2d9f s THR 46 Ca -0.00 1.49 -0.10 0.00 0.31 0.00 0.00 61.69 63.38 2d9f s THR 46 Cb -0.16 -4.06 0.02 0.00 0.01 0.00 0.00 72.50 68.31 2d9f s THR 46 CO -0.08 0.27 0.27 -0.94 -0.69 0.00 0.00 174.62 173.45 2d9f s SER 47 N 0.63 -0.24 0.50 3.53 1.04 -1.01 -1.38 113.70 116.76 2d9f s SER 47 Ca 0.38 0.39 -0.22 0.00 0.48 0.00 0.00 55.95 56.98 2d9f s SER 47 Cb -0.18 0.48 -0.06 0.00 0.10 0.00 0.00 66.02 66.35 2d9f s SER 47 CO 0.19 -0.19 1.20 -0.76 0.98 0.00 0.00 173.24 174.66 2d9f s LEU 48 N -0.27 3.92 0.56 2.42 2.01 -0.61 0.28 118.68 126.98 2d9f s LEU 48 Ca -0.04 2.37 0.31 0.00 0.01 0.00 0.00 54.13 56.78 2d9f s LEU 48 Cb -0.03 -4.33 1.47 0.00 0.01 0.00 0.00 46.19 43.31 2d9f s LEU 48 CO 0.01 -1.13 1.87 -0.08 1.01 0.00 0.00 176.35 178.03 2d9f h GLU 49 N 1.73 0.00 -0.01 1.70 4.57 -1.92 -0.06 114.58 120.59 2d9f h GLU 49 Ca -0.50 0.00 -0.06 0.00 -1.18 0.00 0.00 59.36 57.62 2d9f h GLU 49 Cb 1.26 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.86 2d9f h GLU 49 CO 0.59 0.00 -0.25 -0.91 -1.18 0.00 0.00 179.01 177.26 2d9f h ASN 50 N 0.00 0.23 0.00 1.04 2.35 -1.91 -3.48 115.58 113.81 2d9f h ASN 50 Ca 0.37 -0.75 0.00 0.00 -0.55 0.00 0.00 56.30 55.36 2d9f h ASN 50 Cb 1.62 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 39.92 2d9f h ASN 50 CO -0.00 0.95 0.00 0.61 -1.65 0.00 0.00 177.43 177.34 2d9f n GLY 51 N 0.99 0.00 3.01 2.83 0.00 -0.04 -5.13 105.19 106.85 2d9f n GLY 51 Ca -0.10 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.61 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 0.00 2.44 0.08 2.61 2.01 -1.24 -4.88 115.64 116.65 2d9f s THR 52 Ca 0.00 -2.57 -0.31 0.00 0.31 0.00 0.00 61.69 59.12 2d9f s THR 52 Cb 0.00 -2.76 -0.10 0.00 0.01 0.00 0.00 72.50 69.65 2d9f s THR 52 CO 0.00 -0.66 1.91 0.54 -0.69 0.00 0.00 174.62 175.72 2d9f n ARG 53 N 3.99 2.84 -0.10 4.92 1.74 -1.26 -1.57 116.66 127.21 2d9f n ARG 53 Ca 0.04 1.04 -0.19 0.00 -0.77 0.00 0.00 57.85 57.96 2d9f n ARG 53 Cb 0.40 -2.96 -0.09 0.00 -1.02 0.00 0.00 32.46 28.78 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 5.11 1.51 -3.98 1.55 0.31 -0.48 -4.94 118.33 117.41 2d9f n VAL 54 Ca 0.19 -0.01 -0.11 0.00 -0.01 0.00 0.00 64.34 64.40 2d9f n VAL 54 Cb 0.39 -2.10 -0.12 0.00 -0.91 0.00 0.00 33.84 31.10 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 -2.36 0.27 -0.27 5.55 -2.07 -1.20 -4.93 119.66 114.65 2d9f s GLN 55 Ca -0.27 -0.44 -0.01 0.00 -1.82 0.00 0.00 55.36 52.82 2d9f s GLN 55 Cb 0.06 -0.01 0.08 0.00 -1.09 0.00 0.00 33.01 32.05 2d9f s GLN 55 CO 0.51 -0.01 0.06 -2.00 -1.32 0.00 0.00 175.29 172.53 2d9f s GLU 56 N -1.00 0.86 -0.46 9.60 2.12 -1.26 -1.37 118.70 127.18 2d9f s GLU 56 Ca -0.10 -0.91 -0.11 0.00 0.36 0.00 0.00 54.97 54.22 2d9f s GLU 56 Cb -0.07 -2.15 0.10 0.00 0.26 0.00 0.00 34.13 32.27 2d9f s GLU 56 CO -0.00 -0.83 0.34 -2.00 -0.54 0.00 0.00 175.26 172.22 2d9f s GLU 57 N 1.63 2.64 -0.02 4.30 2.12 -0.70 -4.96 118.70 123.71 2d9f s GLU 57 Ca 0.04 -1.59 -0.25 0.00 0.36 0.00 0.00 54.97 53.53 2d9f s GLU 57 Cb -0.17 -3.94 -0.20 0.00 0.26 0.00 0.00 34.13 30.08 2d9f s GLU 57 CO -0.17 -1.10 1.23 -1.00 -0.54 0.00 0.00 175.26 173.68 2d9f h PRO 58 N 8.52 -0.05 -2.94 4.30 0.13 -1.88 -2.69 132.00 137.39 2d9f h PRO 58 Ca -0.24 0.00 -0.73 0.00 -0.87 0.00 0.00 66.00 64.17 2d9f h PRO 58 Cb 1.08 0.01 -0.34 0.00 0.13 0.00 0.00 31.00 31.89 2d9f h PRO 58 CO 0.84 0.42 0.15 -1.91 -0.23 0.00 0.00 178.00 177.28 2d9f n GLU 59 N -4.88 3.35 -2.99 0.86 2.13 -1.26 -4.20 120.64 113.64 2d9f n GLU 59 Ca -0.08 -4.55 -0.40 0.00 0.66 0.00 0.00 57.16 52.78 2d9f n GLU 59 Cb 0.25 -2.42 -0.04 0.00 0.27 0.00 0.00 31.44 29.49 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 -2.13 4.27 0.05 4.31 1.98 -0.06 -4.94 118.68 122.15 2d9f s LEU 60 Ca 0.32 1.18 0.04 0.00 -2.89 0.00 0.00 54.13 52.79 2d9f s LEU 60 Cb 0.02 -3.14 -0.02 0.00 0.66 0.00 0.00 46.19 43.71 2d9f s LEU 60 CO -0.01 -0.22 -0.12 0.54 -1.89 0.00 0.00 176.35 174.65 2d9f s VAL 61 N 1.28 0.93 0.15 1.68 0.11 -1.26 -0.45 120.40 122.84 2d9f s VAL 61 Ca 0.38 -1.06 -0.25 0.00 -2.93 0.00 0.00 61.98 58.13 2d9f s VAL 61 Cb -0.17 -0.89 0.07 0.00 -1.53 0.00 0.00 36.38 33.86 2d9f s VAL 61 CO 0.17 -0.15 1.02 0.72 -3.33 0.00 0.00 175.10 173.53 2d9f s PHE 62 N -1.05 -0.05 -0.43 1.54 -0.12 -1.12 -5.01 117.98 111.73 2d9f s PHE 62 Ca -0.02 -0.27 -0.11 0.00 -0.05 0.00 0.00 56.93 56.48 2d9f s PHE 62 Cb -0.09 0.65 0.07 0.00 -0.63 0.00 0.00 43.02 43.03 2d9f s PHE 62 CO 0.01 -0.81 0.30 0.99 -0.05 0.00 0.00 175.22 175.67 2d9f s THR 63 N -2.82 4.59 0.25 -4.49 2.01 -1.26 -2.35 115.64 111.56 2d9f s THR 63 Ca 0.16 -1.26 -0.31 0.00 0.31 0.00 0.00 61.69 60.59 2d9f s THR 63 Cb -0.01 -3.77 -0.14 0.00 0.01 0.00 0.00 72.50 68.59 2d9f s THR 63 CO 0.03 -0.52 1.30 -0.11 -0.69 0.00 0.00 174.62 174.64 2d9f n LEU 64 N 5.02 2.74 0.00 4.42 7.94 -1.18 -2.12 117.00 133.81 2d9f n LEU 64 Ca -0.11 1.15 0.00 0.00 -1.11 0.00 0.00 56.01 55.95 2d9f n LEU 64 Cb 0.43 -1.38 0.00 0.00 0.53 0.00 0.00 43.42 43.00 2d9f n LEU 64 CO 0.42 -0.73 0.00 0.61 -1.11 0.00 0.00 177.39 176.57 2d9f n GLY 65 N 1.84 2.46 0.04 -3.96 0.00 -1.26 -0.92 105.19 103.39 2d9f n GLY 65 Ca 0.11 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.25 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 0.00 0.63 -3.67 1.61 -0.08 -0.90 -4.98 116.55 109.17 2d9f n ASP 66 Ca 0.00 -0.13 -0.22 0.00 -1.51 0.00 0.00 54.79 52.93 2d9f n ASP 66 Cb 0.00 0.54 0.05 0.00 2.34 0.00 0.00 41.12 44.04 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 -1.98 0.00 -5.49 0.00 5.19 -1.94 -3.46 116.42 108.74 2d9f h ASP 68 Ca -0.60 0.00 -0.39 0.00 -0.62 0.00 0.00 57.03 55.42 2d9f h ASP 68 Cb 1.36 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.86 2d9f h ASP 68 CO 0.57 0.00 -0.14 1.33 -3.12 0.00 0.00 179.24 177.88 2d9f n VAL 69 N -3.00 0.00 -1.48 -1.35 0.24 -1.26 -5.07 118.33 106.41 2d9f n VAL 69 Ca 0.03 -1.52 -0.40 0.00 -2.04 0.00 0.00 64.34 60.41 2d9f n VAL 69 Cb 0.43 -0.36 0.02 0.00 -1.47 0.00 0.00 33.84 32.46 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 -1.64 2.05 0.44 1.34 2.08 -1.26 -4.71 119.36 117.65 2d9f n ILE 70 Ca 0.04 -0.50 0.09 0.00 0.56 0.00 0.00 62.75 62.94 2d9f n ILE 70 Cb 0.45 -0.68 0.39 0.00 -0.75 0.00 0.00 39.64 39.05 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 0.27 0.09 0.01 0.38 6.02 -0.93 -1.80 117.38 121.42 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 0.43 -1.67 0.03 0.00 1.02 0.00 0.00 30.24 30.05 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 3.88 -0.13 -1.58 0.00 -1.25 -3.33 120.51 116.48 2d9f n ALA 72 Ca 0.03 -0.46 -0.22 0.00 0.00 0.00 0.00 53.44 52.79 2d9f n ALA 72 Cb 0.19 -0.93 -0.11 0.00 0.00 0.00 0.00 19.45 18.59 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 2.61 0.15 0.00 7.94 -0.74 -3.87 117.00 121.40 2d9f n LEU 73 Ca 0.03 0.04 0.01 0.00 -1.11 0.00 0.00 56.01 54.99 2d9f n LEU 73 Cb 0.38 -0.89 0.21 0.00 0.53 0.00 0.00 43.42 43.65 2d9f n LEU 73 CO 0.40 0.81 0.55 -0.78 -1.11 0.00 0.00 177.39 177.25 2d9f h ASP 74 N -0.35 0.00 0.56 1.96 1.82 -1.56 0.19 116.42 119.05 2d9f h ASP 74 Ca -0.61 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.03 2d9f h ASP 74 Cb 1.80 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.81 2d9f h ASP 74 CO -0.20 0.54 -0.17 0.18 -1.61 0.00 0.00 179.24 177.98 2d9f n LEU 75 N -3.62 0.36 -0.04 2.28 4.32 -1.21 -3.82 117.00 115.26 2d9f n LEU 75 Ca -0.00 0.13 -0.05 0.00 -0.02 0.00 0.00 56.01 56.07 2d9f n LEU 75 Cb 0.60 -0.28 -0.07 0.00 -1.62 0.00 0.00 43.42 42.05 2d9f n LEU 75 CO 0.40 0.07 -0.79 -1.54 -1.22 0.00 0.00 177.39 174.31 2d9f n SER 76 N -1.22 2.85 -0.16 -1.43 3.41 -1.06 -4.64 113.62 111.36 2d9f n SER 76 Ca 0.10 -0.00 -0.05 0.00 -0.26 0.00 0.00 58.87 58.66 2d9f n SER 76 Cb 0.31 0.66 0.01 0.00 -0.26 0.00 0.00 64.21 64.93 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 0.28 0.00 -3.33 2.07 -0.73 0.60 116.25 115.14 2d9f h VAL 77 Ca -0.24 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.28 2d9f h VAL 77 Cb 1.53 0.28 0.00 0.00 -1.52 0.00 0.00 31.29 31.58 2d9f h VAL 77 CO 0.01 0.00 0.00 -0.81 0.02 0.00 0.00 177.57 176.79 2d9f n PRO 78 N -5.42 0.49 -0.00 1.57 -0.04 -1.26 -1.85 135.00 128.49 2d9f n PRO 78 Ca 0.04 0.00 0.02 0.00 -0.04 0.00 0.00 63.50 63.52 2d9f n PRO 78 Cb 0.33 -1.20 -0.03 0.00 -0.04 0.00 0.00 33.50 32.56 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 -0.70 0.12 -4.84 1.53 4.77 0.20 -4.94 117.00 113.15 2d9f n LEU 79 Ca 0.05 -0.27 -0.28 0.00 -0.03 0.00 0.00 56.01 55.48 2d9f n LEU 79 Cb 0.02 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.06 2d9f n LEU 79 CO 0.03 0.03 -0.20 0.00 -1.33 0.00 0.00 177.39 175.93 2d9f s MET 80 N -1.84 3.07 0.31 3.23 0.23 -0.54 -5.05 119.30 118.71 2d9f s MET 80 Ca 0.00 -0.72 -0.03 0.00 -1.03 0.00 0.00 55.69 53.91 2d9f s MET 80 Cb 0.03 -2.78 -0.05 0.00 -1.53 0.00 0.00 34.83 30.51 2d9f s MET 80 CO 0.19 0.53 0.56 -0.51 -2.03 0.00 0.00 175.02 173.76 2d9f s ASP 81 N -2.88 6.39 -0.46 -1.18 1.01 -1.26 -4.42 116.67 113.86 2d9f s ASP 81 Ca 0.32 0.64 -0.28 0.00 0.71 0.00 0.00 52.55 53.94 2d9f s ASP 81 Cb -0.11 -2.11 -0.01 0.00 1.01 0.00 0.00 42.92 41.69 2d9f s ASP 81 CO 0.25 -0.24 1.71 0.54 0.21 0.00 0.00 175.17 177.63 2d9f s VAL 82 N -2.18 3.54 0.00 -1.27 0.11 -1.26 -2.22 120.40 117.13 2d9f s VAL 82 Ca 0.43 0.48 0.00 0.00 -2.93 0.00 0.00 61.98 59.96 2d9f s VAL 82 Cb -0.10 -3.93 0.00 0.00 -1.53 0.00 0.00 36.38 30.82 2d9f s VAL 82 CO 0.33 -0.72 0.00 0.61 -3.33 0.00 0.00 175.10 171.98 2d9f n GLY 83 N 5.44 1.56 3.83 6.54 0.00 -0.41 -4.63 105.19 117.52 2d9f n GLY 83 Ca 0.20 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.07 3.33 -0.26 1.61 -6.30 -0.94 -4.57 118.70 111.49 2d9f s GLU 84 Ca 0.00 -0.20 -0.13 0.00 -2.50 0.00 0.00 54.97 52.14 2d9f s GLU 84 Cb 0.00 -3.09 -0.04 0.00 0.00 0.00 0.00 34.13 31.00 2d9f s GLU 84 CO 0.00 0.76 0.27 0.99 0.02 0.00 0.00 175.26 177.30 2d9f s THR 85 N -1.01 5.26 0.01 -1.70 2.01 0.39 -3.68 115.64 116.92 2d9f s THR 85 Ca 0.15 0.36 0.06 0.00 0.31 0.00 0.00 61.69 62.57 2d9f s THR 85 Cb -0.12 -3.60 -0.02 0.00 0.01 0.00 0.00 72.50 68.77 2d9f s THR 85 CO 0.04 0.23 -0.19 0.00 -0.69 0.00 0.00 174.62 174.01 2d9f s ALA 86 N 1.75 1.56 0.10 7.40 0.00 -0.81 0.71 121.76 132.47 2d9f s ALA 86 Ca 0.11 -0.86 0.02 0.00 0.00 0.00 0.00 51.96 51.23 2d9f s ALA 86 Cb -0.15 -0.36 -0.04 0.00 0.00 0.00 0.00 23.12 22.57 2d9f s ALA 86 CO 0.09 0.37 0.18 1.41 0.00 0.00 0.00 175.76 177.81 2d9f s MET 87 N -0.68 3.21 -0.05 0.00 -2.45 0.42 -1.28 119.30 118.47 2d9f s MET 87 Ca 0.07 -0.61 0.00 0.00 -1.25 0.00 0.00 55.69 53.90 2d9f s MET 87 Cb -0.08 -2.88 0.02 0.00 1.25 0.00 0.00 34.83 33.15 2d9f s MET 87 CO 0.00 0.56 -0.02 0.14 1.05 0.00 0.00 175.02 176.75 2d9f s VAL 88 N -1.57 0.43 -0.31 10.11 -7.23 0.31 -1.23 120.40 120.90 2d9f s VAL 88 Ca 0.33 -0.01 0.01 0.00 -1.81 0.00 0.00 61.98 60.50 2d9f s VAL 88 Cb -0.12 -0.51 0.10 0.00 0.56 0.00 0.00 36.38 36.41 2d9f s VAL 88 CO 0.26 0.22 0.07 0.42 -0.31 0.00 0.00 175.10 175.76 2d9f s THR 89 N 1.27 1.49 0.41 5.32 -4.23 -1.23 -1.84 115.64 116.82 2d9f s THR 89 Ca -0.06 -1.76 0.04 0.00 -1.18 0.00 0.00 61.69 58.74 2d9f s THR 89 Cb -0.14 -2.08 -0.05 0.00 1.34 0.00 0.00 72.50 71.57 2d9f s THR 89 CO -0.02 -0.59 0.04 0.00 -0.54 0.00 0.00 174.62 173.51 2d9f s ALA 90 N 1.31 3.11 0.32 3.99 0.00 -1.25 -3.09 121.76 126.14 2d9f s ALA 90 Ca 0.09 -1.65 -0.27 0.00 0.00 0.00 0.00 51.96 50.12 2d9f s ALA 90 Cb -0.18 0.37 -0.09 0.00 0.00 0.00 0.00 23.12 23.21 2d9f s ALA 90 CO -0.17 -0.19 1.04 0.34 0.00 0.00 0.00 175.76 176.79 2d9f s ASP 91 N -3.67 7.18 0.32 0.00 2.15 -1.26 -3.72 116.67 117.66 2d9f s ASP 91 Ca 0.27 2.09 0.24 0.00 0.43 0.00 0.00 52.55 55.58 2d9f s ASP 91 Cb 0.07 -2.60 1.06 0.00 -0.30 0.00 0.00 42.92 41.14 2d9f s ASP 91 CO 0.13 -0.19 1.09 -0.24 -0.17 0.00 0.00 175.17 175.79 2d9f n SER 92 N 0.76 0.13 -0.23 -0.34 2.88 -1.26 0.89 113.62 116.45 2d9f n SER 92 Ca 0.01 0.93 -0.01 0.00 -1.33 0.00 0.00 58.87 58.48 2d9f n SER 92 Cb 0.47 -0.46 0.06 0.00 -0.75 0.00 0.00 64.21 63.54 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 -0.04 0.00 -1.46 2.10 -1.90 0.43 116.57 115.70 2d9f h LYS 93 Ca 0.62 0.00 -0.06 0.00 -2.00 0.00 0.00 60.65 59.22 2d9f h LYS 93 Cb 2.06 0.01 -0.01 0.00 -0.90 0.00 0.00 32.23 33.39 2d9f h LYS 93 CO -0.29 -0.03 -0.26 1.88 -2.00 0.00 0.00 179.45 178.75 2d9f h TYR 94 N -0.04 0.00 0.00 0.07 0.05 0.15 -3.14 116.97 114.06 2d9f h TYR 94 Ca 0.31 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.09 2d9f h TYR 94 Cb 0.53 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.27 2d9f h TYR 94 CO -0.59 0.26 0.00 0.00 -1.05 0.00 0.00 178.16 176.78 2d9f n TYR 96 N -1.57 0.00 0.00 0.00 4.01 0.79 -4.45 117.16 115.93 2d9f n TYR 96 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 2d9f n TYR 96 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.03 2d9f n TYR 96 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2d9f n GLY 97 N 2.33 3.55 0.00 2.72 0.00 0.40 -4.70 105.19 109.49 2d9f n GLY 97 Ca 0.00 -1.84 0.08 0.00 0.00 0.00 0.00 46.02 44.26 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 -1.34 0.42 -0.08 1.61 -0.04 -1.26 -2.37 135.00 131.93 2d9f n PRO 98 Ca 0.00 0.03 -0.11 0.00 -0.04 0.00 0.00 63.50 63.38 2d9f n PRO 98 Cb 0.00 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 31.81 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 -1.07 0.68 0.00 0.54 10.64 -1.26 -4.54 117.38 122.37 2d9f n GLN 99 Ca 0.11 0.09 0.00 0.00 -1.83 0.00 0.00 57.00 55.36 2d9f n GLN 99 Cb 0.07 -1.59 0.00 0.00 -0.86 0.00 0.00 30.24 27.86 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 1.78 0.74 3.59 2.61 0.00 -1.00 -4.69 105.19 108.21 2d9f n GLY 100 Ca -0.31 -2.32 -0.28 0.00 0.00 0.00 0.00 46.02 43.11 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 -0.51 3.19 0.24 1.61 0.15 -1.15 -4.59 113.70 112.64 2d9f s SER 101 Ca 0.00 -1.66 0.08 0.00 0.70 0.00 0.00 55.95 55.07 2d9f s SER 101 Cb 0.00 0.48 -0.04 0.00 -1.71 0.00 0.00 66.02 64.75 2d9f s SER 101 CO 0.00 -0.90 0.06 -0.13 1.20 0.00 0.00 173.24 173.47 2d9f s ARG 102 N -3.76 2.51 -0.23 5.44 1.81 -1.26 -3.82 118.95 119.64 2d9f s ARG 102 Ca 0.19 -1.25 -0.20 0.00 -1.72 0.00 0.00 55.73 52.74 2d9f s ARG 102 Cb 0.02 -2.32 -0.09 0.00 -0.45 0.00 0.00 34.95 32.12 2d9f s ARG 102 CO 0.11 0.39 0.99 0.45 -0.68 0.00 0.00 175.30 176.56 2d9f n SER 103 N -0.84 0.35 -4.71 0.23 2.88 -1.26 -3.18 113.62 107.10 2d9f n SER 103 Ca -0.07 0.32 -0.42 0.00 -1.33 0.00 0.00 58.87 57.36 2d9f n SER 103 Cb 0.58 -0.42 -0.03 0.00 -0.75 0.00 0.00 64.21 63.59 2d9f n SER 103 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 2d9f s PRO 104 N 2.76 4.31 0.49 -1.46 0.04 -1.26 -5.13 135.00 134.74 2d9f s PRO 104 Ca 0.55 2.03 -0.21 0.00 0.04 0.00 0.00 61.00 63.42 2d9f s PRO 104 Cb -0.69 -3.37 -0.08 0.00 0.04 0.00 0.00 34.50 30.40 2d9f s PRO 104 CO 0.31 -0.48 1.08 -0.47 0.04 0.00 0.00 177.00 177.48 2d9f s TYR 105 N 1.55 2.93 -0.04 0.56 6.14 -1.19 -4.81 117.35 122.49 2d9f s TYR 105 Ca 0.64 1.57 -0.04 0.00 0.64 0.00 0.00 57.07 59.89 2d9f s TYR 105 Cb -0.35 -3.17 0.01 0.00 0.42 0.00 0.00 41.96 38.87 2d9f s TYR 105 CO 0.29 -1.08 0.11 0.96 0.64 0.00 0.00 175.55 176.47 2d9f s ILE 106 N -1.83 -0.00 0.47 3.14 -5.25 -1.25 -4.93 121.20 111.54 2d9f s ILE 106 Ca 0.67 0.01 -0.23 0.00 -0.99 0.00 0.00 60.65 60.11 2d9f s ILE 106 Cb -0.21 -0.17 -0.07 0.00 2.95 0.00 0.00 42.46 44.97 2d9f s ILE 106 CO 0.24 0.00 1.16 -2.16 -1.79 0.00 0.00 174.94 172.40 2d9f s PRO 107 N 0.09 3.73 0.64 0.37 0.04 -1.26 -2.95 135.00 135.66 2d9f s PRO 107 Ca -0.00 1.76 -0.16 0.00 0.04 0.00 0.00 61.00 62.64 2d9f s PRO 107 Cb -0.01 -2.38 -0.01 0.00 0.04 0.00 0.00 34.50 32.14 2d9f s PRO 107 CO -0.00 -0.57 1.11 -1.25 0.04 0.00 0.00 177.00 176.33 2d9f s PRO 108 N -2.74 2.89 -1.02 0.56 0.04 -1.26 -3.27 135.00 130.20 2d9f s PRO 108 Ca 0.64 1.42 -0.03 0.00 0.04 0.00 0.00 61.00 63.07 2d9f s PRO 108 Cb -0.28 -1.96 0.03 0.00 0.04 0.00 0.00 34.50 32.32 2d9f s PRO 108 CO 0.34 -1.19 0.18 0.72 0.04 0.00 0.00 177.00 177.09 2d9f n HIS 109 N -2.24 -1.62 -3.67 0.56 8.25 -1.26 -4.90 115.22 110.34 2d9f n HIS 109 Ca 0.11 0.17 -0.38 0.00 -0.26 0.00 0.00 57.72 57.35 2d9f n HIS 109 Cb 0.52 -2.63 -0.10 0.00 1.12 0.00 0.00 29.99 28.90 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 -2.66 3.31 0.72 -1.41 0.00 -1.20 -4.76 121.76 115.75 2d9f s ALA 110 Ca 0.14 -2.62 -0.17 0.00 0.00 0.00 0.00 51.96 49.32 2d9f s ALA 110 Cb -0.08 -2.63 -0.08 0.00 0.00 0.00 0.00 23.12 20.34 2d9f s ALA 110 CO 0.18 -1.88 0.14 0.00 0.00 0.00 0.00 175.76 174.20 2d9f n ALA 111 N 4.62 -2.59 -3.59 0.00 0.00 -1.26 -4.07 120.51 113.62 2d9f n ALA 111 Ca -0.03 -0.27 -0.12 0.00 0.00 0.00 0.00 53.44 53.01 2d9f n ALA 111 Cb 0.41 -1.62 -0.12 0.00 0.00 0.00 0.00 19.45 18.12 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 2.43 0.36 -0.37 0.00 1.43 -1.24 -3.50 118.68 117.79 2d9f s LEU 112 Ca 0.59 0.66 -0.25 0.00 -1.03 0.00 0.00 54.13 54.10 2d9f s LEU 112 Cb -0.36 0.99 0.01 0.00 0.03 0.00 0.00 46.19 46.87 2d9f s LEU 112 CO 0.64 -0.16 0.86 0.00 0.23 0.00 0.00 176.35 177.93 2d9f s LEU 114 N 3.33 2.91 -0.41 0.00 1.43 -0.77 -2.41 118.68 122.77 2d9f s LEU 114 Ca 0.35 -0.29 -0.10 0.00 -1.03 0.00 0.00 54.13 53.06 2d9f s LEU 114 Cb -0.12 -1.69 0.06 0.00 0.03 0.00 0.00 46.19 44.47 2d9f s LEU 114 CO 0.19 0.11 0.25 -0.70 0.23 0.00 0.00 176.35 176.43 2d9f s GLU 115 N 0.67 2.69 0.13 1.70 2.12 -1.21 -0.53 118.70 124.29 2d9f s GLU 115 Ca -0.04 -1.33 -0.14 0.00 0.36 0.00 0.00 54.97 53.82 2d9f s GLU 115 Cb -0.15 -3.78 -0.07 0.00 0.26 0.00 0.00 34.13 30.40 2d9f s GLU 115 CO 0.02 -0.88 0.53 0.08 -0.54 0.00 0.00 175.26 174.47 2d9f s VAL 116 N 1.47 4.89 -0.25 3.70 1.01 -0.40 -3.58 120.40 127.25 2d9f s VAL 116 Ca 0.02 0.78 -0.03 0.00 0.00 0.00 0.00 61.98 62.76 2d9f s VAL 116 Cb -0.22 -3.72 0.11 0.00 0.00 0.00 0.00 36.38 32.55 2d9f s VAL 116 CO 0.04 0.26 0.24 -0.89 0.00 0.00 0.00 175.10 174.74 2d9f s THR 117 N -1.45 -0.32 -0.32 3.92 2.01 -1.23 -1.92 115.64 116.33 2d9f s THR 117 Ca 0.37 -0.33 -0.29 0.00 0.31 0.00 0.00 61.69 61.75 2d9f s THR 117 Cb -0.15 -0.83 -0.01 0.00 0.01 0.00 0.00 72.50 71.52 2d9f s THR 117 CO 0.19 -0.36 1.61 -0.22 -0.69 0.00 0.00 174.62 175.15 2d9f s LEU 118 N 2.31 3.66 -0.07 4.42 1.98 -1.24 -2.51 118.68 127.24 2d9f s LEU 118 Ca 0.08 1.27 -0.04 0.00 -2.89 0.00 0.00 54.13 52.55 2d9f s LEU 118 Cb -0.15 -3.53 -0.01 0.00 0.66 0.00 0.00 46.19 43.15 2d9f s LEU 118 CO -0.23 -1.46 -0.08 0.29 -1.89 0.00 0.00 176.35 172.98 2d9f n LYS 119 N 8.04 0.21 -3.72 1.98 4.76 -0.72 -1.29 118.16 127.43 2d9f n LYS 119 Ca 0.19 0.38 -0.14 0.00 -2.87 0.00 0.00 58.31 55.88 2d9f n LYS 119 Cb 0.47 -1.19 -0.08 0.00 -1.84 0.00 0.00 35.03 32.38 2d9f n LYS 119 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2d9f s THR 120 N -1.58 0.05 -0.22 -0.18 -4.23 -1.20 -4.53 115.64 103.74 2d9f s THR 120 Ca -0.07 -0.41 0.01 0.00 -1.18 0.00 0.00 61.69 60.04 2d9f s THR 120 Cb 0.01 -0.71 0.06 0.00 1.34 0.00 0.00 72.50 73.19 2d9f s THR 120 CO 0.10 -0.22 -0.06 0.00 -0.54 0.00 0.00 174.62 173.90 2d9f s ALA 121 N -1.43 1.90 0.29 3.99 0.00 -1.26 -2.09 121.76 123.16 2d9f s ALA 121 Ca -0.12 -1.27 0.02 0.00 0.00 0.00 0.00 51.96 50.59 2d9f s ALA 121 Cb -0.04 -1.37 -0.05 0.00 0.00 0.00 0.00 23.12 21.66 2d9f s ALA 121 CO 0.04 -1.10 0.12 0.14 0.00 0.00 0.00 175.76 174.97 2d9f s VAL 122 N 1.43 0.50 -0.09 0.00 -7.23 -0.46 -4.97 120.40 109.58 2d9f s VAL 122 Ca -0.04 -2.00 -0.04 0.00 -1.81 0.00 0.00 61.98 58.08 2d9f s VAL 122 Cb -0.18 -2.58 -0.26 0.00 0.56 0.00 0.00 36.38 33.91 2d9f s VAL 122 CO -0.07 0.00 0.47 -0.78 -0.31 0.00 0.00 175.10 174.41 2d9f h ASP 123 N 2.28 0.38 -4.11 4.85 1.82 -1.95 0.54 116.42 120.24 2d9f h ASP 123 Ca -0.36 -0.80 -0.49 0.00 -0.39 0.00 0.00 57.03 54.98 2d9f h ASP 123 Cb 1.25 -0.12 0.07 0.00 0.68 0.00 0.00 39.33 41.20 2d9f h ASP 123 CO 0.58 1.71 0.41 0.00 -1.61 0.00 0.00 179.24 180.33 2d9f s ARG 124 N -2.57 3.36 0.54 0.28 1.70 -1.26 -4.45 118.95 116.55 2d9f s ARG 124 Ca -0.18 1.49 -0.20 0.00 -0.47 0.00 0.00 55.73 56.36 2d9f s ARG 124 Cb 0.07 -2.02 -0.06 0.00 -0.57 0.00 0.00 34.95 32.37 2d9f s ARG 124 CO 0.79 -0.82 1.13 -1.25 -1.08 0.00 0.00 175.30 174.08 2d9f s PRO 125 N -3.47 3.39 -0.08 3.89 0.04 -1.26 -4.81 135.00 132.70 2d9f s PRO 125 Ca 0.70 1.63 -0.25 0.00 0.04 0.00 0.00 61.00 63.12 2d9f s PRO 125 Cb -0.21 -2.04 -0.28 0.00 0.04 0.00 0.00 34.50 32.02 2d9f s PRO 125 CO 0.29 -0.83 0.89 -0.44 0.04 0.00 0.00 177.00 176.95 2d9f h ASP 126 N 1.27 0.26 -3.09 6.66 5.19 -1.97 -3.42 116.42 121.32 2d9f h ASP 126 Ca -0.50 -0.93 -0.70 0.00 -0.62 0.00 0.00 57.03 54.28 2d9f h ASP 126 Cb 1.26 -0.08 -0.19 0.00 0.18 0.00 0.00 39.33 40.49 2d9f h ASP 126 CO 0.57 1.17 0.04 -0.22 -3.12 0.00 0.00 179.24 177.68 2d9f s LEU 127 N -8.14 5.27 0.16 1.55 2.96 -1.26 -5.05 118.68 114.17 2d9f s LEU 127 Ca -0.16 -1.22 -0.21 0.00 -0.22 0.00 0.00 54.13 52.32 2d9f s LEU 127 Cb -0.00 -2.35 -0.08 0.00 0.50 0.00 0.00 46.19 44.26 2d9f s LEU 127 CO 0.76 -0.98 0.69 -1.83 -1.32 0.00 0.00 176.35 173.68 2d9f s GLU 128 N 2.54 4.31 -0.24 1.98 -1.05 -1.26 -5.06 118.70 119.92 2d9f s GLU 128 Ca 0.12 0.89 -0.07 0.00 -0.15 0.00 0.00 54.97 55.76 2d9f s GLU 128 Cb -0.22 -3.09 0.11 0.00 -0.44 0.00 0.00 34.13 30.49 2d9f s GLU 128 CO 0.08 0.52 0.50 1.41 0.95 0.00 0.00 175.26 178.72 2d9f s MET 129 N -1.51 0.42 1.01 -4.83 1.75 -1.26 -5.16 119.30 109.70 2d9f s MET 129 Ca 0.37 1.14 -0.12 0.00 -1.25 0.00 0.00 55.69 55.83 2d9f s MET 129 Cb -0.19 0.47 0.19 0.00 2.84 0.00 0.00 34.83 38.14 2d9f s MET 129 CO 0.22 -0.27 1.08 -1.12 -0.65 0.00 0.00 175.02 174.27 2d9f s SER 130 N 2.71 2.45 0.00 1.11 0.01 -1.26 -4.87 113.70 113.85 2d9f s SER 130 Ca -0.01 1.45 0.00 0.00 1.31 0.00 0.00 55.95 58.70 2d9f s SER 130 Cb -0.12 -2.13 0.00 0.00 0.21 0.00 0.00 66.02 63.98 2d9f s SER 130 CO -0.15 -3.27 0.00 0.61 0.41 0.00 0.00 173.24 170.83 2d9f n GLY 131 N -0.49 2.62 3.57 3.44 0.00 -1.26 -4.92 105.19 108.15 2d9f n GLY 131 Ca 0.06 -2.07 -0.27 0.00 0.00 0.00 0.00 46.02 43.74 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 -2.37 2.52 0.31 1.61 0.04 -1.26 -4.85 135.00 131.00 2d9f s PRO 132 Ca 0.00 -0.72 -0.14 0.00 0.04 0.00 0.00 61.00 60.17 2d9f s PRO 132 Cb 0.00 -5.15 0.02 0.00 0.04 0.00 0.00 34.50 29.41 2d9f s PRO 132 CO 0.00 -3.69 0.63 -1.54 0.04 0.00 0.00 177.00 172.44 2d9f s SER 133 N 7.28 0.04 0.08 6.66 1.04 -1.26 -5.06 113.70 122.48 2d9f s SER 133 Ca 0.69 -0.98 -0.21 0.00 0.48 0.00 0.00 55.95 55.93 2d9f s SER 133 Cb -0.04 0.71 -0.11 0.00 0.10 0.00 0.00 66.02 66.68 2d9f s SER 133 CO 0.06 -1.37 1.61 -1.28 0.98 0.00 0.00 173.24 173.24 2d9f h SER 134 N 2.09 0.20 0.00 7.02 0.87 -1.97 -3.53 113.55 118.24 2d9f h SER 134 Ca -0.26 -0.17 0.00 0.00 -1.23 0.00 0.00 61.79 60.13 2d9f h SER 134 Cb 1.25 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 63.16 2d9f h SER 134 CO 0.34 0.32 0.00 0.61 -0.53 0.00 0.00 176.83 177.57