#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1kta s SER 2 N 0.00 0.62 -1.25 0.00 0.15 -1.26 -5.03 113.70 106.93 1kta s SER 2 Ca 0.00 -1.45 -0.12 0.00 0.70 0.00 0.00 55.95 55.08 1kta s SER 2 Cb 0.00 0.49 -0.06 0.00 -1.71 0.00 0.00 66.02 64.74 1kta s SER 2 CO 0.00 -0.99 2.37 -1.20 1.20 0.00 0.00 173.24 174.62 1kta n SER 3 N -0.76 5.37 -3.54 5.45 7.64 -1.26 -4.63 113.62 121.88 1kta n SER 3 Ca 0.03 -2.60 -0.17 0.00 1.01 0.00 0.00 58.87 57.14 1kta n SER 3 Cb 0.64 -1.39 -0.06 0.00 -1.01 0.00 0.00 64.21 62.39 1kta n SER 3 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1kta s SER 4 N 3.27 -0.68 0.76 6.43 0.15 -1.26 -4.72 113.70 117.66 1kta s SER 4 Ca 0.54 0.87 -0.12 0.00 0.70 0.00 0.00 55.95 57.94 1kta s SER 4 Cb 0.14 0.73 0.06 0.00 -1.71 0.00 0.00 66.02 65.24 1kta s SER 4 CO -0.03 -0.54 1.11 0.72 1.20 0.00 0.00 173.24 175.71 1kta s PHE 5 N -0.87 2.42 0.02 3.44 -0.12 -1.26 -4.97 117.98 116.63 1kta s PHE 5 Ca -0.09 1.59 0.08 0.00 -0.05 0.00 0.00 56.93 58.46 1kta s PHE 5 Cb -0.01 -3.14 -0.02 0.00 -0.63 0.00 0.00 43.02 39.21 1kta s PHE 5 CO 0.08 -1.97 -0.23 0.15 -0.05 0.00 0.00 175.22 173.20 1kta s LYS 6 N -4.63 1.70 0.00 1.99 -0.14 -1.26 -4.80 119.74 112.60 1kta s LYS 6 Ca 0.64 -0.95 0.00 0.00 -1.36 0.00 0.00 55.97 54.30 1kta s LYS 6 Cb -0.19 -1.77 0.00 0.00 -1.68 0.00 0.00 37.83 34.19 1kta s LYS 6 CO 0.52 0.47 0.00 0.00 -0.76 0.00 0.00 175.35 175.58 1kta n ALA 7 N 2.08 0.37 -0.33 5.17 0.00 -1.26 -3.46 120.51 123.07 1kta n ALA 7 Ca -0.16 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.26 1kta n ALA 7 Cb 0.52 -0.34 -0.02 0.00 0.00 0.00 0.00 19.45 19.61 1kta n ALA 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1kta n ALA 8 N 0.12 3.04 -1.16 0.00 0.00 -1.26 -4.84 120.51 116.41 1kta n ALA 8 Ca 0.00 -0.26 -0.32 0.00 0.00 0.00 0.00 53.44 52.86 1kta n ALA 8 Cb 0.00 -1.71 -0.12 0.00 0.00 0.00 0.00 19.45 17.63 1kta n ALA 8 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1kta n ASP 9 N 2.02 0.23 -3.35 0.00 8.00 -1.22 -4.52 116.55 117.70 1kta n ASP 9 Ca 0.06 0.15 -0.13 0.00 0.71 0.00 0.00 54.79 55.58 1kta n ASP 9 Cb 0.31 -0.71 -0.03 0.00 -0.02 0.00 0.00 41.12 40.67 1kta n ASP 9 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 1kta n LEU 10 N 8.11 0.16 -0.98 0.64 7.94 0.25 -4.48 117.00 128.63 1kta n LEU 10 Ca 0.51 -0.99 0.10 0.00 -1.11 0.00 0.00 56.01 54.52 1kta n LEU 10 Cb 0.02 -0.35 -0.04 0.00 0.53 0.00 0.00 43.42 43.59 1kta n LEU 10 CO 0.73 -1.29 -0.23 0.00 -1.11 0.00 0.00 177.39 175.48 1kta n GLN 11 N 5.21 -1.68 -4.54 1.96 3.00 -1.26 -4.71 117.38 115.36 1kta n GLN 11 Ca 0.13 1.23 -0.32 0.00 -0.01 0.00 0.00 57.00 58.04 1kta n GLN 11 Cb 0.15 -2.21 -0.11 0.00 0.00 0.00 0.00 30.24 28.07 1kta n GLN 11 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.06 175.89 1kta s LEU 12 N -5.13 3.02 -0.40 1.08 2.96 -1.26 -3.54 118.68 115.41 1kta s LEU 12 Ca 0.00 -0.20 -0.00 0.00 -0.22 0.00 0.00 54.13 53.71 1kta s LEU 12 Cb 0.00 -1.73 0.11 0.00 0.50 0.00 0.00 46.19 45.07 1kta s LEU 12 CO 0.00 0.28 0.17 -0.70 -1.32 0.00 0.00 176.35 174.79 1kta s GLU 13 N -1.35 1.86 0.58 1.98 2.12 0.39 -4.98 118.70 119.31 1kta s GLU 13 Ca 0.16 -1.92 -0.19 0.00 0.36 0.00 0.00 54.97 53.38 1kta s GLU 13 Cb -0.11 -3.46 -0.04 0.00 0.26 0.00 0.00 34.13 30.78 1kta s GLU 13 CO 0.06 -1.04 1.20 -1.64 -0.54 0.00 0.00 175.26 173.30 1kta s MET 14 N 0.93 3.06 0.44 4.30 -1.94 -1.26 -3.41 119.30 121.42 1kta s MET 14 Ca 0.10 1.80 -0.23 0.00 -1.71 0.00 0.00 55.69 55.64 1kta s MET 14 Cb -0.22 -1.96 -0.08 0.00 2.01 0.00 0.00 34.83 34.59 1kta s MET 14 CO -0.05 -1.13 1.12 -0.08 -0.01 0.00 0.00 175.02 174.88 1kta s THR 15 N -1.61 3.33 -0.26 2.05 -1.32 -1.26 -4.79 115.64 111.78 1kta s THR 15 Ca 0.76 1.01 0.12 0.00 -1.21 0.00 0.00 61.69 62.37 1kta s THR 15 Cb -0.29 -3.52 0.54 0.00 -1.51 0.00 0.00 72.50 67.72 1kta s THR 15 CO 0.32 -0.00 1.50 0.00 -2.21 0.00 0.00 174.62 174.23 1kta n GLN 16 N -0.32 2.39 -2.69 7.08 1.13 -1.26 -4.66 117.38 119.06 1kta n GLN 16 Ca 0.06 -3.03 -0.06 0.00 -1.94 0.00 0.00 57.00 52.03 1kta n GLN 16 Cb 0.49 -1.88 0.10 0.00 0.11 0.00 0.00 30.24 29.06 1kta n GLN 16 CO 0.00 0.00 0.00 1.17 -1.44 0.00 0.00 177.06 176.79 1kta n LYS 17 N -0.84 0.54 -1.49 -1.09 4.81 -1.26 -5.15 118.16 113.67 1kta n LYS 17 Ca 0.31 -1.25 -0.45 0.00 -0.87 0.00 0.00 58.31 56.04 1kta n LYS 17 Cb 1.05 -0.55 -0.02 0.00 0.02 0.00 0.00 35.03 35.53 1kta n LYS 17 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 1kta n PRO 18 N 0.45 0.72 -2.03 1.64 -0.02 -1.26 -4.96 135.00 129.53 1kta n PRO 18 Ca -0.00 0.25 -0.30 0.00 -2.02 0.00 0.00 63.50 61.43 1kta n PRO 18 Cb 0.73 -1.48 0.01 0.00 -0.02 0.00 0.00 33.50 32.75 1kta n PRO 18 CO 0.00 0.00 0.00 -1.01 1.98 0.00 0.00 175.50 176.47 1kta s HIS 19 N -1.13 3.59 -0.15 6.00 3.76 -1.26 -5.02 115.29 121.08 1kta s HIS 19 Ca 0.61 1.17 -0.28 0.00 -0.15 0.00 0.00 55.06 56.41 1kta s HIS 19 Cb -0.76 -2.66 -0.01 0.00 1.11 0.00 0.00 32.58 30.26 1kta s HIS 19 CO 0.58 -0.65 0.94 0.21 -0.85 0.00 0.00 174.74 174.98 1kta s LYS 20 N -5.10 4.35 0.39 1.40 2.20 -1.26 -5.01 119.74 116.71 1kta s LYS 20 Ca 0.54 1.23 -0.27 0.00 -0.36 0.00 0.00 55.97 57.11 1kta s LYS 20 Cb -0.11 -3.57 -0.09 0.00 -1.51 0.00 0.00 37.83 32.55 1kta s LYS 20 CO 0.52 -0.37 1.37 0.15 -0.36 0.00 0.00 175.35 176.66 1kta s LYS 21 N 2.24 4.03 -0.45 4.03 3.01 -1.26 -4.78 119.74 126.56 1kta s LYS 21 Ca 0.44 2.31 -0.41 0.00 -1.01 0.00 0.00 55.97 57.29 1kta s LYS 21 Cb -0.17 -2.85 -0.18 0.00 -1.01 0.00 0.00 37.83 33.62 1kta s LYS 21 CO 0.14 -0.50 1.65 -2.30 0.51 0.00 0.00 175.35 174.85 1kta n PRO 22 N 0.28 0.00 -0.60 -1.68 -0.02 -1.26 -4.81 135.00 126.91 1kta n PRO 22 Ca 0.03 0.00 -0.30 0.00 -2.02 0.00 0.00 63.50 61.20 1kta n PRO 22 Cb 0.42 -1.35 0.20 0.00 -0.02 0.00 0.00 33.50 32.75 1kta n PRO 22 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1kta n GLY 23 N 4.98 -1.04 0.56 -1.23 0.00 -1.26 -4.85 105.19 102.34 1kta n GLY 23 Ca 0.37 -0.89 0.38 0.00 0.00 0.00 0.00 46.02 45.88 1kta n GLY 23 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1kta h PRO 24 N -2.20 0.00 0.00 1.61 0.11 -2.04 -2.20 132.00 127.27 1kta h PRO 24 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1kta h PRO 24 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1kta h PRO 24 CO 0.44 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.64 1kta n GLY 25 N -1.79 0.00 3.05 -0.55 0.00 -1.26 -4.80 105.19 99.85 1kta n GLY 25 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.30 1kta n GLY 25 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1kta n GLU 26 N 0.26 -0.94 -2.95 1.61 -0.58 -0.83 -4.86 120.64 112.35 1kta n GLU 26 Ca 0.00 -0.35 -0.38 0.00 -0.42 0.00 0.00 57.16 56.01 1kta n GLU 26 Cb 0.00 0.63 -0.01 0.00 -0.57 0.00 0.00 31.44 31.49 1kta n GLU 26 CO 0.00 0.00 0.00 -0.35 -0.48 0.00 0.00 177.13 176.30 1kta n PRO 27 N -0.85 4.32 -2.49 3.49 -0.04 -1.26 -5.00 135.00 133.17 1kta n PRO 27 Ca 0.00 -4.65 -0.42 0.00 -0.04 0.00 0.00 63.50 58.39 1kta n PRO 27 Cb 0.00 -2.43 -0.03 0.00 -0.04 0.00 0.00 33.50 31.01 1kta n PRO 27 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1kta s LEU 28 N -3.30 3.40 -0.18 1.53 1.43 -1.26 -5.00 118.68 115.30 1kta s LEU 28 Ca 0.37 0.13 -0.06 0.00 -1.03 0.00 0.00 54.13 53.54 1kta s LEU 28 Cb 0.14 -3.05 -0.04 0.00 0.03 0.00 0.00 46.19 43.27 1kta s LEU 28 CO -0.01 -1.62 0.03 -0.69 0.23 0.00 0.00 176.35 174.29 1kta s VAL 29 N 5.53 4.45 -0.09 -1.59 1.01 -1.26 -3.95 120.40 124.49 1kta s VAL 29 Ca 0.46 -0.16 -0.38 0.00 0.00 0.00 0.00 61.98 61.90 1kta s VAL 29 Cb -0.09 -2.99 -0.16 0.00 0.00 0.00 0.00 36.38 33.14 1kta s VAL 29 CO 0.24 0.46 1.54 0.33 0.00 0.00 0.00 175.10 177.67 1kta n PHE 30 N 3.63 1.78 -1.80 5.22 7.35 -1.26 -2.91 117.46 129.47 1kta n PHE 30 Ca -0.17 0.58 -0.19 0.00 -0.76 0.00 0.00 57.45 56.92 1kta n PHE 30 Cb 0.52 -2.40 -0.06 0.00 0.35 0.00 0.00 39.48 37.90 1kta n PHE 30 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1kta n GLY 31 N 3.33 1.18 0.05 7.13 0.00 -1.26 -4.85 105.19 110.76 1kta n GLY 31 Ca 0.22 -0.09 -0.01 0.00 0.00 0.00 0.00 46.02 46.14 1kta n GLY 31 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1kta n LYS 32 N -2.56 1.13 -4.86 1.61 4.76 -1.15 -4.96 118.16 112.13 1kta n LYS 32 Ca -0.20 -0.07 -0.33 0.00 -2.87 0.00 0.00 58.31 54.85 1kta n LYS 32 Cb 0.64 -1.38 -0.15 0.00 -1.84 0.00 0.00 35.03 32.30 1kta n LYS 32 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 1kta s THR 33 N -2.67 2.88 0.19 -0.18 2.01 -1.26 -5.11 115.64 111.49 1kta s THR 33 Ca -0.07 -0.72 0.09 0.00 0.31 0.00 0.00 61.69 61.30 1kta s THR 33 Cb 0.07 -2.19 -0.04 0.00 0.01 0.00 0.00 72.50 70.34 1kta s THR 33 CO 0.63 0.53 -0.08 -0.36 -0.69 0.00 0.00 174.62 174.65 1kta s PHE 34 N 0.33 2.66 0.91 4.92 0.40 -1.26 -3.85 117.98 122.09 1kta s PHE 34 Ca -0.12 -0.21 -0.13 0.00 -0.60 0.00 0.00 56.93 55.87 1kta s PHE 34 Cb -0.16 -1.29 0.18 0.00 0.51 0.00 0.00 43.02 42.26 1kta s PHE 34 CO 0.06 0.52 1.26 0.95 0.70 0.00 0.00 175.22 178.71 1kta s THR 35 N -1.76 2.03 0.33 0.64 -4.23 -0.92 -4.98 115.64 106.74 1kta s THR 35 Ca 0.26 -0.11 0.14 0.00 -1.18 0.00 0.00 61.69 60.80 1kta s THR 35 Cb -0.09 -2.92 0.09 0.00 1.34 0.00 0.00 72.50 70.92 1kta s THR 35 CO 0.16 0.00 1.79 0.44 -0.54 0.00 0.00 174.62 176.46 1kta h ASP 36 N -1.41 0.00 -2.61 3.99 3.32 -1.95 -3.43 116.42 114.33 1kta h ASP 36 Ca -0.43 0.00 -0.53 0.00 0.02 0.00 0.00 57.03 56.09 1kta h ASP 36 Cb 1.25 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 40.66 1kta h ASP 36 CO 0.40 0.41 -0.67 -1.00 -1.72 0.00 0.00 179.24 176.66 1kta s HIS 37 N -3.99 2.11 0.08 4.55 3.76 -1.26 0.00 115.29 120.53 1kta s HIS 37 Ca -0.02 -0.67 -0.07 0.00 -0.15 0.00 0.00 55.06 54.15 1kta s HIS 37 Cb 0.13 -1.24 -0.01 0.00 1.11 0.00 0.00 32.58 32.57 1kta s HIS 37 CO 0.72 0.35 0.14 0.00 -0.85 0.00 0.00 174.74 175.09 1kta s MET 38 N -3.71 0.77 0.00 1.40 0.23 0.40 -4.55 119.30 113.84 1kta s MET 38 Ca 0.31 -1.00 -0.01 0.00 -1.03 0.00 0.00 55.69 53.97 1kta s MET 38 Cb 0.04 0.31 -0.04 0.00 -1.53 0.00 0.00 34.83 33.61 1kta s MET 38 CO 0.14 -0.22 0.13 -1.17 -2.03 0.00 0.00 175.02 171.86 1kta s LEU 39 N -2.81 4.11 -0.11 0.18 2.96 -0.55 -1.01 118.68 121.46 1kta s LEU 39 Ca 0.05 0.23 -0.06 0.00 -0.22 0.00 0.00 54.13 54.12 1kta s LEU 39 Cb 0.05 -2.45 0.04 0.00 0.50 0.00 0.00 46.19 44.33 1kta s LEU 39 CO -0.10 0.26 0.26 -0.32 -1.32 0.00 0.00 176.35 175.13 1kta s MET 40 N -1.88 0.24 -0.02 1.98 -2.45 -0.30 -1.30 119.30 115.56 1kta s MET 40 Ca 0.25 0.51 -0.00 0.00 -1.25 0.00 0.00 55.69 55.20 1kta s MET 40 Cb -0.12 -0.06 0.03 0.00 1.25 0.00 0.00 34.83 35.93 1kta s MET 40 CO 0.17 -0.14 0.03 0.08 1.05 0.00 0.00 175.02 176.21 1kta s VAL 41 N 1.03 -0.04 0.02 10.11 1.01 0.60 -1.10 120.40 132.03 1kta s VAL 41 Ca -0.07 0.22 0.00 0.00 0.00 0.00 0.00 61.98 62.13 1kta s VAL 41 Cb -0.08 -0.10 -0.04 0.00 0.00 0.00 0.00 36.38 36.16 1kta s VAL 41 CO -0.07 0.10 0.09 -1.61 0.00 0.00 0.00 175.10 173.61 1kta s GLU 42 N 1.13 3.06 0.02 2.72 2.02 -1.26 -0.45 118.70 125.95 1kta s GLU 42 Ca -0.08 -0.52 0.05 0.00 0.02 0.00 0.00 54.97 54.43 1kta s GLU 42 Cb -0.13 -2.85 -0.02 0.00 0.10 0.00 0.00 34.13 31.23 1kta s GLU 42 CO -0.03 0.63 -0.14 -0.46 0.02 0.00 0.00 175.26 175.28 1kta s TRP 43 N -1.26 1.22 0.00 1.61 -0.00 0.39 -0.19 118.94 120.70 1kta s TRP 43 Ca 0.25 -0.31 0.00 0.00 -0.00 0.00 0.00 56.10 56.04 1kta s TRP 43 Cb -0.12 -0.75 0.00 0.00 -0.00 0.00 0.00 33.47 32.60 1kta s TRP 43 CO 0.17 0.02 0.00 0.27 -0.00 0.00 0.00 176.95 177.41 1kta n ASN 44 N 2.18 0.00 -0.37 5.86 0.23 -0.31 -1.07 115.26 121.79 1kta n ASN 44 Ca -0.17 0.00 0.06 0.00 -0.53 0.00 0.00 54.58 53.94 1kta n ASN 44 Cb 0.55 0.00 0.22 0.00 -2.08 0.00 0.00 39.78 38.47 1kta n ASN 44 CO 0.00 0.00 0.00 -2.24 -0.93 0.00 0.00 177.26 174.09 1kta h ASP 45 N 0.00 0.96 1.19 0.53 2.03 -1.99 0.28 116.42 119.42 1kta h ASP 45 Ca 0.00 0.04 0.00 0.00 -0.73 0.00 0.00 57.03 56.34 1kta h ASP 45 Cb 0.00 -0.16 0.00 0.00 -0.83 0.00 0.00 39.33 38.34 1kta h ASP 45 CO 0.00 0.54 0.00 0.11 -1.03 0.00 0.00 179.24 178.86 1kta h LYS 46 N 1.05 0.00 0.00 4.15 1.57 -1.96 -3.49 116.57 117.89 1kta h LYS 46 Ca 0.48 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.26 1kta h LYS 46 Cb 0.39 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.70 1kta h LYS 46 CO -0.24 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.05 1kta n GLY 47 N 0.53 -0.30 3.71 3.86 0.00 0.98 -4.99 105.19 108.98 1kta n GLY 47 Ca 0.03 -2.03 -0.42 0.00 0.00 0.00 0.00 46.02 43.60 1kta n GLY 47 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1kta s TRP 48 N 0.00 3.44 0.13 1.61 0.52 -1.26 -1.16 118.94 122.22 1kta s TRP 48 Ca 0.00 1.34 -0.02 0.00 0.02 0.00 0.00 56.10 57.44 1kta s TRP 48 Cb 0.00 -3.38 0.03 0.00 -1.15 0.00 0.00 33.47 28.97 1kta s TRP 48 CO 0.00 -1.12 0.17 0.41 0.02 0.00 0.00 176.95 176.43 1kta n GLY 49 N 3.19 -1.23 3.80 0.98 0.00 0.73 -4.79 105.19 107.87 1kta n GLY 49 Ca 0.09 -1.67 -0.38 0.00 0.00 0.00 0.00 46.02 44.06 1kta n GLY 49 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1kta s GLN 50 N -3.38 4.39 0.62 1.61 -0.21 -1.26 -4.70 119.66 116.73 1kta s GLN 50 Ca 0.10 1.00 -0.19 0.00 0.02 0.00 0.00 55.36 56.29 1kta s GLN 50 Cb -0.00 -3.03 -0.02 0.00 1.00 0.00 0.00 33.01 30.95 1kta s GLN 50 CO 0.07 0.47 1.29 -2.14 -2.12 0.00 0.00 175.29 172.86 1kta s PRO 51 N -1.63 2.71 -0.01 2.91 0.02 -1.26 -4.69 135.00 133.05 1kta s PRO 51 Ca 0.40 2.05 0.00 0.00 0.02 0.00 0.00 61.00 63.47 1kta s PRO 51 Cb -0.19 -1.92 0.01 0.00 0.02 0.00 0.00 34.50 32.42 1kta s PRO 51 CO 0.23 -1.47 0.01 0.50 -0.33 0.00 0.00 177.00 175.94 1kta s ARG 52 N -3.30 -0.01 -0.24 5.54 3.52 -0.25 0.84 118.95 125.05 1kta s ARG 52 Ca 0.80 0.06 -0.06 0.00 -0.13 0.00 0.00 55.73 56.40 1kta s ARG 52 Cb -0.37 -0.08 -0.02 0.00 -1.56 0.00 0.00 34.95 32.92 1kta s ARG 52 CO 0.40 -0.05 0.04 0.42 -0.81 0.00 0.00 175.30 175.29 1kta s ILE 53 N 0.34 4.06 0.21 4.11 1.01 -1.23 -1.15 121.20 128.55 1kta s ILE 53 Ca -0.03 -0.26 0.01 0.00 0.00 0.00 0.00 60.65 60.38 1kta s ILE 53 Cb -0.04 -2.89 -0.05 0.00 0.01 0.00 0.00 42.46 39.49 1kta s ILE 53 CO -0.01 0.36 0.06 0.00 0.00 0.00 0.00 174.94 175.35 1kta s GLN 54 N 1.57 1.23 0.64 2.79 -2.07 -0.18 -0.46 119.66 123.19 1kta s GLN 54 Ca 0.06 -1.63 -0.18 0.00 -1.82 0.00 0.00 55.36 51.79 1kta s GLN 54 Cb -0.15 -0.18 -0.01 0.00 -1.09 0.00 0.00 33.01 31.58 1kta s GLN 54 CO 0.02 -0.24 1.28 -2.14 -1.32 0.00 0.00 175.29 172.89 1kta s PRO 55 N -4.00 2.60 0.10 9.60 0.02 -1.22 -0.46 135.00 141.64 1kta s PRO 55 Ca 0.31 2.02 -0.32 0.00 0.02 0.00 0.00 61.00 63.03 1kta s PRO 55 Cb 0.07 -1.86 -0.11 0.00 0.02 0.00 0.00 34.50 32.62 1kta s PRO 55 CO 0.09 -1.55 1.80 0.34 -0.33 0.00 0.00 177.00 177.34 1kta n PHE 56 N -1.89 2.53 -3.90 6.54 7.35 0.10 -4.56 117.46 123.63 1kta n PHE 56 Ca 0.15 -0.05 -0.09 0.00 -0.76 0.00 0.00 57.45 56.71 1kta n PHE 56 Cb 0.48 -2.69 -0.04 0.00 0.35 0.00 0.00 39.48 37.58 1kta n PHE 56 CO 0.00 0.00 0.00 1.14 -0.76 0.00 0.00 176.76 177.14 1kta s GLN 57 N 2.54 1.54 0.72 -4.13 -2.07 -1.26 -5.01 119.66 111.99 1kta s GLN 57 Ca 0.83 -1.10 -0.11 0.00 -1.82 0.00 0.00 55.36 53.16 1kta s GLN 57 Cb -0.55 0.51 0.03 0.00 -1.09 0.00 0.00 33.01 31.91 1kta s GLN 57 CO 0.39 -0.65 1.07 -0.80 -1.32 0.00 0.00 175.29 173.98 1kta s ASN 58 N -2.96 5.04 0.20 12.60 0.01 -1.26 -5.05 114.94 123.53 1kta s ASN 58 Ca 0.17 1.70 -0.05 0.00 -0.71 0.00 0.00 52.86 53.96 1kta s ASN 58 Cb -0.02 -2.51 -0.06 0.00 0.41 0.00 0.00 41.25 39.08 1kta s ASN 58 CO 0.05 -1.67 0.45 -0.76 -1.51 0.00 0.00 177.10 173.66 1kta s LEU 59 N -5.69 4.20 -0.26 0.60 1.43 -1.26 -5.07 118.68 112.63 1kta s LEU 59 Ca 0.59 0.67 0.02 0.00 -1.03 0.00 0.00 54.13 54.39 1kta s LEU 59 Cb -0.15 -3.43 0.06 0.00 0.03 0.00 0.00 46.19 42.70 1kta s LEU 59 CO 0.55 -0.04 -0.10 -0.89 0.23 0.00 0.00 176.35 176.10 1kta s THR 60 N -1.80 2.26 -0.04 5.49 2.01 -1.26 -5.10 115.64 117.19 1kta s THR 60 Ca 0.43 -1.56 0.05 0.00 0.31 0.00 0.00 61.69 60.92 1kta s THR 60 Cb -0.11 -2.30 -0.01 0.00 0.01 0.00 0.00 72.50 70.08 1kta s THR 60 CO 0.25 -0.00 -0.20 -0.76 -0.69 0.00 0.00 174.62 173.22 1kta s LEU 61 N 1.13 1.99 0.35 4.42 1.43 -1.26 -5.12 118.68 121.62 1kta s LEU 61 Ca -0.08 -0.41 -0.29 0.00 -1.03 0.00 0.00 54.13 52.33 1kta s LEU 61 Cb -0.20 -1.12 -0.11 0.00 0.03 0.00 0.00 46.19 44.80 1kta s LEU 61 CO -0.05 0.21 1.45 -2.28 0.23 0.00 0.00 176.35 175.90 1kta s HIS 62 N -0.16 2.75 0.63 0.29 5.65 -1.26 -4.87 115.29 118.32 1kta s HIS 62 Ca -0.01 1.18 0.32 0.00 0.25 0.00 0.00 55.06 56.80 1kta s HIS 62 Cb -0.11 -3.92 1.74 0.00 -1.18 0.00 0.00 32.58 29.10 1kta s HIS 62 CO 0.02 -2.73 2.04 -1.35 -0.65 0.00 0.00 174.74 172.06 1kta h PRO 63 N 3.42 0.00 -0.49 2.88 0.11 -1.99 0.13 132.00 136.07 1kta h PRO 63 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1kta h PRO 63 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1kta h PRO 63 CO 0.67 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.46 1kta n ALA 64 N -2.11 2.42 -1.71 -0.75 0.00 -1.26 -4.96 120.51 112.14 1kta n ALA 64 Ca 0.00 -0.99 -0.64 0.00 0.00 0.00 0.00 53.44 51.81 1kta n ALA 64 Cb 0.36 -0.94 -0.09 0.00 0.00 0.00 0.00 19.45 18.78 1kta n ALA 64 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1kta n SER 65 N 1.27 1.40 0.33 0.00 2.88 0.44 -3.70 113.62 116.24 1kta n SER 65 Ca 0.20 1.16 0.15 0.00 -1.33 0.00 0.00 58.87 59.04 1kta n SER 65 Cb 0.53 -0.96 0.78 0.00 -0.75 0.00 0.00 64.21 63.81 1kta n SER 65 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 1kta h SER 66 N 5.34 0.00 0.22 -3.46 4.64 -1.52 -0.46 113.55 118.32 1kta h SER 66 Ca -0.45 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 60.82 1kta h SER 66 Cb 1.36 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.45 1kta h SER 66 CO 0.94 0.00 -0.20 0.77 -0.87 0.00 0.00 176.83 177.47 1kta h SER 67 N 0.00 0.00 0.00 4.97 4.64 -1.71 -2.11 113.55 119.34 1kta h SER 67 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 1kta h SER 67 Cb 0.74 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.83 1kta h SER 67 CO -0.00 0.20 -1.79 0.18 -0.87 0.00 0.00 176.83 174.55 1kta n LEU 68 N -4.22 0.19 -0.13 5.97 4.77 -0.19 -3.83 117.00 119.57 1kta n LEU 68 Ca -0.02 -0.10 -0.17 0.00 -0.03 0.00 0.00 56.01 55.69 1kta n LEU 68 Cb 0.26 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.23 1kta n LEU 68 CO 0.36 0.05 -1.32 1.41 -1.33 0.00 0.00 177.39 176.55 1kta n HIS 69 N -2.10 0.00 -1.52 -1.77 8.25 -1.18 -4.68 115.22 112.22 1kta n HIS 69 Ca -0.02 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.50 1kta n HIS 69 Cb 0.52 -1.00 0.16 0.00 1.12 0.00 0.00 29.99 30.79 1kta n HIS 69 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1kta n TYR 70 N -3.19 0.00 -3.99 4.41 4.01 -0.80 -5.01 117.16 112.58 1kta n TYR 70 Ca -0.44 -1.16 -0.29 0.00 -0.16 0.00 0.00 57.90 55.85 1kta n TYR 70 Cb 1.01 -0.20 -0.01 0.00 -0.31 0.00 0.00 39.34 39.84 1kta n TYR 70 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1kta n SER 71 N -1.03 -1.99 -4.41 7.72 2.88 -1.22 -4.84 113.62 110.74 1kta n SER 71 Ca 0.16 -0.95 -0.43 0.00 -1.33 0.00 0.00 58.87 56.31 1kta n SER 71 Cb 0.71 -3.22 0.00 0.00 -0.75 0.00 0.00 64.21 60.95 1kta n SER 71 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1kta n LEU 72 N -4.43 5.35 -3.73 2.46 4.77 -1.20 -4.78 117.00 115.45 1kta n LEU 72 Ca -0.14 -4.33 -0.13 0.00 -0.03 0.00 0.00 56.01 51.38 1kta n LEU 72 Cb 0.60 -1.64 -0.10 0.00 -2.33 0.00 0.00 43.42 39.95 1kta n LEU 72 CO 0.77 0.66 0.10 0.00 -1.33 0.00 0.00 177.39 177.59 1kta s GLN 73 N 2.19 0.49 0.09 3.23 -2.07 -1.26 0.16 119.66 122.50 1kta s GLN 73 Ca 0.46 0.60 -0.08 0.00 -1.82 0.00 0.00 55.36 54.51 1kta s GLN 73 Cb 0.01 0.23 -0.00 0.00 -1.09 0.00 0.00 33.01 32.15 1kta s GLN 73 CO 0.02 -0.06 0.19 -0.48 -1.32 0.00 0.00 175.29 173.63 1kta s LEU 74 N 0.29 1.42 0.28 2.60 0.05 -0.66 -2.68 118.68 119.99 1kta s LEU 74 Ca -0.01 -0.69 -0.10 0.00 0.05 0.00 0.00 54.13 53.39 1kta s LEU 74 Cb -0.03 1.01 0.00 0.00 -2.05 0.00 0.00 46.19 45.12 1kta s LEU 74 CO -0.00 -0.74 0.49 0.72 -0.55 0.00 0.00 176.35 176.27 1kta s PHE 75 N -3.87 0.54 0.27 3.48 -0.71 -0.85 -1.74 117.98 115.10 1kta s PHE 75 Ca 0.06 -0.89 0.02 0.00 -1.04 0.00 0.00 56.93 55.07 1kta s PHE 75 Cb 0.05 0.15 -0.05 0.00 -1.21 0.00 0.00 43.02 41.96 1kta s PHE 75 CO -0.10 -1.07 0.12 -1.21 -1.34 0.00 0.00 175.22 171.62 1kta s GLU 76 N -3.64 1.46 -0.23 1.99 0.41 -0.43 -4.74 118.70 113.51 1kta s GLU 76 Ca 0.24 -1.80 -0.08 0.00 -0.41 0.00 0.00 54.97 52.92 1kta s GLU 76 Cb -0.01 -0.17 0.10 0.00 -1.78 0.00 0.00 34.13 32.27 1kta s GLU 76 CO 0.12 -0.35 0.49 0.20 -0.49 0.00 0.00 175.26 175.23 1kta s GLY 77 N -3.32 -0.47 0.21 -1.39 0.00 -1.26 -3.85 107.32 97.24 1kta s GLY 77 Ca 0.37 1.77 -0.14 0.00 0.00 0.00 0.00 44.72 46.72 1kta s GLY 77 CO 0.15 2.58 0.45 -3.16 0.00 0.00 0.00 173.10 173.11 1kta s MET 78 N 2.64 1.39 0.12 2.90 0.23 -0.97 -4.93 119.30 120.67 1kta s MET 78 Ca -0.03 -1.09 0.09 0.00 -1.03 0.00 0.00 55.69 53.63 1kta s MET 78 Cb -0.12 0.47 -0.04 0.00 -1.53 0.00 0.00 34.83 33.61 1kta s MET 78 CO -0.15 -0.57 -0.22 0.15 -2.03 0.00 0.00 175.02 172.20 1kta s LYS 79 N -3.95 1.22 -0.06 3.16 1.02 -1.26 -0.27 119.74 119.60 1kta s LYS 79 Ca 0.16 -1.25 0.03 0.00 0.02 0.00 0.00 55.97 54.93 1kta s LYS 79 Cb 0.00 -1.53 -0.02 0.00 -0.52 0.00 0.00 37.83 35.76 1kta s LYS 79 CO 0.02 0.35 -0.14 0.00 -0.92 0.00 0.00 175.35 174.67 1kta s ALA 80 N -1.24 2.67 -0.02 5.17 0.00 0.11 -2.55 121.76 125.90 1kta s ALA 80 Ca 0.10 -0.96 0.08 0.00 0.00 0.00 0.00 51.96 51.18 1kta s ALA 80 Cb -0.10 -1.02 -0.02 0.00 0.00 0.00 0.00 23.12 21.98 1kta s ALA 80 CO 0.05 0.50 -0.25 -0.06 0.00 0.00 0.00 175.76 176.00 1kta s PHE 81 N -0.54 2.29 -0.25 0.00 0.40 0.29 -1.43 117.98 118.74 1kta s PHE 81 Ca 0.07 -0.44 -0.07 0.00 -0.60 0.00 0.00 56.93 55.90 1kta s PHE 81 Cb -0.12 -1.47 -0.03 0.00 0.51 0.00 0.00 43.02 41.92 1kta s PHE 81 CO 0.01 -0.04 0.06 0.21 0.70 0.00 0.00 175.22 176.16 1kta s LYS 82 N -0.59 3.62 0.91 0.44 2.20 -1.26 -0.32 119.74 124.74 1kta s LYS 82 Ca 0.10 -0.50 -0.13 0.00 -0.36 0.00 0.00 55.97 55.07 1kta s LYS 82 Cb -0.10 -3.29 0.14 0.00 -1.51 0.00 0.00 37.83 33.08 1kta s LYS 82 CO -0.01 -0.19 1.18 0.20 -0.36 0.00 0.00 175.35 176.17 1kta s GLY 83 N 1.60 1.62 0.31 5.54 0.00 -0.37 -4.80 107.32 111.23 1kta s GLY 83 Ca 0.06 -0.73 0.06 0.00 0.00 0.00 0.00 44.72 44.12 1kta s GLY 83 CO 0.03 -0.12 1.76 0.50 0.00 0.00 0.00 173.10 175.26 1kta h LYS 84 N -1.48 0.29 0.00 2.90 1.79 -1.90 0.18 116.57 118.35 1kta h LYS 84 Ca -0.47 -0.11 0.00 0.00 -2.18 0.00 0.00 60.65 57.88 1kta h LYS 84 Cb 1.31 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.94 1kta h LYS 84 CO 0.56 0.57 0.00 -0.40 -1.08 0.00 0.00 179.45 179.11 1kta n ASP 85 N -4.11 0.00 0.00 0.86 5.68 -1.26 -4.80 116.55 112.92 1kta n ASP 85 Ca -0.01 -0.18 0.00 0.00 -0.50 0.00 0.00 54.79 54.10 1kta n ASP 85 Cb 0.41 -0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.38 1kta n ASP 85 CO 0.00 0.00 0.00 1.67 -1.33 0.00 0.00 177.20 177.54 1kta n GLN 86 N -1.00 -0.49 -2.98 0.11 -0.06 0.64 -5.01 117.38 108.59 1kta n GLN 86 Ca 0.04 0.12 -0.39 0.00 -2.00 0.00 0.00 57.00 54.78 1kta n GLN 86 Cb 0.02 -3.76 -0.06 0.00 -4.06 0.00 0.00 30.24 22.38 1kta n GLN 86 CO 0.00 0.00 0.00 -1.14 -0.20 0.00 0.00 177.06 175.72 1kta s GLN 87 N -0.75 4.55 -0.09 3.69 2.00 -1.26 -4.72 119.66 123.07 1kta s GLN 87 Ca 0.00 1.15 -0.10 0.00 -2.00 0.00 0.00 55.36 54.40 1kta s GLN 87 Cb 0.00 -3.20 -0.05 0.00 0.80 0.00 0.00 33.01 30.56 1kta s GLN 87 CO 0.00 0.54 0.24 0.08 -0.50 0.00 0.00 175.29 175.65 1kta s VAL 88 N -1.21 5.33 -0.02 1.34 1.01 -1.26 -1.24 120.40 124.35 1kta s VAL 88 Ca 0.37 0.45 -0.03 0.00 0.00 0.00 0.00 61.98 62.77 1kta s VAL 88 Cb -0.22 -3.53 0.00 0.00 0.00 0.00 0.00 36.38 32.63 1kta s VAL 88 CO 0.26 0.57 0.07 -0.13 0.00 0.00 0.00 175.10 175.87 1kta s ARG 89 N -0.77 0.18 -0.07 2.72 0.52 0.57 0.21 118.95 122.30 1kta s ARG 89 Ca 0.18 -0.07 -0.12 0.00 -0.52 0.00 0.00 55.73 55.20 1kta s ARG 89 Cb -0.14 0.08 -0.05 0.00 0.52 0.00 0.00 34.95 35.36 1kta s ARG 89 CO 0.07 -0.03 0.30 -0.51 0.02 0.00 0.00 175.30 175.15 1kta s LEU 90 N -0.37 4.40 -0.45 2.53 1.43 0.27 0.11 118.68 126.59 1kta s LEU 90 Ca -0.04 0.71 -0.24 0.00 -1.03 0.00 0.00 54.13 53.53 1kta s LEU 90 Cb -0.03 -2.38 0.03 0.00 0.03 0.00 0.00 46.19 43.84 1kta s LEU 90 CO 0.00 0.30 0.84 0.12 0.23 0.00 0.00 176.35 177.85 1kta s PHE 91 N -0.73 2.97 -1.52 0.29 5.36 -1.06 -0.58 117.98 122.72 1kta s PHE 91 Ca 0.19 0.28 -0.02 0.00 -0.96 0.00 0.00 56.93 56.42 1kta s PHE 91 Cb -0.14 -3.77 0.00 0.00 -0.34 0.00 0.00 43.02 38.77 1kta s PHE 91 CO 0.08 -1.02 0.07 0.54 -1.46 0.00 0.00 175.22 173.44 1kta n ARG 92 N 6.88 -1.10 0.15 10.12 1.74 0.14 -4.80 116.66 129.79 1kta n ARG 92 Ca 0.04 0.12 0.16 0.00 -0.77 0.00 0.00 57.85 57.40 1kta n ARG 92 Cb 0.48 -3.60 0.74 0.00 -1.02 0.00 0.00 32.46 29.06 1kta n ARG 92 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 1kta h PRO 93 N -1.84 0.00 -0.85 5.56 0.13 -1.81 -2.33 132.00 130.86 1kta h PRO 93 Ca -0.66 0.00 0.05 0.00 -0.87 0.00 0.00 66.00 64.52 1kta h PRO 93 Cb 1.40 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.48 1kta h PRO 93 CO 0.69 0.00 0.56 -1.49 -0.23 0.00 0.00 178.00 177.53 1kta h TRP 94 N 0.00 0.98 -0.65 1.56 6.55 -1.95 -1.21 115.95 121.24 1kta h TRP 94 Ca 0.13 0.02 -0.05 0.00 0.95 0.00 0.00 58.89 59.94 1kta h TRP 94 Cb 0.57 -0.33 -0.03 0.00 -0.86 0.00 0.00 29.16 28.51 1kta h TRP 94 CO 0.00 0.54 0.19 -0.07 -1.05 0.00 0.00 178.44 178.05 1kta h LEU 95 N 0.99 0.93 -0.82 -4.49 3.38 -1.79 -0.07 115.31 113.43 1kta h LEU 95 Ca 0.36 -0.17 -0.11 0.00 0.09 0.00 0.00 57.88 58.05 1kta h LEU 95 Cb 0.15 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 1kta h LEU 95 CO -0.12 0.88 -0.27 0.78 0.09 0.00 0.00 178.44 179.80 1kta h ASN 96 N 0.96 0.59 -0.24 -0.43 2.35 -1.44 -1.43 115.58 115.94 1kta h ASN 96 Ca 0.21 -0.21 -0.06 0.00 -0.55 0.00 0.00 56.30 55.69 1kta h ASN 96 Cb 0.30 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.50 1kta h ASN 96 CO -0.01 0.84 -0.07 0.24 -1.65 0.00 0.00 177.43 176.78 1kta h MET 97 N 0.50 0.46 -0.59 0.81 2.86 -0.78 -1.06 114.93 117.13 1kta h MET 97 Ca 0.07 -0.18 0.08 0.00 -2.06 0.00 0.00 59.70 57.61 1kta h MET 97 Cb 0.72 -0.02 -0.06 0.00 0.06 0.00 0.00 31.60 32.30 1kta h MET 97 CO 0.06 0.70 0.25 -0.44 1.06 0.00 0.00 176.91 178.54 1kta h ASP 98 N 0.19 0.28 -0.58 1.22 3.45 -0.90 -1.66 116.42 118.43 1kta h ASP 98 Ca 0.06 0.06 -0.09 0.00 0.43 0.00 0.00 57.03 57.49 1kta h ASP 98 Cb 0.54 0.03 -0.02 0.00 -0.56 0.00 0.00 39.33 39.31 1kta h ASP 98 CO 0.03 0.18 0.01 -0.09 -1.57 0.00 0.00 179.24 177.79 1kta h ARG 99 N 0.45 1.03 -0.60 3.56 2.43 -1.11 -1.59 114.38 118.56 1kta h ARG 99 Ca 0.29 -0.31 -0.05 0.00 -0.81 0.00 0.00 59.98 59.10 1kta h ARG 99 Cb 0.32 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.74 1kta h ARG 99 CO -0.27 1.00 0.17 1.98 -1.51 0.00 0.00 179.97 181.35 1kta h MET 100 N 0.95 0.93 -0.27 0.20 4.05 -0.85 -0.41 114.93 119.53 1kta h MET 100 Ca 0.17 -0.21 -0.11 0.00 -0.28 0.00 0.00 59.70 59.27 1kta h MET 100 Cb 0.53 -0.13 -0.01 0.00 -0.80 0.00 0.00 31.60 31.19 1kta h MET 100 CO 0.03 0.84 -0.30 1.25 0.23 0.00 0.00 176.91 178.96 1kta h LEU 101 N 0.85 0.56 -0.54 3.39 5.85 -1.09 -0.34 115.31 123.99 1kta h LEU 101 Ca 0.19 -0.21 -0.07 0.00 0.84 0.00 0.00 57.88 58.63 1kta h LEU 101 Cb 0.31 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.16 1kta h LEU 101 CO -0.00 0.83 0.07 0.03 -0.34 0.00 0.00 178.44 179.03 1kta h ARG 102 N 0.47 0.90 -0.64 1.25 3.08 -0.95 -1.67 114.38 116.82 1kta h ARG 102 Ca 0.06 -0.25 -0.01 0.00 0.07 0.00 0.00 59.98 59.85 1kta h ARG 102 Cb 0.75 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 30.67 1kta h ARG 102 CO 0.06 0.88 0.35 0.77 -1.07 0.00 0.00 179.97 180.96 1kta h SER 103 N 0.78 0.79 -0.71 7.04 0.02 -0.75 -2.23 113.55 118.49 1kta h SER 103 Ca 0.16 -0.09 0.03 0.00 -0.84 0.00 0.00 61.79 61.05 1kta h SER 103 Cb 0.43 -0.20 -0.04 0.00 0.14 0.00 0.00 62.40 62.72 1kta h SER 103 CO 0.01 0.65 0.45 0.00 -1.14 0.00 0.00 176.83 176.81 1kta h ALA 104 N 1.17 0.92 -0.17 3.77 0.00 -0.78 -2.39 119.26 121.79 1kta h ALA 104 Ca 0.22 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 55.01 1kta h ALA 104 Cb 0.03 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1kta h ALA 104 CO -0.04 0.25 -0.30 0.52 0.00 0.00 0.00 179.25 179.68 1kta h MET 105 N 0.89 0.32 0.00 0.00 2.07 -1.05 1.00 114.93 118.16 1kta h MET 105 Ca 0.28 -0.13 -0.07 0.00 -2.07 0.00 0.00 59.70 57.72 1kta h MET 105 Cb -0.01 -0.02 -0.01 0.00 -1.87 0.00 0.00 31.60 29.69 1kta h MET 105 CO -0.10 0.60 -0.32 -0.09 1.07 0.00 0.00 176.91 178.07 1kta h ARG 106 N 0.29 0.00 -0.55 1.72 9.65 -0.90 -2.57 114.38 122.01 1kta h ARG 106 Ca 0.04 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.92 1kta h ARG 106 Cb 0.68 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.26 1kta h ARG 106 CO 0.05 0.32 0.00 1.28 2.80 0.00 0.00 179.97 184.42 1kta n LEU 107 N -4.13 4.66 -3.96 3.80 4.77 -1.03 -4.96 117.00 116.15 1kta n LEU 107 Ca -0.02 -2.58 -0.31 0.00 -0.03 0.00 0.00 56.01 53.07 1kta n LEU 107 Cb 0.37 -0.56 0.02 0.00 -2.33 0.00 0.00 43.42 40.91 1kta n LEU 107 CO 0.38 0.76 0.08 0.00 -1.33 0.00 0.00 177.39 177.28 1kta s LEU 109 N -7.27 4.23 0.22 0.00 1.43 0.29 -4.43 118.68 113.15 1kta s LEU 109 Ca 0.66 0.02 -0.32 0.00 -1.03 0.00 0.00 54.13 53.46 1kta s LEU 109 Cb -0.34 -2.77 -0.12 0.00 0.03 0.00 0.00 46.19 43.00 1kta s LEU 109 CO 0.85 -0.05 1.69 -0.81 0.23 0.00 0.00 176.35 178.26 1kta n PRO 110 N -1.26 2.73 -1.22 1.29 -0.04 -1.26 -4.42 135.00 130.83 1kta n PRO 110 Ca -0.09 0.98 -0.32 0.00 -0.04 0.00 0.00 63.50 64.04 1kta n PRO 110 Cb 0.57 -2.81 0.10 0.00 -0.04 0.00 0.00 33.50 31.32 1kta n PRO 110 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1kta s SER 111 N 1.01 4.21 0.17 3.54 0.15 -1.26 -4.96 113.70 116.55 1kta s SER 111 Ca 0.73 1.97 -0.10 0.00 0.70 0.00 0.00 55.95 59.25 1kta s SER 111 Cb -0.51 -2.54 -0.00 0.00 -1.71 0.00 0.00 66.02 61.25 1kta s SER 111 CO 0.36 -2.24 0.31 0.72 1.20 0.00 0.00 173.24 173.59 1kta s PHE 112 N -2.70 0.34 -0.26 3.44 -0.12 -1.26 -4.86 117.98 112.56 1kta s PHE 112 Ca 0.64 -0.70 -0.28 0.00 -0.05 0.00 0.00 56.93 56.55 1kta s PHE 112 Cb -0.20 -0.00 0.01 0.00 -0.63 0.00 0.00 43.02 42.19 1kta s PHE 112 CO 0.54 -0.74 0.98 0.34 -0.05 0.00 0.00 175.22 176.28 1kta s ASP 113 N -2.96 6.97 0.27 1.98 -1.08 -1.26 -4.94 116.67 115.65 1kta s ASP 113 Ca 0.16 1.17 -0.03 0.00 -0.52 0.00 0.00 52.55 53.34 1kta s ASP 113 Cb 0.03 -2.51 0.39 0.00 -1.46 0.00 0.00 42.92 39.38 1kta s ASP 113 CO -0.00 -0.68 1.91 0.11 0.52 0.00 0.00 175.17 177.02 1kta h LYS 114 N 7.70 1.17 -0.05 4.34 1.57 -1.99 -1.81 116.57 127.48 1kta h LYS 114 Ca -0.21 -0.07 -0.11 0.00 -1.87 0.00 0.00 60.65 58.39 1kta h LYS 114 Cb 1.07 -0.26 -0.01 0.00 0.08 0.00 0.00 32.23 33.10 1kta h LYS 114 CO 0.96 0.77 -0.47 -0.07 -0.57 0.00 0.00 179.45 180.07 1kta h LEU 115 N 1.20 0.14 -0.28 2.94 3.38 -1.99 -1.12 115.31 119.58 1kta h LEU 115 Ca 0.40 -0.06 -0.15 0.00 0.09 0.00 0.00 57.88 58.15 1kta h LEU 115 Cb 0.07 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 1kta h LEU 115 CO -0.14 0.60 -0.42 -0.33 0.09 0.00 0.00 178.44 178.24 1kta h GLU 116 N 0.11 0.79 -0.70 1.13 4.39 -1.69 -1.62 114.58 116.98 1kta h GLU 116 Ca 0.00 -0.47 -0.04 0.00 0.34 0.00 0.00 59.36 59.20 1kta h GLU 116 Cb 0.88 0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 29.54 1kta h GLU 116 CO 0.07 1.10 0.28 1.25 -1.16 0.00 0.00 179.01 180.55 1kta h LEU 117 N 0.54 0.97 -0.46 1.33 5.85 -1.27 -0.36 115.31 121.91 1kta h LEU 117 Ca 0.03 -0.17 0.01 0.00 0.84 0.00 0.00 57.88 58.58 1kta h LEU 117 Cb 1.02 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.78 1kta h LEU 117 CO 0.10 0.87 0.30 0.25 -0.34 0.00 0.00 178.44 179.62 1kta h LEU 118 N 1.00 0.51 -0.67 2.25 5.85 -1.06 0.62 115.31 123.81 1kta h LEU 118 Ca 0.23 -0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.92 1kta h LEU 118 Cb 0.21 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.08 1kta h LEU 118 CO -0.02 0.37 0.34 -0.08 -0.34 0.00 0.00 178.44 178.71 1kta h GLU 119 N 0.61 0.96 -0.81 1.25 4.57 -0.90 0.25 114.58 120.52 1kta h GLU 119 Ca 0.17 -0.14 -0.03 0.00 -1.18 0.00 0.00 59.36 58.19 1kta h GLU 119 Cb -0.05 -0.18 -0.04 0.00 -0.16 0.00 0.00 28.75 28.32 1kta h GLU 119 CO -0.05 0.76 0.39 0.00 -1.18 0.00 0.00 179.01 178.93 1kta h ILE 121 N 1.15 1.26 -0.20 0.00 2.04 -0.18 -0.84 117.51 120.74 1kta h ILE 121 Ca 0.28 -1.09 0.01 0.00 1.00 0.00 0.00 64.86 65.06 1kta h ILE 121 Cb 0.11 0.83 -0.02 0.00 -0.74 0.00 0.00 36.82 37.01 1kta h ILE 121 CO -0.04 0.39 0.10 -0.09 0.00 0.00 0.00 178.15 178.52 1kta h ARG 122 N 0.86 0.21 -0.69 2.37 2.43 0.50 -0.16 114.38 119.91 1kta h ARG 122 Ca 0.16 -0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.28 1kta h ARG 122 Cb 0.51 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.98 1kta h ARG 122 CO 0.03 0.14 0.29 0.00 -1.51 0.00 0.00 179.97 178.91 1kta h ARG 123 N 0.22 1.00 -0.20 0.20 2.47 -0.55 -0.66 114.38 116.86 1kta h ARG 123 Ca 0.08 -0.16 -0.01 0.00 -1.26 0.00 0.00 59.98 58.64 1kta h ARG 123 Cb 0.01 -0.17 -0.01 0.00 -1.65 0.00 0.00 29.97 28.15 1kta h ARG 123 CO -0.05 0.81 0.10 1.25 0.56 0.00 0.00 179.97 182.63 1kta h LEU 124 N 0.99 0.25 -0.88 3.04 5.85 -0.65 -1.61 115.31 122.29 1kta h LEU 124 Ca 0.23 -0.11 -0.05 0.00 0.84 0.00 0.00 57.88 58.80 1kta h LEU 124 Cb 0.17 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.10 1kta h LEU 124 CO -0.02 0.29 0.28 0.40 -0.34 0.00 0.00 178.44 179.04 1kta h ILE 125 N 0.20 1.25 -0.20 4.05 2.04 -0.56 -1.92 117.51 122.37 1kta h ILE 125 Ca 0.07 -0.81 0.04 0.00 1.00 0.00 0.00 64.86 65.16 1kta h ILE 125 Cb 0.10 0.39 -0.04 0.00 -0.74 0.00 0.00 36.82 36.54 1kta h ILE 125 CO -0.01 0.32 -0.05 -0.08 0.00 0.00 0.00 178.15 178.34 1kta h GLU 126 N 1.06 0.00 -0.52 2.37 4.81 -0.85 0.68 114.58 122.14 1kta h GLU 126 Ca 0.24 -0.00 0.07 0.00 -0.13 0.00 0.00 59.36 59.55 1kta h GLU 126 Cb 0.23 -0.00 -0.06 0.00 0.63 0.00 0.00 28.75 29.54 1kta h GLU 126 CO -0.02 0.00 0.19 0.28 -0.73 0.00 0.00 179.01 178.73 1kta h VAL 127 N 0.00 0.82 -0.49 0.32 2.07 -0.79 -1.59 116.25 116.60 1kta h VAL 127 Ca 0.09 -0.13 -0.04 0.00 0.82 0.00 0.00 66.70 67.45 1kta h VAL 127 Cb 0.14 0.42 -0.02 0.00 -1.52 0.00 0.00 31.29 30.31 1kta h VAL 127 CO -0.20 0.07 0.05 0.47 0.02 0.00 0.00 177.57 177.97 1kta n ASP 128 N -5.00 4.68 -0.35 0.57 8.00 -0.64 -4.64 116.55 119.17 1kta n ASP 128 Ca 0.06 -2.79 0.29 0.00 0.71 0.00 0.00 54.79 53.05 1kta n ASP 128 Cb 0.21 -0.66 0.59 0.00 -0.02 0.00 0.00 41.12 41.24 1kta n ASP 128 CO 0.00 0.00 0.00 0.07 -0.39 0.00 0.00 177.20 176.88 1kta h LYS 129 N 2.97 0.24 0.00 -1.24 2.10 0.14 0.17 116.57 120.95 1kta h LYS 129 Ca 0.05 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.68 1kta h LYS 129 Cb 1.76 -0.05 0.00 0.00 -0.90 0.00 0.00 32.23 33.03 1kta h LYS 129 CO 0.44 0.16 0.00 -0.25 -2.00 0.00 0.00 179.45 177.79 1kta n ASP 130 N -4.54 0.47 0.03 7.07 9.92 -1.26 -1.21 116.55 127.04 1kta n ASP 130 Ca 0.28 0.68 0.12 0.00 -0.53 0.00 0.00 54.79 55.34 1kta n ASP 130 Cb 1.08 -0.75 0.29 0.00 -0.64 0.00 0.00 41.12 41.09 1kta n ASP 130 CO 0.00 0.00 0.00 0.79 0.13 0.00 0.00 177.20 178.12 1kta n TRP 131 N -2.09 0.29 -2.44 1.24 7.02 0.60 -4.81 117.44 117.26 1kta n TRP 131 Ca 0.00 0.08 -0.43 0.00 -1.02 0.00 0.00 57.50 56.14 1kta n TRP 131 Cb 0.10 -0.50 -0.02 0.00 -2.42 0.00 0.00 31.31 28.47 1kta n TRP 131 CO 0.00 0.00 0.00 0.08 -2.02 0.00 0.00 177.69 175.75 1kta s VAL 132 N -3.07 3.98 1.02 -0.99 1.01 -0.35 -4.74 120.40 117.25 1kta s VAL 132 Ca 0.10 0.97 -0.11 0.00 0.00 0.00 0.00 61.98 62.93 1kta s VAL 132 Cb 0.16 -4.39 0.20 0.00 0.00 0.00 0.00 36.38 32.35 1kta s VAL 132 CO 0.67 -0.94 1.09 -2.16 0.00 0.00 0.00 175.10 173.76 1kta s PRO 133 N 4.90 0.21 0.00 2.72 0.04 -1.26 -4.91 135.00 136.70 1kta s PRO 133 Ca 0.55 1.17 0.00 0.00 0.04 0.00 0.00 61.00 62.76 1kta s PRO 133 Cb -0.11 -1.66 0.00 0.00 0.04 0.00 0.00 34.50 32.77 1kta s PRO 133 CO 0.31 -3.06 0.35 -0.40 0.04 0.00 0.00 177.00 174.24 1kta n ASP 134 N -4.49 0.11 -4.76 6.66 3.85 -1.26 -4.32 116.55 112.33 1kta n ASP 134 Ca 0.07 -1.04 -0.31 0.00 -0.71 0.00 0.00 54.79 52.80 1kta n ASP 134 Cb 0.53 0.00 0.09 0.00 -1.35 0.00 0.00 41.12 40.39 1kta n ASP 134 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1kta s ALA 135 N -0.04 2.25 0.08 2.12 0.00 -1.26 -4.89 121.76 120.02 1kta s ALA 135 Ca 0.00 0.31 -0.36 0.00 0.00 0.00 0.00 51.96 51.91 1kta s ALA 135 Cb 0.00 -3.29 -0.16 0.00 0.00 0.00 0.00 23.12 19.67 1kta s ALA 135 CO 0.00 -1.76 1.38 0.00 0.00 0.00 0.00 175.76 175.39 1kta n ALA 136 N -3.43 -0.68 -1.56 0.00 0.00 -1.26 -2.18 120.51 111.40 1kta n ALA 136 Ca 0.09 0.50 -0.16 0.00 0.00 0.00 0.00 53.44 53.88 1kta n ALA 136 Cb 0.53 -2.11 -0.06 0.00 0.00 0.00 0.00 19.45 17.80 1kta n ALA 136 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1kta n GLY 137 N 2.68 1.36 3.84 0.00 0.00 -1.26 -4.64 105.19 107.17 1kta n GLY 137 Ca 0.18 -0.27 -0.21 0.00 0.00 0.00 0.00 46.02 45.72 1kta n GLY 137 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1kta s THR 138 N -2.61 3.23 0.21 2.61 -4.23 -0.93 -3.52 115.64 110.41 1kta s THR 138 Ca 0.00 -1.42 -0.21 0.00 -1.18 0.00 0.00 61.69 58.87 1kta s THR 138 Cb 0.00 -3.11 0.07 0.00 1.34 0.00 0.00 72.50 70.81 1kta s THR 138 CO 0.00 -0.13 0.99 -0.94 -0.54 0.00 0.00 174.62 174.00 1kta s SER 139 N -4.00 -0.01 -0.22 3.99 1.04 -0.79 -4.77 113.70 108.94 1kta s SER 139 Ca 0.42 -0.73 -0.03 0.00 0.48 0.00 0.00 55.95 56.09 1kta s SER 139 Cb -0.04 0.56 -0.01 0.00 0.10 0.00 0.00 66.02 66.63 1kta s SER 139 CO 0.26 -1.10 -0.06 -0.22 0.98 0.00 0.00 173.24 173.11 1kta s LEU 140 N -3.32 2.83 -0.07 2.42 2.96 -0.51 0.70 118.68 123.69 1kta s LEU 140 Ca 0.20 -0.41 -0.20 0.00 -0.22 0.00 0.00 54.13 53.51 1kta s LEU 140 Cb -0.03 -1.72 -0.04 0.00 0.50 0.00 0.00 46.19 44.90 1kta s LEU 140 CO 0.06 -0.02 0.55 -0.47 -1.32 0.00 0.00 176.35 175.15 1kta s TYR 141 N 1.44 3.58 -0.17 5.38 5.04 0.16 -0.71 117.35 132.07 1kta s TYR 141 Ca 0.05 1.04 -0.03 0.00 -2.44 0.00 0.00 57.07 55.70 1kta s TYR 141 Cb -0.14 -2.60 -0.02 0.00 0.35 0.00 0.00 41.96 39.55 1kta s TYR 141 CO -0.04 0.23 -0.07 0.08 -1.34 0.00 0.00 175.55 174.41 1kta s VAL 142 N 0.36 3.40 -0.49 3.14 1.01 0.63 -0.93 120.40 127.52 1kta s VAL 142 Ca 0.29 -0.51 0.03 0.00 0.00 0.00 0.00 61.98 61.79 1kta s VAL 142 Cb -0.16 -2.49 0.13 0.00 0.00 0.00 0.00 36.38 33.85 1kta s VAL 142 CO 0.14 0.47 0.25 -0.60 0.00 0.00 0.00 175.10 175.36 1kta s ARG 143 N 0.82 1.70 0.39 2.72 6.06 -0.21 -2.30 118.95 128.13 1kta s ARG 143 Ca -0.02 -2.37 -0.22 0.00 -2.50 0.00 0.00 55.73 50.61 1kta s ARG 143 Cb -0.15 -2.92 -0.10 0.00 0.06 0.00 0.00 34.95 31.84 1kta s ARG 143 CO 0.01 -1.13 0.93 -2.14 -2.50 0.00 0.00 175.30 170.47 1kta s PRO 144 N -0.03 4.32 -0.07 5.12 0.02 -1.25 -2.16 135.00 140.95 1kta s PRO 144 Ca 0.17 1.14 -0.07 0.00 0.02 0.00 0.00 61.00 62.27 1kta s PRO 144 Cb -0.25 -2.39 0.02 0.00 0.02 0.00 0.00 34.50 31.90 1kta s PRO 144 CO 0.00 0.08 0.20 0.08 -0.33 0.00 0.00 177.00 177.03 1kta s VAL 145 N -1.99 0.01 -0.07 3.83 1.01 0.16 -1.32 120.40 122.03 1kta s VAL 145 Ca 0.58 -0.08 0.02 0.00 0.00 0.00 0.00 61.98 62.50 1kta s VAL 145 Cb -0.12 -0.31 0.02 0.00 0.00 0.00 0.00 36.38 35.97 1kta s VAL 145 CO 0.16 -0.04 -0.10 -0.22 0.00 0.00 0.00 175.10 174.91 1kta s LEU 146 N -0.07 1.48 0.08 3.92 2.96 -0.71 -0.84 118.68 125.51 1kta s LEU 146 Ca -0.02 -0.26 0.04 0.00 -0.22 0.00 0.00 54.13 53.68 1kta s LEU 146 Cb -0.02 -0.74 -0.03 0.00 0.50 0.00 0.00 46.19 45.90 1kta s LEU 146 CO 0.00 -0.01 -0.11 0.27 -1.32 0.00 0.00 176.35 175.18 1kta s ILE 147 N 0.90 0.92 0.59 6.68 -4.36 0.10 -1.65 121.20 124.38 1kta s ILE 147 Ca -0.10 -1.40 -0.14 0.00 -0.26 0.00 0.00 60.65 58.74 1kta s ILE 147 Cb -0.15 -1.10 -0.04 0.00 1.25 0.00 0.00 42.46 42.42 1kta s ILE 147 CO 0.01 -0.40 1.03 -0.83 0.24 0.00 0.00 174.94 174.98 1kta s GLY 148 N -2.02 1.93 -0.16 6.27 0.00 0.12 -0.86 107.32 112.61 1kta s GLY 148 Ca -0.00 0.17 0.12 0.00 0.00 0.00 0.00 44.72 45.01 1kta s GLY 148 CO 0.01 0.46 1.24 -2.01 0.00 0.00 0.00 173.10 172.80 1kta n ASN 149 N -2.20 -0.44 -4.71 1.64 5.15 0.52 -2.64 115.26 112.59 1kta n ASN 149 Ca 0.07 -2.08 -0.42 0.00 -0.60 0.00 0.00 54.58 51.55 1kta n ASN 149 Cb 0.54 0.22 -0.03 0.00 -0.53 0.00 0.00 39.78 39.97 1kta n ASN 149 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 1kta s GLU 150 N -0.58 4.49 -1.42 1.20 0.41 -1.23 -4.72 118.70 116.85 1kta s GLU 150 Ca 0.13 1.56 -0.07 0.00 -0.41 0.00 0.00 54.97 56.18 1kta s GLU 150 Cb 0.27 -3.43 0.05 0.00 -1.78 0.00 0.00 34.13 29.24 1kta s GLU 150 CO -0.08 -0.16 2.55 -0.35 -0.49 0.00 0.00 175.26 176.73 1kta n PRO 151 N 4.05 4.24 -3.84 0.39 -0.04 -1.26 -1.64 135.00 136.89 1kta n PRO 151 Ca 0.08 -3.04 -0.12 0.00 -0.04 0.00 0.00 63.50 60.38 1kta n PRO 151 Cb 0.49 -2.71 -0.13 0.00 -0.04 0.00 0.00 33.50 31.11 1kta n PRO 151 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1kta s SER 152 N 1.03 -0.10 0.00 3.54 0.15 -1.24 -4.89 113.70 112.19 1kta s SER 152 Ca 0.59 0.18 0.28 0.00 0.70 0.00 0.00 55.95 57.69 1kta s SER 152 Cb 0.18 0.21 1.09 0.00 -1.71 0.00 0.00 66.02 65.79 1kta s SER 152 CO -0.08 -0.06 1.77 0.18 1.20 0.00 0.00 173.24 176.26 1kta n LEU 153 N 2.92 0.67 -4.77 3.45 4.77 -1.26 -4.53 117.00 118.25 1kta n LEU 153 Ca -0.13 -0.09 -0.39 0.00 -0.03 0.00 0.00 56.01 55.36 1kta n LEU 153 Cb 0.59 -0.16 -0.02 0.00 -2.33 0.00 0.00 43.42 41.51 1kta n LEU 153 CO 0.22 0.12 0.91 -0.83 -1.33 0.00 0.00 177.39 176.49 1kta s GLY 154 N -2.46 2.94 -0.62 -0.72 0.00 -1.26 -4.93 107.32 100.27 1kta s GLY 154 Ca 0.28 1.12 -0.25 0.00 0.00 0.00 0.00 44.72 45.87 1kta s GLY 154 CO 0.48 1.70 1.06 0.14 0.00 0.00 0.00 173.10 176.48 1kta s VAL 155 N -1.27 4.17 0.29 1.40 1.01 -1.26 -4.94 120.40 119.79 1kta s VAL 155 Ca 0.54 0.29 -0.19 0.00 0.00 0.00 0.00 61.98 62.62 1kta s VAL 155 Cb -0.35 -4.68 0.06 0.00 0.00 0.00 0.00 36.38 31.40 1kta s VAL 155 CO 0.46 -1.38 0.86 -0.94 0.00 0.00 0.00 175.10 174.10 1kta s SER 156 N 3.22 -0.06 0.01 3.32 1.04 -1.26 -5.12 113.70 114.86 1kta s SER 156 Ca 0.32 -0.86 -0.30 0.00 0.48 0.00 0.00 55.95 55.59 1kta s SER 156 Cb -0.12 0.70 -0.07 0.00 0.10 0.00 0.00 66.02 66.63 1kta s SER 156 CO 0.18 -1.37 1.75 -1.58 0.98 0.00 0.00 173.24 173.20 1kta s GLN 157 N -2.63 4.17 0.67 4.02 0.74 -1.26 -4.95 119.66 120.42 1kta s GLN 157 Ca 0.16 2.36 -0.16 0.00 0.05 0.00 0.00 55.36 57.77 1kta s GLN 157 Cb -0.04 -3.91 0.01 0.00 1.10 0.00 0.00 33.01 30.17 1kta s GLN 157 CO 0.08 -0.84 1.17 -2.14 -0.55 0.00 0.00 175.29 173.01 1kta s PRO 158 N 3.70 2.60 0.00 1.67 0.02 -1.26 -4.91 135.00 136.82 1kta s PRO 158 Ca 0.78 1.64 0.12 0.00 0.02 0.00 0.00 61.00 63.55 1kta s PRO 158 Cb -0.38 -1.90 0.18 0.00 0.02 0.00 0.00 34.50 32.41 1kta s PRO 158 CO 0.34 -1.45 1.02 0.54 -0.33 0.00 0.00 177.00 177.11 1kta n ARG 159 N -2.31 1.41 -3.76 5.54 5.12 -1.26 -4.92 116.66 116.49 1kta n ARG 159 Ca 0.12 -1.52 -0.13 0.00 -1.93 0.00 0.00 57.85 54.40 1kta n ARG 159 Cb 0.51 -1.25 -0.13 0.00 -1.16 0.00 0.00 32.46 30.43 1kta n ARG 159 CO 0.00 0.00 0.00 0.50 -1.93 0.00 0.00 177.63 176.20 1kta s ARG 160 N -1.01 0.21 0.08 5.56 3.52 -1.26 -3.32 118.95 122.73 1kta s ARG 160 Ca 0.18 0.41 -0.03 0.00 -0.13 0.00 0.00 55.73 56.16 1kta s ARG 160 Cb 0.11 -0.03 -0.03 0.00 -1.56 0.00 0.00 34.95 33.44 1kta s ARG 160 CO 0.16 -0.11 0.05 0.00 -0.81 0.00 0.00 175.30 174.59 1kta s ALA 161 N 0.77 0.38 -0.04 6.12 0.00 -0.23 -0.36 121.76 128.40 1kta s ALA 161 Ca -0.05 -1.10 0.01 0.00 0.00 0.00 0.00 51.96 50.82 1kta s ALA 161 Cb -0.07 0.46 0.02 0.00 0.00 0.00 0.00 23.12 23.53 1kta s ALA 161 CO -0.05 -0.44 -0.06 -1.17 0.00 0.00 0.00 175.76 174.05 1kta s LEU 162 N -2.93 1.49 -0.14 0.00 2.96 -0.04 -0.46 118.68 119.56 1kta s LEU 162 Ca 0.10 -0.14 -0.01 0.00 -0.22 0.00 0.00 54.13 53.86 1kta s LEU 162 Cb 0.07 -0.47 -0.01 0.00 0.50 0.00 0.00 46.19 46.27 1kta s LEU 162 CO -0.08 -0.02 -0.12 -0.22 -1.32 0.00 0.00 176.35 174.60 1kta s LEU 163 N 0.68 2.73 0.09 -0.68 0.20 0.41 -0.72 118.68 121.38 1kta s LEU 163 Ca -0.10 -0.34 -0.06 0.00 0.69 0.00 0.00 54.13 54.33 1kta s LEU 163 Cb -0.13 -1.63 -0.02 0.00 -0.43 0.00 0.00 46.19 43.99 1kta s LEU 163 CO 0.01 0.14 0.12 0.72 -0.29 0.00 0.00 176.35 177.04 1kta s PHE 164 N 0.49 0.36 -0.02 5.38 -0.71 -0.02 -0.29 117.98 123.17 1kta s PHE 164 Ca -0.09 -0.82 0.00 0.00 -1.04 0.00 0.00 56.93 54.99 1kta s PHE 164 Cb -0.16 -0.20 0.02 0.00 -1.21 0.00 0.00 43.02 41.47 1kta s PHE 164 CO 0.04 -0.51 0.01 0.08 -1.34 0.00 0.00 175.22 173.50 1kta s VAL 165 N -3.91 0.09 0.17 -2.49 1.01 -0.42 0.40 120.40 115.24 1kta s VAL 165 Ca 0.09 0.09 0.07 0.00 0.00 0.00 0.00 61.98 62.23 1kta s VAL 165 Cb 0.06 -0.17 -0.04 0.00 0.00 0.00 0.00 36.38 36.23 1kta s VAL 165 CO -0.08 0.10 -0.15 0.27 0.00 0.00 0.00 175.10 175.24 1kta s ILE 166 N 0.76 1.60 0.05 2.22 -4.36 -0.92 -1.48 121.20 119.08 1kta s ILE 166 Ca -0.07 -2.00 0.08 0.00 -0.26 0.00 0.00 60.65 58.40 1kta s ILE 166 Cb -0.10 -1.85 -0.03 0.00 1.25 0.00 0.00 42.46 41.73 1kta s ILE 166 CO -0.02 -0.49 -0.23 -0.76 0.24 0.00 0.00 174.94 173.68 1kta s LEU 167 N -2.92 2.18 -0.06 0.37 1.43 -1.26 -1.04 118.68 117.38 1kta s LEU 167 Ca 0.17 -0.56 0.01 0.00 -1.03 0.00 0.00 54.13 52.71 1kta s LEU 167 Cb -0.03 -1.11 0.02 0.00 0.03 0.00 0.00 46.19 45.11 1kta s LEU 167 CO 0.05 0.20 -0.04 0.00 0.23 0.00 0.00 176.35 176.79 1kta s PRO 169 N 1.17 4.65 -0.03 0.00 0.02 -1.25 0.41 135.00 139.97 1kta s PRO 169 Ca -0.07 1.76 0.04 0.00 0.02 0.00 0.00 61.00 62.76 1kta s PRO 169 Cb -0.14 -3.18 -0.01 0.00 0.02 0.00 0.00 34.50 31.19 1kta s PRO 169 CO -0.01 0.24 -0.16 0.08 -0.33 0.00 0.00 177.00 176.82 1kta s VAL 170 N -1.18 1.28 1.11 3.83 1.01 0.22 -4.77 120.40 121.91 1kta s VAL 170 Ca 0.44 -0.66 -0.18 0.00 0.00 0.00 0.00 61.98 61.59 1kta s VAL 170 Cb -0.31 -1.10 0.25 0.00 0.00 0.00 0.00 36.38 35.22 1kta s VAL 170 CO 0.40 0.37 1.18 -0.83 0.00 0.00 0.00 175.10 176.22 1kta s GLY 171 N -0.09 1.65 0.54 4.51 0.00 -1.25 -1.89 107.32 110.78 1kta s GLY 171 Ca 0.00 -1.00 -0.19 0.00 0.00 0.00 0.00 44.72 43.52 1kta s GLY 171 CO 0.01 -0.17 1.12 0.00 0.00 0.00 0.00 173.10 174.06 1kta s ALA 172 N -3.30 2.70 -0.78 3.20 0.00 -1.23 -4.65 121.76 117.69 1kta s ALA 172 Ca 0.71 0.79 -0.25 0.00 0.00 0.00 0.00 51.96 53.22 1kta s ALA 172 Cb -0.08 -3.35 -0.05 0.00 0.00 0.00 0.00 23.12 19.64 1kta s ALA 172 CO 0.55 -0.75 1.98 -0.47 0.00 0.00 0.00 175.76 177.06 1kta s TYR 173 N -1.81 1.67 -0.26 0.00 5.04 -1.26 -3.69 117.35 117.04 1kta s TYR 173 Ca 0.72 0.83 -0.01 0.00 -2.44 0.00 0.00 57.07 56.17 1kta s TYR 173 Cb -0.23 -3.99 0.00 0.00 0.35 0.00 0.00 41.96 38.09 1kta s TYR 173 CO 0.27 -1.95 0.02 1.19 -1.34 0.00 0.00 175.55 173.74 1kta n PHE 174 N 14.04 -3.56 -0.62 4.97 0.99 -1.26 -4.78 117.46 127.23 1kta n PHE 174 Ca 0.34 1.63 -0.25 0.00 -0.00 0.00 0.00 57.45 59.17 1kta n PHE 174 Cb 0.49 -3.71 -0.07 0.00 -1.00 0.00 0.00 39.48 35.19 1kta n PHE 174 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.76 176.41 1kta n PRO 175 N 0.70 0.00 -3.22 -1.08 -0.04 -1.24 -4.60 135.00 125.52 1kta n PRO 175 Ca -0.03 -0.59 -0.01 0.00 -0.04 0.00 0.00 63.50 62.82 1kta n PRO 175 Cb 0.05 -1.91 -0.02 0.00 -0.04 0.00 0.00 33.50 31.59 1kta n PRO 175 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1kta s GLY 176 N 5.28 -1.14 0.00 0.55 0.00 -1.26 -5.04 107.32 105.71 1kta s GLY 176 Ca 0.38 0.09 0.00 0.00 0.00 0.00 0.00 44.72 45.19 1kta s GLY 176 CO 0.19 3.57 0.00 0.61 0.00 0.00 0.00 173.10 177.48 1kta n GLY 177 N 4.39 0.00 3.63 0.20 0.00 -1.26 -4.36 105.19 107.79 1kta n GLY 177 Ca 0.11 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.73 1kta n GLY 177 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1kta s SER 178 N -2.85 6.51 -0.27 1.61 0.01 -1.26 -5.03 113.70 112.41 1kta s SER 178 Ca 0.00 0.62 -0.36 0.00 1.31 0.00 0.00 55.95 57.52 1kta s SER 178 Cb 0.00 -2.30 -0.12 0.00 0.21 0.00 0.00 66.02 63.81 1kta s SER 178 CO 0.00 -0.28 2.04 1.33 0.41 0.00 0.00 173.24 176.75 1kta n VAL 179 N 4.99 0.30 -3.52 3.43 0.24 -1.26 -4.97 118.33 117.54 1kta n VAL 179 Ca -0.03 -0.20 -0.37 0.00 -2.04 0.00 0.00 64.34 61.70 1kta n VAL 179 Cb 0.50 -1.66 -0.06 0.00 -1.47 0.00 0.00 33.84 31.14 1kta n VAL 179 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 1kta s THR 180 N 5.99 5.23 0.69 3.34 2.01 -1.26 -4.94 115.64 126.70 1kta s THR 180 Ca 1.04 0.66 -0.11 0.00 0.31 0.00 0.00 61.69 63.59 1kta s THR 180 Cb -0.84 -3.66 0.01 0.00 0.01 0.00 0.00 72.50 68.01 1kta s THR 180 CO 0.52 0.45 1.06 -2.16 -0.69 0.00 0.00 174.62 173.80 1kta s PRO 181 N -0.03 2.97 0.25 4.92 0.04 -1.26 -4.60 135.00 137.29 1kta s PRO 181 Ca 0.20 0.92 0.11 0.00 0.04 0.00 0.00 61.00 62.27 1kta s PRO 181 Cb -0.14 -2.00 -0.05 0.00 0.04 0.00 0.00 34.50 32.36 1kta s PRO 181 CO 0.07 -1.07 -0.16 0.14 0.04 0.00 0.00 177.00 176.03 1kta s VAL 182 N -3.07 2.72 0.05 -0.36 -7.23 -0.25 -4.85 120.40 107.41 1kta s VAL 182 Ca 0.58 -2.18 0.04 0.00 -1.81 0.00 0.00 61.98 58.61 1kta s VAL 182 Cb -0.14 -2.41 -0.04 0.00 0.56 0.00 0.00 36.38 34.36 1kta s VAL 182 CO 0.55 -0.32 -0.04 -0.94 -0.31 0.00 0.00 175.10 174.03 1kta s SER 183 N -3.35 4.78 0.05 4.85 1.04 -1.26 -2.05 113.70 117.77 1kta s SER 183 Ca 0.28 -0.18 0.06 0.00 0.48 0.00 0.00 55.95 56.60 1kta s SER 183 Cb -0.06 -1.11 -0.03 0.00 0.10 0.00 0.00 66.02 64.92 1kta s SER 183 CO 0.15 0.23 -0.18 -0.76 0.98 0.00 0.00 173.24 173.66 1kta s LEU 184 N -1.87 2.19 -0.22 2.42 1.43 -0.33 -1.38 118.68 120.92 1kta s LEU 184 Ca 0.21 -0.52 -0.13 0.00 -1.03 0.00 0.00 54.13 52.66 1kta s LEU 184 Cb -0.11 -0.78 -0.04 0.00 0.03 0.00 0.00 46.19 45.28 1kta s LEU 184 CO 0.13 0.08 0.27 -0.22 0.23 0.00 0.00 176.35 176.84 1kta s LEU 185 N -1.29 4.14 -0.47 1.79 2.96 0.09 -0.46 118.68 125.44 1kta s LEU 185 Ca 0.04 0.32 0.03 0.00 -0.22 0.00 0.00 54.13 54.30 1kta s LEU 185 Cb -0.09 -2.30 0.12 0.00 0.50 0.00 0.00 46.19 44.42 1kta s LEU 185 CO 0.02 0.00 0.21 0.00 -1.32 0.00 0.00 176.35 175.26 1kta s ALA 186 N 1.13 3.20 -0.16 5.97 0.00 -0.33 -1.02 121.76 130.56 1kta s ALA 186 Ca 0.13 -3.01 0.01 0.00 0.00 0.00 0.00 51.96 49.08 1kta s ALA 186 Cb -0.14 -2.16 0.02 0.00 0.00 0.00 0.00 23.12 20.84 1kta s ALA 186 CO 0.06 -1.92 -0.15 0.34 0.00 0.00 0.00 175.76 174.09 1kta s ASP 187 N 0.26 2.85 0.00 0.00 -1.08 -1.26 -4.11 116.67 113.33 1kta s ASP 187 Ca 0.15 -0.56 0.06 0.00 -0.52 0.00 0.00 52.55 51.68 1kta s ASP 187 Cb -0.23 -1.26 0.27 0.00 -1.46 0.00 0.00 42.92 40.24 1kta s ASP 187 CO -0.03 -0.05 1.11 -2.65 0.52 0.00 0.00 175.17 174.07 1kta n PRO 188 N 4.73 0.04 0.28 4.34 -0.02 -1.26 -2.93 135.00 140.18 1kta n PRO 188 Ca -0.18 0.32 0.14 0.00 -2.02 0.00 0.00 63.50 61.77 1kta n PRO 188 Cb 0.50 -1.50 0.84 0.00 -0.02 0.00 0.00 33.50 33.32 1kta n PRO 188 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1kta h ALA 189 N 2.24 1.38 -3.13 3.55 0.00 -1.95 -3.42 119.26 117.92 1kta h ALA 189 Ca 0.00 -0.05 -0.63 0.00 0.00 0.00 0.00 54.91 54.23 1kta h ALA 189 Cb 0.08 -0.01 -0.19 0.00 0.00 0.00 0.00 17.79 17.67 1kta h ALA 189 CO 0.00 0.07 -0.58 -0.06 0.00 0.00 0.00 179.25 178.68 1kta s PHE 190 N -4.39 3.18 -0.26 0.00 0.40 -1.15 -5.07 117.98 110.69 1kta s PHE 190 Ca -0.04 -0.11 0.03 0.00 -0.60 0.00 0.00 56.93 56.21 1kta s PHE 190 Cb 0.14 -2.16 0.06 0.00 0.51 0.00 0.00 43.02 41.57 1kta s PHE 190 CO 0.56 -0.06 -0.10 0.42 0.70 0.00 0.00 175.22 176.74 1kta s ILE 191 N 0.94 2.17 0.14 0.64 1.01 -1.26 -4.58 121.20 120.25 1kta s ILE 191 Ca 0.04 -1.67 -0.00 0.00 0.00 0.00 0.00 60.65 59.01 1kta s ILE 191 Cb -0.14 -2.29 -0.18 0.00 0.01 0.00 0.00 42.46 39.86 1kta s ILE 191 CO 0.03 -0.06 1.32 -0.09 0.00 0.00 0.00 174.94 176.14 1kta h ARG 192 N 7.76 0.27 -3.06 2.79 2.43 -1.97 -3.48 114.38 119.13 1kta h ARG 192 Ca -0.18 -0.31 0.05 0.00 -0.81 0.00 0.00 59.98 58.73 1kta h ARG 192 Cb 1.04 0.09 -0.06 0.00 -0.42 0.00 0.00 29.97 30.62 1kta h ARG 192 CO 0.46 1.04 0.20 0.00 -1.51 0.00 0.00 179.97 180.16 1kta s ALA 193 N -3.14 -1.18 0.15 2.80 0.00 -1.26 -4.91 121.76 114.22 1kta s ALA 193 Ca -0.04 -0.27 -0.09 0.00 0.00 0.00 0.00 51.96 51.56 1kta s ALA 193 Cb 0.09 0.87 -0.01 0.00 0.00 0.00 0.00 23.12 24.08 1kta s ALA 193 CO 0.85 -0.99 0.28 1.67 0.00 0.00 0.00 175.76 177.56 1kta s TRP 194 N -3.91 0.32 0.23 0.00 -2.14 -1.26 -5.03 118.94 107.15 1kta s TRP 194 Ca 0.11 -0.70 -0.31 0.00 2.66 0.00 0.00 56.10 57.86 1kta s TRP 194 Cb -0.05 -0.04 -0.11 0.00 -3.10 0.00 0.00 33.47 30.18 1kta s TRP 194 CO 0.05 -0.69 1.55 0.08 -2.66 0.00 0.00 176.95 175.27 1kta s VAL 195 N -3.94 2.45 0.00 -0.66 1.01 -1.26 -1.01 120.40 116.99 1kta s VAL 195 Ca 0.14 0.35 0.00 0.00 0.00 0.00 0.00 61.98 62.48 1kta s VAL 195 Cb 0.03 -3.23 0.00 0.00 0.00 0.00 0.00 36.38 33.19 1kta s VAL 195 CO -0.02 0.04 0.00 0.61 0.00 0.00 0.00 175.10 175.73 1kta n GLY 196 N 2.89 0.80 0.00 4.51 0.00 -1.26 -5.04 105.19 107.10 1kta n GLY 196 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1kta n GLY 196 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1kta n GLY 197 N -2.00 1.71 0.70 -0.02 0.00 -0.18 -5.06 105.19 100.34 1kta n GLY 197 Ca 0.00 -1.77 0.06 0.00 0.00 0.00 0.00 46.02 44.31 1kta n GLY 197 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1kta n VAL 198 N 0.00 1.51 0.30 1.61 0.24 -1.26 -4.77 118.33 115.95 1kta n VAL 198 Ca 0.00 -2.36 0.19 0.00 -2.04 0.00 0.00 64.34 60.13 1kta n VAL 198 Cb 0.00 0.09 0.84 0.00 -1.47 0.00 0.00 33.84 33.30 1kta n VAL 198 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 1kta h GLY 199 N 0.76 0.00 -2.09 7.63 0.00 -1.77 -2.34 103.07 105.26 1kta h GLY 199 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.28 1kta h GLY 199 CO 0.02 0.00 0.00 1.16 0.00 0.00 0.00 176.54 177.72 1kta n ASN 200 N -3.06 3.12 -4.21 0.19 2.04 -1.13 -2.88 115.26 109.34 1kta n ASN 200 Ca -0.00 -2.31 -0.22 0.00 -0.44 0.00 0.00 54.58 51.60 1kta n ASN 200 Cb 0.23 -0.48 -0.13 0.00 -2.53 0.00 0.00 39.78 36.87 1kta n ASN 200 CO 0.00 0.00 0.00 -0.31 -0.44 0.00 0.00 177.26 176.51 1kta s TYR 201 N -1.77 1.53 -1.24 -2.53 2.02 -0.88 -4.59 117.35 109.88 1kta s TYR 201 Ca 0.30 -0.38 -0.10 0.00 -0.37 0.00 0.00 57.07 56.52 1kta s TYR 201 Cb 0.20 -0.89 0.18 0.00 -0.40 0.00 0.00 41.96 41.06 1kta s TYR 201 CO 0.13 0.09 1.72 1.17 -1.57 0.00 0.00 175.55 177.09 1kta n LYS 202 N 1.66 3.65 -3.87 -0.62 4.81 -1.26 -4.95 118.16 117.58 1kta n LYS 202 Ca -0.18 -3.72 -0.37 0.00 -0.87 0.00 0.00 58.31 53.17 1kta n LYS 202 Cb 0.54 -2.90 -0.06 0.00 0.02 0.00 0.00 35.03 32.63 1kta n LYS 202 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1kta s LEU 203 N -0.04 4.39 0.39 3.14 1.43 -1.26 -2.02 118.68 124.70 1kta s LEU 203 Ca 0.39 0.47 0.11 0.00 -1.03 0.00 0.00 54.13 54.07 1kta s LEU 203 Cb 0.06 -2.08 0.90 0.00 0.03 0.00 0.00 46.19 45.10 1kta s LEU 203 CO 0.01 0.40 1.93 1.23 0.23 0.00 0.00 176.35 180.15 1kta h GLY 204 N 5.02 0.89 1.80 -3.19 0.00 -1.85 -1.39 103.07 104.35 1kta h GLY 204 Ca -0.55 -0.25 0.01 0.00 0.00 0.00 0.00 47.33 46.55 1kta h GLY 204 CO 0.59 0.12 0.09 -1.33 0.00 0.00 0.00 176.54 176.01 1kta h GLY 205 N 0.59 0.00 2.00 4.60 0.00 -1.86 -0.27 103.07 108.12 1kta h GLY 205 Ca 0.36 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.63 1kta h GLY 205 CO -0.13 0.00 -0.29 3.43 0.00 0.00 0.00 176.54 179.55 1kta h ASN 206 N 0.00 0.00 0.14 0.19 -0.26 -1.62 -3.36 115.58 110.67 1kta h ASN 206 Ca 0.02 0.00 -0.36 0.00 -0.56 0.00 0.00 56.30 55.40 1kta h ASN 206 Cb 0.20 0.00 -0.04 0.00 -1.06 0.00 0.00 38.32 37.42 1kta h ASN 206 CO -0.00 0.29 -2.09 -1.22 -1.06 0.00 0.00 177.43 173.35 1kta n TYR 207 N -3.61 0.87 -0.22 1.19 4.02 -0.12 -4.48 117.16 114.81 1kta n TYR 207 Ca -0.01 0.20 0.02 0.00 -0.01 0.00 0.00 57.90 58.11 1kta n TYR 207 Cb 0.42 -1.12 0.12 0.00 -0.02 0.00 0.00 39.34 38.74 1kta n TYR 207 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 1kta h GLY 208 N 1.81 0.72 2.00 2.72 0.00 -1.69 0.12 103.07 108.77 1kta h GLY 208 Ca -0.45 0.07 0.00 0.00 0.00 0.00 0.00 47.33 46.95 1kta h GLY 208 CO 0.04 -0.21 0.00 -1.05 0.00 0.00 0.00 176.54 175.32 1kta n PRO 209 N -5.27 0.03 0.04 4.80 -0.02 -1.26 -2.47 135.00 130.84 1kta n PRO 209 Ca 0.10 0.36 0.13 0.00 -2.02 0.00 0.00 63.50 62.07 1kta n PRO 209 Cb 0.38 -1.56 0.35 0.00 -0.02 0.00 0.00 33.50 32.65 1kta n PRO 209 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1kta n THR 210 N -1.61 0.22 -0.11 3.45 -2.24 0.43 -4.17 114.28 110.25 1kta n THR 210 Ca 0.02 -0.14 -0.06 0.00 -2.27 0.00 0.00 64.05 61.61 1kta n THR 210 Cb 0.12 -0.21 0.02 0.00 -2.10 0.00 0.00 70.33 68.16 1kta n THR 210 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 1kta h VAL 211 N 0.00 0.90 -0.56 2.28 2.07 -1.54 0.49 116.25 119.89 1kta h VAL 211 Ca 0.00 -0.11 -0.09 0.00 0.82 0.00 0.00 66.70 67.33 1kta h VAL 211 Cb 0.62 0.57 -0.02 0.00 -1.52 0.00 0.00 31.29 30.93 1kta h VAL 211 CO 0.00 0.06 0.01 0.25 0.02 0.00 0.00 177.57 177.90 1kta h LEU 212 N 0.31 0.93 -0.53 2.57 5.85 -1.81 -1.71 115.31 120.92 1kta h LEU 212 Ca 0.17 -0.25 -0.13 0.00 0.84 0.00 0.00 57.88 58.52 1kta h LEU 212 Cb 0.14 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 40.91 1kta h LEU 212 CO -0.17 0.98 -0.19 0.58 -0.34 0.00 0.00 178.44 179.31 1kta h VAL 213 N 0.88 1.27 -0.48 1.05 2.07 -1.58 -1.89 116.25 117.57 1kta h VAL 213 Ca 0.16 -1.35 -0.08 0.00 0.82 0.00 0.00 66.70 66.26 1kta h VAL 213 Cb 0.51 1.08 -0.02 0.00 -1.52 0.00 0.00 31.29 31.34 1kta h VAL 213 CO 0.02 0.47 -0.02 -0.61 0.02 0.00 0.00 177.57 177.45 1kta h GLN 214 N 0.86 0.80 -0.79 1.57 5.75 -0.76 -1.46 115.11 121.08 1kta h GLN 214 Ca 0.12 -0.23 0.01 0.00 -0.15 0.00 0.00 58.65 58.40 1kta h GLN 214 Cb 0.76 -0.09 -0.04 0.00 1.07 0.00 0.00 27.48 29.18 1kta h GLN 214 CO 0.06 0.82 0.52 1.96 -2.65 0.00 0.00 178.83 179.55 1kta h GLN 215 N 0.75 1.04 -0.26 1.69 4.20 -0.83 -2.34 115.11 119.35 1kta h GLN 215 Ca 0.14 -0.06 0.01 0.00 0.06 0.00 0.00 58.65 58.79 1kta h GLN 215 Cb 0.48 -0.24 -0.02 0.00 0.30 0.00 0.00 27.48 28.01 1kta h GLN 215 CO 0.02 0.69 0.16 1.49 -0.67 0.00 0.00 178.83 180.53 1kta h GLU 216 N 1.08 0.32 -0.66 1.46 4.57 -0.79 -0.39 114.58 120.17 1kta h GLU 216 Ca 0.29 -0.02 0.13 0.00 -1.18 0.00 0.00 59.36 58.58 1kta h GLU 216 Cb -0.12 -0.07 -0.10 0.00 -0.16 0.00 0.00 28.75 28.30 1kta h GLU 216 CO -0.06 0.21 0.14 0.00 -1.18 0.00 0.00 179.01 178.12 1kta h ALA 217 N 1.11 0.80 0.25 2.92 0.00 -0.97 0.35 119.26 123.72 1kta h ALA 217 Ca 0.10 0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 1kta h ALA 217 Cb -0.02 0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1kta h ALA 217 CO -0.04 -0.32 -0.12 -0.07 0.00 0.00 0.00 179.25 178.70 1kta h LEU 218 N 0.25 -0.29 -1.80 0.00 4.07 -0.92 0.35 115.31 116.99 1kta h LEU 218 Ca 0.36 -0.08 0.26 0.00 0.08 0.00 0.00 57.88 58.50 1kta h LEU 218 Cb 0.57 0.07 -0.05 0.00 1.08 0.00 0.00 40.66 42.33 1kta h LEU 218 CO -0.46 -0.09 0.67 0.50 -1.08 0.00 0.00 178.44 177.98 1kta h LYS 219 N -0.47 0.14 -0.60 1.13 3.64 0.23 0.45 116.57 121.10 1kta h LYS 219 Ca -0.03 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1kta h LYS 219 Cb 0.35 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.14 1kta h LYS 219 CO 0.06 0.09 0.00 0.54 -2.27 0.00 0.00 179.45 177.87 1kta n ARG 220 N -4.36 2.74 -0.89 1.90 1.74 0.11 -4.93 116.66 112.97 1kta n ARG 220 Ca 0.21 -2.14 0.00 0.00 -0.77 0.00 0.00 57.85 55.15 1kta n ARG 220 Cb 0.94 -1.60 0.00 0.00 -1.02 0.00 0.00 32.46 30.77 1kta n ARG 220 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1kta n GLY 221 N 1.17 0.52 3.79 -0.13 0.00 0.16 -5.04 105.19 105.66 1kta n GLY 221 Ca 0.20 -0.28 -0.22 0.00 0.00 0.00 0.00 46.02 45.71 1kta n GLY 221 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1kta n GLU 223 N -1.15 0.67 -4.12 0.00 1.02 -0.48 -3.16 120.64 113.43 1kta n GLU 223 Ca -0.06 0.09 -0.13 0.00 -0.02 0.00 0.00 57.16 57.03 1kta n GLU 223 Cb 0.59 -1.61 -0.06 0.00 -0.02 0.00 0.00 31.44 30.33 1kta n GLU 223 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 1kta s GLN 224 N -2.56 1.67 -0.14 3.49 -0.21 -0.94 -4.90 119.66 116.07 1kta s GLN 224 Ca -0.08 -1.65 -0.02 0.00 0.02 0.00 0.00 55.36 53.62 1kta s GLN 224 Cb 0.07 0.40 -0.02 0.00 1.00 0.00 0.00 33.01 34.45 1kta s GLN 224 CO 0.83 -0.66 -0.06 0.08 -2.12 0.00 0.00 175.29 173.36 1kta s VAL 225 N -3.54 3.67 -0.38 1.09 1.01 -1.26 -0.73 120.40 120.26 1kta s VAL 225 Ca 0.32 -0.44 -0.14 0.00 0.00 0.00 0.00 61.98 61.72 1kta s VAL 225 Cb 0.01 -2.58 0.00 0.00 0.00 0.00 0.00 36.38 33.82 1kta s VAL 225 CO 0.17 0.51 0.26 -0.22 0.00 0.00 0.00 175.10 175.83 1kta s LEU 226 N 0.25 4.81 -0.14 3.92 2.96 -0.19 0.08 118.68 130.38 1kta s LEU 226 Ca -0.05 -0.70 -0.29 0.00 -0.22 0.00 0.00 54.13 52.87 1kta s LEU 226 Cb -0.14 -2.14 -0.01 0.00 0.50 0.00 0.00 46.19 44.40 1kta s LEU 226 CO 0.04 -0.35 1.00 0.26 -1.32 0.00 0.00 176.35 175.97 1kta s TRP 227 N 1.69 3.47 0.20 5.38 0.52 -0.48 -4.30 118.94 125.41 1kta s TRP 227 Ca 0.05 1.54 0.05 0.00 0.02 0.00 0.00 56.10 57.76 1kta s TRP 227 Cb -0.18 -3.19 -0.04 0.00 -1.15 0.00 0.00 33.47 28.91 1kta s TRP 227 CO 0.10 -0.28 0.23 -0.51 0.02 0.00 0.00 176.95 176.51 1kta s LEU 228 N 2.29 4.03 -0.05 2.99 1.43 -1.26 -1.30 118.68 126.81 1kta s LEU 228 Ca 0.46 -0.06 -0.05 0.00 -1.03 0.00 0.00 54.13 53.46 1kta s LEU 228 Cb -0.17 -2.60 0.01 0.00 0.03 0.00 0.00 46.19 43.46 1kta s LEU 228 CO 0.15 0.01 0.15 -0.47 0.23 0.00 0.00 176.35 176.41 1kta s TYR 229 N -1.90 -0.16 0.00 0.29 5.04 -0.30 -4.80 117.35 115.53 1kta s TYR 229 Ca 0.33 0.38 0.00 0.00 -2.44 0.00 0.00 57.07 55.34 1kta s TYR 229 Cb -0.09 0.05 0.00 0.00 0.35 0.00 0.00 41.96 42.27 1kta s TYR 229 CO 0.26 -0.09 0.00 0.41 -1.34 0.00 0.00 175.55 174.79 1kta n GLY 230 N 2.93 -1.40 0.25 8.97 0.00 -1.26 -0.33 105.19 114.35 1kta n GLY 230 Ca -0.13 -1.58 0.11 0.00 0.00 0.00 0.00 46.02 44.43 1kta n GLY 230 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1kta h PRO 231 N 0.00 0.00 0.00 1.61 0.11 -2.01 -0.05 132.00 131.66 1kta h PRO 231 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1kta h PRO 231 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 1kta h PRO 231 CO 0.00 0.15 0.00 -3.47 -0.21 0.00 0.00 178.00 174.47 1kta n ASP 232 N -3.64 0.00 -3.67 -2.05 -0.08 -1.26 -4.95 116.55 100.90 1kta n ASP 232 Ca -0.01 0.05 -0.27 0.00 -1.51 0.00 0.00 54.79 53.05 1kta n ASP 232 Cb 0.28 -0.34 0.04 0.00 2.34 0.00 0.00 41.12 43.43 1kta n ASP 232 CO 0.00 0.00 0.00 1.41 0.12 0.00 0.00 177.20 178.73 1kta n HIS 233 N -1.34 -1.94 -2.56 -0.67 8.25 -0.03 -4.20 115.22 112.73 1kta n HIS 233 Ca 0.12 0.62 -0.38 0.00 -0.26 0.00 0.00 57.72 57.81 1kta n HIS 233 Cb 0.25 -3.76 -0.05 0.00 1.12 0.00 0.00 29.99 27.55 1kta n HIS 233 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 1kta s GLN 234 N -5.87 4.45 -0.09 -0.41 -0.21 0.55 -1.57 119.66 116.51 1kta s GLN 234 Ca 0.31 1.61 -0.30 0.00 0.02 0.00 0.00 55.36 57.00 1kta s GLN 234 Cb -0.10 -2.88 -0.02 0.00 1.00 0.00 0.00 33.01 31.01 1kta s GLN 234 CO 0.84 0.10 1.07 -0.51 -2.12 0.00 0.00 175.29 174.67 1kta s LEU 235 N -1.99 4.25 0.00 2.90 1.02 0.25 -1.15 118.68 123.97 1kta s LEU 235 Ca 0.50 1.63 0.00 0.00 0.02 0.00 0.00 54.13 56.28 1kta s LEU 235 Cb -0.26 -3.56 0.00 0.00 0.02 0.00 0.00 46.19 42.39 1kta s LEU 235 CO 0.33 -0.50 0.00 0.35 0.02 0.00 0.00 176.35 176.55 1kta n THR 236 N 4.59 0.00 -3.72 5.49 -2.24 -0.42 -4.62 114.28 113.36 1kta n THR 236 Ca 0.10 0.36 -0.10 0.00 -2.27 0.00 0.00 64.05 62.14 1kta n THR 236 Cb 0.48 -1.35 -0.05 0.00 -2.10 0.00 0.00 70.33 67.30 1kta n THR 236 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1kta s GLU 237 N -0.83 1.03 -0.41 -0.78 -1.05 -1.25 -4.38 118.70 111.03 1kta s GLU 237 Ca 0.00 -0.81 0.02 0.00 -0.15 0.00 0.00 54.97 54.03 1kta s GLU 237 Cb 0.00 0.43 0.11 0.00 -0.44 0.00 0.00 34.13 34.23 1kta s GLU 237 CO 0.00 -0.39 0.15 0.54 0.95 0.00 0.00 175.26 176.51 1kta s VAL 238 N -3.83 2.64 0.00 1.83 0.11 0.94 -1.38 120.40 120.71 1kta s VAL 238 Ca 0.05 -2.53 0.00 0.00 -2.93 0.00 0.00 61.98 56.57 1kta s VAL 238 Cb 0.03 -2.87 0.00 0.00 -1.53 0.00 0.00 36.38 32.00 1kta s VAL 238 CO -0.10 -0.68 0.00 0.61 -3.33 0.00 0.00 175.10 171.60 1kta n GLY 239 N 4.04 1.88 2.39 6.54 0.00 0.11 -2.29 105.19 117.87 1kta n GLY 239 Ca 0.03 -0.18 -0.17 0.00 0.00 0.00 0.00 46.02 45.70 1kta n GLY 239 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1kta n THR 240 N 0.00 2.00 -3.71 2.61 -2.24 -1.26 -5.00 114.28 106.67 1kta n THR 240 Ca 0.00 -3.88 -0.14 0.00 -2.27 0.00 0.00 64.05 57.76 1kta n THR 240 Cb 0.00 -0.32 -0.08 0.00 -2.10 0.00 0.00 70.33 67.84 1kta n THR 240 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 1kta s MET 241 N -3.59 0.78 0.57 -0.78 -1.94 -0.97 -4.72 119.30 108.65 1kta s MET 241 Ca 0.41 -0.21 -0.10 0.00 -1.71 0.00 0.00 55.69 54.08 1kta s MET 241 Cb 0.39 0.35 -0.04 0.00 2.01 0.00 0.00 34.83 37.54 1kta s MET 241 CO -0.02 -0.24 0.97 -0.80 -0.01 0.00 0.00 175.02 174.91 1kta s ASN 242 N -1.54 6.29 -0.04 3.03 0.01 -0.40 -0.04 114.94 122.26 1kta s ASN 242 Ca -0.11 1.33 0.03 0.00 -0.71 0.00 0.00 52.86 53.40 1kta s ASN 242 Cb -0.03 -2.42 -0.03 0.00 0.41 0.00 0.00 41.25 39.18 1kta s ASN 242 CO 0.03 -0.76 -0.11 -0.51 -1.51 0.00 0.00 177.10 174.24 1kta s ILE 243 N -2.99 3.37 0.05 0.60 2.07 -1.26 -0.31 121.20 122.72 1kta s ILE 243 Ca 0.54 -0.70 0.05 0.00 -1.41 0.00 0.00 60.65 59.13 1kta s ILE 243 Cb -0.11 -2.38 -0.02 0.00 0.13 0.00 0.00 42.46 40.08 1kta s ILE 243 CO 0.49 0.53 -0.13 -0.36 -1.91 0.00 0.00 174.94 173.55 1kta s PHE 244 N -0.83 1.16 -0.06 3.50 0.40 0.23 -4.16 117.98 118.22 1kta s PHE 244 Ca 0.13 -0.39 0.01 0.00 -0.60 0.00 0.00 56.93 56.09 1kta s PHE 244 Cb -0.11 -0.68 0.02 0.00 0.51 0.00 0.00 43.02 42.76 1kta s PHE 244 CO 0.03 0.03 -0.07 0.08 0.70 0.00 0.00 175.22 175.99 1kta s VAL 245 N -0.99 0.74 -0.23 -0.44 1.01 -0.65 -1.45 120.40 118.40 1kta s VAL 245 Ca -0.00 -0.24 -0.03 0.00 0.00 0.00 0.00 61.98 61.71 1kta s VAL 245 Cb -0.08 -0.74 0.00 0.00 0.00 0.00 0.00 36.38 35.56 1kta s VAL 245 CO 0.01 0.27 -0.04 -0.47 0.00 0.00 0.00 175.10 174.88 1kta s TYR 246 N 0.91 2.99 0.24 5.22 5.04 0.82 -1.05 117.35 131.51 1kta s TYR 246 Ca -0.11 -1.10 -0.21 0.00 -2.44 0.00 0.00 57.07 53.21 1kta s TYR 246 Cb -0.15 -2.10 0.06 0.00 0.35 0.00 0.00 41.96 40.12 1kta s TYR 246 CO 0.01 -0.60 0.92 1.67 -1.34 0.00 0.00 175.55 176.21 1kta s TRP 247 N 1.44 0.01 -0.29 4.97 -2.14 -0.48 -0.96 118.94 121.49 1kta s TRP 247 Ca 0.04 -0.46 -0.16 0.00 2.66 0.00 0.00 56.10 58.19 1kta s TRP 247 Cb -0.15 0.72 -0.03 0.00 -3.10 0.00 0.00 33.47 30.91 1kta s TRP 247 CO -0.03 -1.10 0.40 0.99 -2.66 0.00 0.00 176.95 174.55 1kta s THR 248 N -2.67 5.14 0.00 0.66 2.01 -0.64 0.96 115.64 121.11 1kta s THR 248 Ca 0.17 0.47 0.00 0.00 0.31 0.00 0.00 61.69 62.64 1kta s THR 248 Cb -0.03 -3.76 0.00 0.00 0.01 0.00 0.00 72.50 68.71 1kta s THR 248 CO 0.06 0.06 0.00 1.57 -0.69 0.00 0.00 174.62 175.62 1kta n HIS 249 N 5.41 -1.87 1.86 4.92 -0.00 -0.82 -4.78 115.22 119.95 1kta n HIS 249 Ca -0.08 0.00 0.03 0.00 0.46 0.00 0.00 57.72 58.14 1kta n HIS 249 Cb 0.50 0.00 0.21 0.00 -0.12 0.00 0.00 29.99 30.58 1kta n HIS 249 CO 0.00 0.00 0.00 0.39 0.46 0.00 0.00 176.34 177.19 1kta n GLU 250 N -0.97 0.93 -0.01 1.57 1.02 -1.26 -2.30 120.64 119.62 1kta n GLU 250 Ca 0.00 0.00 0.01 0.00 -0.02 0.00 0.00 57.16 57.15 1kta n GLU 250 Cb 0.00 -1.12 0.01 0.00 -0.02 0.00 0.00 31.44 30.32 1kta n GLU 250 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1kta n ASP 251 N -0.62 1.71 -0.10 1.62 3.85 -1.26 -4.97 116.55 116.79 1kta n ASP 251 Ca 0.05 -1.62 -0.01 0.00 -0.71 0.00 0.00 54.79 52.50 1kta n ASP 251 Cb 0.02 -0.02 -0.01 0.00 -1.35 0.00 0.00 41.12 39.77 1kta n ASP 251 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1kta n GLY 252 N -0.19 0.45 3.62 6.12 0.00 -0.97 -5.02 105.19 109.20 1kta n GLY 252 Ca 0.01 -0.15 -0.38 0.00 0.00 0.00 0.00 46.02 45.50 1kta n GLY 252 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1kta s VAL 253 N -1.80 5.26 0.22 1.61 1.01 -1.26 -4.81 120.40 120.63 1kta s VAL 253 Ca 0.00 0.38 -0.31 0.00 0.00 0.00 0.00 61.98 62.04 1kta s VAL 253 Cb 0.00 -3.61 -0.11 0.00 0.00 0.00 0.00 36.38 32.66 1kta s VAL 253 CO 0.00 0.24 1.63 -0.22 0.00 0.00 0.00 175.10 176.75 1kta s LEU 254 N 1.65 4.36 0.15 3.92 2.96 -1.26 -1.94 118.68 128.52 1kta s LEU 254 Ca 0.11 2.81 -0.21 0.00 -0.22 0.00 0.00 54.13 56.62 1kta s LEU 254 Cb -0.15 -3.61 0.06 0.00 0.50 0.00 0.00 46.19 42.99 1kta s LEU 254 CO 0.09 -0.90 0.56 -1.83 -1.32 0.00 0.00 176.35 172.94 1kta s GLU 255 N 0.63 1.24 -0.20 1.98 -1.05 0.27 -3.13 118.70 118.44 1kta s GLU 255 Ca 0.70 -0.53 -0.04 0.00 -0.15 0.00 0.00 54.97 54.94 1kta s GLU 255 Cb -0.47 0.56 -0.02 0.00 -0.44 0.00 0.00 34.13 33.76 1kta s GLU 255 CO 0.37 -0.53 -0.02 -1.17 0.95 0.00 0.00 175.26 174.86 1kta s LEU 256 N -2.76 3.15 0.05 1.83 2.96 -0.29 -1.38 118.68 122.23 1kta s LEU 256 Ca 0.02 -0.25 0.04 0.00 -0.22 0.00 0.00 54.13 53.72 1kta s LEU 256 Cb -0.00 -1.79 -0.02 0.00 0.50 0.00 0.00 46.19 44.87 1kta s LEU 256 CO -0.13 0.06 -0.12 0.54 -1.32 0.00 0.00 176.35 175.38 1kta s VAL 257 N 1.05 0.90 -0.01 1.68 0.11 -0.22 -1.06 120.40 122.85 1kta s VAL 257 Ca 0.02 -1.07 -0.07 0.00 -2.93 0.00 0.00 61.98 57.92 1kta s VAL 257 Cb -0.14 -0.87 0.00 0.00 -1.53 0.00 0.00 36.38 33.84 1kta s VAL 257 CO 0.01 -0.17 0.15 0.28 -3.33 0.00 0.00 175.10 172.04 1kta s THR 258 N -1.08 0.07 0.44 5.04 -1.32 -0.92 -1.63 115.64 116.23 1kta s THR 258 Ca -0.03 -0.59 -0.24 0.00 -1.21 0.00 0.00 61.69 59.62 1kta s THR 258 Cb -0.09 -0.42 -0.10 0.00 -1.51 0.00 0.00 72.50 70.39 1kta s THR 258 CO 0.01 -0.32 1.11 -2.65 -2.21 0.00 0.00 174.62 170.56 1kta n PRO 259 N 1.64 1.54 -1.56 7.08 -0.02 -1.25 -1.64 135.00 140.79 1kta n PRO 259 Ca -0.21 0.55 -0.30 0.00 -2.02 0.00 0.00 63.50 61.52 1kta n PRO 259 Cb 0.56 -2.19 0.09 0.00 -0.02 0.00 0.00 33.50 31.94 1kta n PRO 259 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1kta s PRO 260 N -2.16 2.11 -1.27 0.52 0.04 -1.26 -4.70 135.00 128.28 1kta s PRO 260 Ca 0.64 0.65 -0.17 0.00 0.04 0.00 0.00 61.00 62.15 1kta s PRO 260 Cb -0.53 -1.92 0.10 0.00 0.04 0.00 0.00 34.50 32.19 1kta s PRO 260 CO 0.56 -1.60 1.65 -0.51 0.04 0.00 0.00 177.00 177.14 1kta s LEU 261 N -5.77 4.17 0.00 -3.56 1.43 -1.26 -4.65 118.68 109.05 1kta s LEU 261 Ca 0.61 -2.59 0.22 0.00 -1.03 0.00 0.00 54.13 51.34 1kta s LEU 261 Cb -0.14 -2.53 0.50 0.00 0.03 0.00 0.00 46.19 44.05 1kta s LEU 261 CO 0.54 -1.05 1.44 -0.46 0.23 0.00 0.00 176.35 177.04 1kta n ASN 262 N 7.63 3.11 0.00 2.29 6.94 -1.26 -4.93 115.26 129.03 1kta n ASN 262 Ca 0.45 -1.94 0.00 0.00 -0.02 0.00 0.00 54.58 53.07 1kta n ASN 262 Cb 0.45 -0.24 0.00 0.00 -2.36 0.00 0.00 39.78 37.63 1kta n ASN 262 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1kta n GLY 263 N 1.44 2.05 0.08 4.83 0.00 -1.26 -4.86 105.19 107.46 1kta n GLY 263 Ca 0.19 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.12 1kta n GLY 263 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1kta h VAL 264 N 0.00 1.01 -2.40 1.61 2.07 -1.89 -3.00 116.25 113.64 1kta h VAL 264 Ca 0.00 -2.83 -0.57 0.00 0.82 0.00 0.00 66.70 64.12 1kta h VAL 264 Cb 0.00 2.51 -0.10 0.00 -1.52 0.00 0.00 31.29 32.18 1kta h VAL 264 CO 0.00 0.59 -0.65 0.27 0.02 0.00 0.00 177.57 177.80 1kta s ILE 265 N -2.62 3.55 0.07 4.57 -4.36 -1.26 -4.32 121.20 116.83 1kta s ILE 265 Ca -0.04 -1.76 -0.30 0.00 -0.26 0.00 0.00 60.65 58.29 1kta s ILE 265 Cb 0.08 -2.86 -0.05 0.00 1.25 0.00 0.00 42.46 40.88 1kta s ILE 265 CO 0.82 -0.30 1.05 -0.22 0.24 0.00 0.00 174.94 176.54 1kta s LEU 266 N -3.47 4.42 -1.02 0.37 2.96 -1.14 -3.92 118.68 116.88 1kta s LEU 266 Ca 0.30 1.86 -0.23 0.00 -0.22 0.00 0.00 54.13 55.84 1kta s LEU 266 Cb -0.07 -3.58 0.01 0.00 0.50 0.00 0.00 46.19 43.05 1kta s LEU 266 CO 0.20 -0.26 1.68 -2.84 -1.32 0.00 0.00 176.35 173.80 1kta s PRO 267 N 0.55 3.21 0.33 0.98 0.02 -1.26 -4.94 135.00 133.89 1kta s PRO 267 Ca 0.52 -0.95 -0.29 0.00 0.02 0.00 0.00 61.00 60.31 1kta s PRO 267 Cb -0.25 -5.27 -0.10 0.00 0.02 0.00 0.00 34.50 28.89 1kta s PRO 267 CO 0.30 -2.73 1.35 0.20 -0.33 0.00 0.00 177.00 175.79 1kta s GLY 268 N 6.01 2.92 0.16 0.52 0.00 -1.26 -4.94 107.32 110.74 1kta s GLY 268 Ca 0.56 1.32 -0.10 0.00 0.00 0.00 0.00 44.72 46.50 1kta s GLY 268 CO -0.03 2.00 1.56 -2.08 0.00 0.00 0.00 173.10 174.55 1kta h VAL 269 N 3.08 1.27 -0.32 1.40 2.07 -1.96 -1.59 116.25 120.20 1kta h VAL 269 Ca -0.49 -1.31 -0.06 0.00 0.82 0.00 0.00 66.70 65.66 1kta h VAL 269 Cb 1.23 1.07 -0.01 0.00 -1.52 0.00 0.00 31.29 32.06 1kta h VAL 269 CO 0.66 0.46 -0.02 0.58 0.02 0.00 0.00 177.57 179.27 1kta h VAL 270 N 0.85 1.27 -0.36 2.57 2.07 -1.92 -1.35 116.25 119.38 1kta h VAL 270 Ca 0.12 -1.01 0.08 0.00 0.82 0.00 0.00 66.70 66.71 1kta h VAL 270 Cb 0.73 1.28 -0.08 0.00 -1.52 0.00 0.00 31.29 31.70 1kta h VAL 270 CO 0.06 0.33 -0.21 -0.09 0.02 0.00 0.00 177.57 177.68 1kta h ARG 271 N 0.37 -0.15 -0.59 1.57 2.43 -1.83 0.18 114.38 116.37 1kta h ARG 271 Ca 0.09 0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.23 1kta h ARG 271 Cb 0.48 0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.04 1kta h ARG 271 CO 0.02 -0.10 0.23 0.37 -1.51 0.00 0.00 179.97 178.98 1kta h GLN 272 N -0.15 0.86 -0.61 0.20 5.75 -1.19 -1.28 115.11 118.68 1kta h GLN 272 Ca 0.18 -0.14 -0.09 0.00 -0.15 0.00 0.00 58.65 58.45 1kta h GLN 272 Cb 0.43 -0.15 -0.02 0.00 1.07 0.00 0.00 27.48 28.81 1kta h GLN 272 CO -0.45 0.71 0.02 0.77 -2.65 0.00 0.00 178.83 177.23 1kta h SER 273 N 0.85 1.04 -0.39 -0.69 0.02 0.09 -0.85 113.55 113.62 1kta h SER 273 Ca 0.20 -0.30 -0.09 0.00 -0.84 0.00 0.00 61.79 60.76 1kta h SER 273 Cb 0.17 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.42 1kta h SER 273 CO -0.02 1.08 -0.12 -0.07 -1.14 0.00 0.00 176.83 176.56 1kta h LEU 274 N 0.97 0.79 -0.13 5.07 3.38 -0.30 -0.54 115.31 124.55 1kta h LEU 274 Ca 0.18 -0.38 0.03 0.00 0.09 0.00 0.00 57.88 57.80 1kta h LEU 274 Cb 0.53 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.04 1kta h LEU 274 CO 0.03 0.98 -0.04 -0.07 0.09 0.00 0.00 178.44 179.43 1kta h LEU 275 N 0.58 -0.13 -0.15 1.67 4.07 -1.12 -0.71 115.31 119.51 1kta h LEU 275 Ca 0.10 0.04 0.04 0.00 0.08 0.00 0.00 57.88 58.13 1kta h LEU 275 Cb 0.66 0.08 -0.04 0.00 1.08 0.00 0.00 40.66 42.44 1kta h LEU 275 CO 0.04 -0.05 -0.10 0.44 -1.08 0.00 0.00 178.44 177.70 1kta h ASP 276 N -0.01 -0.31 0.16 -0.43 3.45 -0.96 0.23 116.42 118.56 1kta h ASP 276 Ca 0.06 0.07 -0.00 0.00 0.43 0.00 0.00 57.03 57.59 1kta h ASP 276 Cb 0.10 0.16 -0.01 0.00 -0.56 0.00 0.00 39.33 39.03 1kta h ASP 276 CO -0.14 -0.13 -0.12 -0.03 -1.57 0.00 0.00 179.24 177.26 1kta h MET 277 N -0.09 -0.27 -0.72 3.56 4.05 -0.98 0.55 114.93 121.03 1kta h MET 277 Ca 0.09 0.02 -0.06 0.00 -0.28 0.00 0.00 59.70 59.47 1kta h MET 277 Cb 0.23 0.06 -0.03 0.00 -0.80 0.00 0.00 31.60 31.06 1kta h MET 277 CO -0.21 -0.18 0.23 0.00 0.23 0.00 0.00 176.91 176.98 1kta h ALA 278 N 0.54 1.04 0.12 0.39 0.00 -0.97 -1.59 119.26 118.80 1kta h ALA 278 Ca -0.01 -0.22 0.02 0.00 0.00 0.00 0.00 54.91 54.70 1kta h ALA 278 Cb 0.25 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 1kta h ALA 278 CO -0.00 0.65 -0.27 1.96 0.00 0.00 0.00 179.25 181.59 1kta h GLN 279 N 1.07 -0.46 -0.48 0.00 1.08 -0.36 -2.86 115.11 113.09 1kta h GLN 279 Ca 0.23 0.03 0.06 0.00 -1.45 0.00 0.00 58.65 57.53 1kta h GLN 279 Cb 0.29 0.10 -0.05 0.00 -0.05 0.00 0.00 27.48 27.77 1kta h GLN 279 CO -0.01 -0.31 0.18 1.15 -0.95 0.00 0.00 178.83 178.90 1kta h THR 280 N -0.48 0.85 -0.66 -0.54 2.02 -0.39 -2.63 112.91 111.08 1kta h THR 280 Ca 0.03 -0.12 0.09 0.00 0.77 0.00 0.00 66.41 67.17 1kta h THR 280 Cb 0.50 0.46 -0.07 0.00 -1.74 0.00 0.00 68.15 67.30 1kta h THR 280 CO -0.15 0.07 0.32 -0.50 0.37 0.00 0.00 175.52 175.62 1kta h TRP 281 N 0.36 0.57 -2.66 3.16 6.55 -1.19 -3.46 115.95 119.28 1kta h TRP 281 Ca 0.23 0.03 -0.26 0.00 0.95 0.00 0.00 58.89 59.84 1kta h TRP 281 Cb 0.23 -0.15 0.02 0.00 -0.86 0.00 0.00 29.16 28.40 1kta h TRP 281 CO -0.15 0.21 -0.37 0.41 -1.05 0.00 0.00 178.44 177.48 1kta n GLY 282 N -1.29 -0.11 0.00 1.49 0.00 -0.99 -4.92 105.19 99.37 1kta n GLY 282 Ca 0.10 -0.24 0.10 0.00 0.00 0.00 0.00 46.02 45.97 1kta n GLY 282 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1kta n GLU 283 N -2.65 0.29 -3.69 1.61 1.02 -1.26 -5.01 120.64 110.94 1kta n GLU 283 Ca -0.10 -0.05 -0.08 0.00 -0.02 0.00 0.00 57.16 56.91 1kta n GLU 283 Cb 0.59 -1.49 -0.02 0.00 -0.02 0.00 0.00 31.44 30.50 1kta n GLU 283 CO 0.00 0.00 0.00 -0.59 1.18 0.00 0.00 177.13 177.72 1kta s PHE 284 N -3.10 -0.30 0.21 -0.32 -0.71 -1.26 -5.12 117.98 107.38 1kta s PHE 284 Ca 0.04 -0.05 -0.30 0.00 -1.04 0.00 0.00 56.93 55.58 1kta s PHE 284 Cb 0.15 0.65 -0.09 0.00 -1.21 0.00 0.00 43.02 42.52 1kta s PHE 284 CO 0.86 -1.04 1.32 0.50 -1.34 0.00 0.00 175.22 175.52 1kta s ARG 285 N -3.77 4.38 -0.17 1.99 3.52 -1.18 -4.92 118.95 118.79 1kta s ARG 285 Ca 0.08 2.09 0.01 0.00 -0.13 0.00 0.00 55.73 57.77 1kta s ARG 285 Cb -0.04 -3.18 0.03 0.00 -1.56 0.00 0.00 34.95 30.21 1kta s ARG 285 CO -0.01 -0.26 -0.12 0.08 -0.81 0.00 0.00 175.30 174.18 1kta s VAL 286 N 0.02 1.59 0.05 7.11 1.01 -1.26 -1.14 120.40 127.77 1kta s VAL 286 Ca 0.56 -0.82 0.01 0.00 0.00 0.00 0.00 61.98 61.73 1kta s VAL 286 Cb -0.37 -1.59 -0.03 0.00 0.00 0.00 0.00 36.38 34.39 1kta s VAL 286 CO 0.39 0.30 -0.05 0.68 0.00 0.00 0.00 175.10 176.42 1kta s VAL 287 N 1.45 0.36 -0.33 2.92 -7.23 -0.23 -4.99 120.40 112.34 1kta s VAL 287 Ca 0.02 -1.31 -0.08 0.00 -1.81 0.00 0.00 61.98 58.80 1kta s VAL 287 Cb -0.15 -0.85 0.02 0.00 0.56 0.00 0.00 36.38 35.97 1kta s VAL 287 CO -0.09 -0.63 0.13 -1.61 -0.31 0.00 0.00 175.10 172.59 1kta s GLU 288 N -2.37 2.87 0.04 4.82 2.02 -1.26 -2.17 118.70 122.65 1kta s GLU 288 Ca -0.05 -1.02 -0.20 0.00 0.02 0.00 0.00 54.97 53.72 1kta s GLU 288 Cb -0.04 -3.51 0.04 0.00 0.10 0.00 0.00 34.13 30.72 1kta s GLU 288 CO -0.03 -0.59 0.46 0.50 0.02 0.00 0.00 175.26 175.62 1kta s ARG 289 N 1.49 0.96 0.39 1.61 3.52 -0.65 -4.70 118.95 121.56 1kta s ARG 289 Ca 0.01 -0.29 -0.27 0.00 -0.13 0.00 0.00 55.73 55.05 1kta s ARG 289 Cb -0.19 0.43 -0.11 0.00 -1.56 0.00 0.00 34.95 33.53 1kta s ARG 289 CO 0.04 -0.33 1.41 2.41 -0.81 0.00 0.00 175.30 178.02 1kta n THR 290 N 0.50 2.22 -4.56 4.11 -1.04 -1.26 -3.79 114.28 110.45 1kta n THR 290 Ca -0.19 -0.50 -0.26 0.00 -2.04 0.00 0.00 64.05 61.06 1kta n THR 290 Cb 0.60 -1.82 -0.17 0.00 -1.82 0.00 0.00 70.33 67.12 1kta n THR 290 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1kta s ILE 291 N -1.14 1.29 0.25 12.58 1.01 -1.26 -5.00 121.20 128.93 1kta s ILE 291 Ca 0.56 -0.55 0.08 0.00 0.00 0.00 0.00 60.65 60.74 1kta s ILE 291 Cb -0.49 -1.18 -0.04 0.00 0.01 0.00 0.00 42.46 40.76 1kta s ILE 291 CO 0.62 0.39 0.10 0.42 0.00 0.00 0.00 174.94 176.47 1kta s THR 292 N 0.78 4.01 0.23 2.92 -4.23 -1.26 -0.58 115.64 117.50 1kta s THR 292 Ca -0.12 -1.61 -0.07 0.00 -1.18 0.00 0.00 61.69 58.71 1kta s THR 292 Cb -0.16 -3.15 0.18 0.00 1.34 0.00 0.00 72.50 70.71 1kta s THR 292 CO 0.02 -0.35 1.81 0.24 -0.54 0.00 0.00 174.62 175.80 1kta h MET 293 N 1.71 1.18 -0.65 3.99 2.86 -1.46 -1.61 114.93 120.96 1kta h MET 293 Ca -0.47 -0.19 0.10 0.00 -2.06 0.00 0.00 59.70 57.08 1kta h MET 293 Cb 1.24 -0.20 -0.07 0.00 0.06 0.00 0.00 31.60 32.63 1kta h MET 293 CO 0.61 0.93 0.28 -0.22 1.06 0.00 0.00 176.91 179.57 1kta h LYS 294 N 1.16 0.47 -0.45 1.72 3.64 -1.85 0.21 116.57 121.48 1kta h LYS 294 Ca 0.27 -0.03 -0.09 0.00 -1.27 0.00 0.00 60.65 59.53 1kta h LYS 294 Cb 0.16 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.86 1kta h LYS 294 CO -0.03 0.31 -0.09 1.96 -2.27 0.00 0.00 179.45 179.33 1kta h GLN 295 N 0.48 0.80 -0.14 1.90 4.20 -1.81 -1.06 115.11 119.48 1kta h GLN 295 Ca 0.33 -0.26 -0.03 0.00 0.06 0.00 0.00 58.65 58.75 1kta h GLN 295 Cb 0.38 -0.07 -0.00 0.00 0.30 0.00 0.00 27.48 28.09 1kta h GLN 295 CO -0.29 0.87 -0.01 1.25 -0.67 0.00 0.00 178.83 179.98 1kta h LEU 296 N 0.73 0.25 0.09 1.46 6.46 -0.35 0.19 115.31 124.14 1kta h LEU 296 Ca 0.13 -0.33 0.02 0.00 -0.12 0.00 0.00 57.88 57.58 1kta h LEU 296 Cb 0.58 -0.07 -0.03 0.00 -0.73 0.00 0.00 40.66 40.41 1kta h LEU 296 CO 0.04 0.52 -0.24 -0.07 -0.62 0.00 0.00 178.44 178.06 1kta h LEU 297 N -0.02 -0.70 -1.82 2.25 3.38 -0.50 0.32 115.31 118.22 1kta h LEU 297 Ca 0.04 0.08 0.05 0.00 0.09 0.00 0.00 57.88 58.14 1kta h LEU 297 Cb 0.39 0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.40 1kta h LEU 297 CO 0.01 -0.33 0.22 -0.09 0.09 0.00 0.00 178.44 178.34 1kta h ARG 298 N -0.43 0.22 0.08 1.13 2.43 -1.13 -2.32 114.38 114.35 1kta h ARG 298 Ca 0.04 -0.01 -0.26 0.00 -0.81 0.00 0.00 59.98 58.93 1kta h ARG 298 Cb 0.47 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.96 1kta h ARG 298 CO -0.15 0.14 -1.26 0.00 -1.51 0.00 0.00 179.97 177.19 1kta h ALA 299 N 1.82 0.26 0.00 2.80 0.00 -0.17 -2.70 119.26 121.27 1kta h ALA 299 Ca 0.14 -0.98 0.00 0.00 0.00 0.00 0.00 54.91 54.07 1kta h ALA 299 Cb 0.29 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1kta h ALA 299 CO -0.03 1.14 0.00 1.28 0.00 0.00 0.00 179.25 181.65 1kta n LEU 300 N -3.42 0.60 -0.11 0.00 4.77 0.11 -0.95 117.00 118.00 1kta n LEU 300 Ca -0.08 0.65 0.03 0.00 -0.03 0.00 0.00 56.01 56.58 1kta n LEU 300 Cb 1.00 -0.57 0.05 0.00 -2.33 0.00 0.00 43.42 41.57 1kta n LEU 300 CO 0.50 -0.54 0.53 -0.62 -1.33 0.00 0.00 177.39 175.94 1kta n GLU 301 N -2.17 2.65 0.00 3.23 4.71 -1.01 -3.99 120.64 124.06 1kta n GLU 301 Ca 0.02 -1.82 0.01 0.00 -0.01 0.00 0.00 57.16 55.37 1kta n GLU 301 Cb 0.22 -1.16 0.00 0.00 -1.01 0.00 0.00 31.44 29.50 1kta n GLU 301 CO 0.00 0.00 0.00 -1.91 0.09 0.00 0.00 177.13 175.31 1kta n GLU 302 N -0.57 1.03 -3.06 3.49 4.07 -1.01 -4.98 120.64 119.60 1kta n GLU 302 Ca 0.05 -0.49 -0.23 0.00 -0.06 0.00 0.00 57.16 56.43 1kta n GLU 302 Cb 0.37 -0.94 0.03 0.00 -0.06 0.00 0.00 31.44 30.84 1kta n GLU 302 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1kta n GLY 303 N 0.36 -0.52 0.11 8.31 0.00 -0.49 -4.91 105.19 108.04 1kta n GLY 303 Ca 0.01 0.13 0.11 0.00 0.00 0.00 0.00 46.02 46.28 1kta n GLY 303 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1kta n ARG 304 N -4.03 0.30 -2.92 1.61 1.74 -0.12 -4.92 116.66 108.33 1kta n ARG 304 Ca -0.10 -0.22 -0.41 0.00 -0.77 0.00 0.00 57.85 56.35 1kta n ARG 304 Cb 0.61 -1.50 -0.04 0.00 -1.02 0.00 0.00 32.46 30.52 1kta n ARG 304 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1kta s VAL 305 N -2.85 4.93 -0.23 1.55 1.01 -1.24 -1.62 120.40 121.95 1kta s VAL 305 Ca 0.13 1.63 -0.16 0.00 0.00 0.00 0.00 61.98 63.58 1kta s VAL 305 Cb 0.17 -4.13 -0.10 0.00 0.00 0.00 0.00 36.38 32.32 1kta s VAL 305 CO 0.72 0.11 -0.28 0.54 0.00 0.00 0.00 175.10 176.19 1kta n ARG 306 N 4.62 0.56 -3.79 2.72 1.74 -0.13 -4.76 116.66 117.62 1kta n ARG 306 Ca 0.03 0.30 -0.13 0.00 -0.77 0.00 0.00 57.85 57.28 1kta n ARG 306 Cb 0.50 -1.51 -0.10 0.00 -1.02 0.00 0.00 32.46 30.33 1kta n ARG 306 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1kta s GLU 307 N -2.60 0.49 -0.03 5.56 2.02 -1.01 -3.58 118.70 119.55 1kta s GLU 307 Ca -0.33 0.02 0.03 0.00 0.02 0.00 0.00 54.97 54.70 1kta s GLU 307 Cb 0.10 0.22 0.00 0.00 0.10 0.00 0.00 34.13 34.55 1kta s GLU 307 CO 0.46 -0.11 -0.10 0.08 0.02 0.00 0.00 175.26 175.62 1kta s VAL 308 N -0.70 0.86 0.12 2.63 1.01 -1.26 -0.12 120.40 122.93 1kta s VAL 308 Ca -0.08 -0.39 -0.15 0.00 0.00 0.00 0.00 61.98 61.35 1kta s VAL 308 Cb -0.04 -0.77 0.03 0.00 0.00 0.00 0.00 36.38 35.60 1kta s VAL 308 CO 0.02 0.27 0.38 0.72 0.00 0.00 0.00 175.10 176.49 1kta s PHE 309 N 0.25 -0.17 0.22 5.22 -0.71 -0.53 -1.61 117.98 120.64 1kta s PHE 309 Ca -0.04 -0.14 0.03 0.00 -1.04 0.00 0.00 56.93 55.74 1kta s PHE 309 Cb -0.10 0.22 -0.03 0.00 -1.21 0.00 0.00 43.02 41.90 1kta s PHE 309 CO 0.01 -0.67 0.36 0.20 -1.34 0.00 0.00 175.22 173.77 1kta s GLY 310 N -2.75 1.43 -0.01 1.99 0.00 -0.31 -0.60 107.32 107.07 1kta s GLY 310 Ca 0.02 -1.10 0.03 0.00 0.00 0.00 0.00 44.72 43.67 1kta s GLY 310 CO -0.11 -1.10 -0.10 -1.35 0.00 0.00 0.00 173.10 170.44 1kta s SER 311 N -3.68 1.18 -0.13 1.64 1.04 0.58 -0.90 113.70 113.43 1kta s SER 311 Ca 0.35 -0.18 -0.34 0.00 0.48 0.00 0.00 55.95 56.26 1kta s SER 311 Cb -0.10 -0.20 0.14 0.00 0.10 0.00 0.00 66.02 65.96 1kta s SER 311 CO 0.29 0.10 1.33 -0.83 0.98 0.00 0.00 173.24 175.12 1kta s GLY 312 N -0.08 -0.37 0.24 7.32 0.00 -1.07 -1.27 107.32 112.10 1kta s GLY 312 Ca 0.01 1.19 -0.07 0.00 0.00 0.00 0.00 44.72 45.85 1kta s GLY 312 CO -0.00 0.32 1.92 -0.84 0.00 0.00 0.00 173.10 174.50 1kta h THR 313 N 2.00 1.25 -0.21 0.90 2.02 -1.91 0.35 112.91 117.31 1kta h THR 313 Ca -0.21 -0.47 -0.03 0.00 0.77 0.00 0.00 66.41 66.47 1kta h THR 313 Cb 1.18 -0.16 -0.01 0.00 -1.74 0.00 0.00 68.15 67.42 1kta h THR 313 CO 0.26 0.24 0.03 0.00 0.37 0.00 0.00 175.52 176.42 1kta h ALA 314 N 1.35 0.28 -2.72 6.16 0.00 -1.96 -3.37 119.26 119.00 1kta h ALA 314 Ca 0.35 -0.18 -0.59 0.00 0.00 0.00 0.00 54.91 54.49 1kta h ALA 314 Cb -0.14 -0.08 -0.39 0.00 0.00 0.00 0.00 17.79 17.18 1kta h ALA 314 CO -0.07 -0.04 -0.81 0.00 0.00 0.00 0.00 179.25 178.32 1kta h GLN 316 N 6.79 -0.19 -3.76 0.00 4.20 -1.09 -2.83 115.11 118.23 1kta h GLN 316 Ca 0.05 0.01 -0.53 0.00 0.06 0.00 0.00 58.65 58.24 1kta h GLN 316 Cb 0.95 0.04 -0.39 0.00 0.30 0.00 0.00 27.48 28.38 1kta h GLN 316 CO 0.36 -0.13 -0.77 0.08 -0.67 0.00 0.00 178.83 177.70 1kta s VAL 317 N -5.88 0.75 -0.35 -0.54 1.01 -1.26 -2.88 120.40 111.25 1kta s VAL 317 Ca -0.14 -0.65 -0.03 0.00 0.00 0.00 0.00 61.98 61.16 1kta s VAL 317 Cb 0.14 -1.17 0.07 0.00 0.00 0.00 0.00 36.38 35.43 1kta s VAL 317 CO 0.67 -0.13 0.11 0.00 0.00 0.00 0.00 175.10 175.74 1kta s PRO 319 N 1.25 2.82 -0.11 0.00 0.04 -1.26 -1.16 135.00 136.57 1kta s PRO 319 Ca 0.01 1.81 0.03 0.00 0.04 0.00 0.00 61.00 62.88 1kta s PRO 319 Cb -0.21 -1.91 -0.00 0.00 0.04 0.00 0.00 34.50 32.42 1kta s PRO 319 CO -0.01 -1.32 -0.22 0.08 0.04 0.00 0.00 177.00 175.57 1kta s VAL 320 N -1.68 2.25 -0.18 -0.36 1.01 -0.64 -1.09 120.40 119.71 1kta s VAL 320 Ca 0.77 -0.95 0.04 0.00 0.00 0.00 0.00 61.98 61.85 1kta s VAL 320 Cb -0.30 -1.88 -0.05 0.00 0.00 0.00 0.00 36.38 34.15 1kta s VAL 320 CO 0.36 0.55 0.18 0.00 0.00 0.00 0.00 175.10 176.18 1kta n HIS 321 N 3.59 0.00 -3.70 5.22 1.44 -0.87 -4.30 115.22 116.60 1kta n HIS 321 Ca -0.19 0.00 -0.14 0.00 -2.01 0.00 0.00 57.72 55.38 1kta n HIS 321 Cb 0.53 -0.01 -0.09 0.00 0.12 0.00 0.00 29.99 30.54 1kta n HIS 321 CO 0.00 0.00 0.00 0.50 -2.81 0.00 0.00 176.34 174.03 1kta s ARG 322 N -1.54 0.64 -0.08 -1.40 3.52 -1.24 -0.29 118.95 118.57 1kta s ARG 322 Ca 0.01 0.45 0.00 0.00 -0.13 0.00 0.00 55.73 56.07 1kta s ARG 322 Cb 0.03 0.31 0.02 0.00 -1.56 0.00 0.00 34.95 33.75 1kta s ARG 322 CO 0.18 -0.12 -0.06 0.42 -0.81 0.00 0.00 175.30 174.91 1kta s ILE 323 N -0.23 0.76 -0.40 4.11 1.01 -0.67 -1.18 121.20 124.60 1kta s ILE 323 Ca -0.04 -0.18 -0.16 0.00 0.00 0.00 0.00 60.65 60.27 1kta s ILE 323 Cb -0.03 -0.79 0.01 0.00 0.01 0.00 0.00 42.46 41.65 1kta s ILE 323 CO 0.02 0.30 0.35 -0.22 0.00 0.00 0.00 174.94 175.40 1kta s LEU 324 N 1.38 4.87 -0.24 2.97 2.96 0.39 -0.70 118.68 130.31 1kta s LEU 324 Ca -0.03 -0.68 0.01 0.00 -0.22 0.00 0.00 54.13 53.22 1kta s LEU 324 Cb -0.13 -2.27 0.06 0.00 0.50 0.00 0.00 46.19 44.35 1kta s LEU 324 CO -0.03 -0.46 -0.07 -0.47 -1.32 0.00 0.00 176.35 173.99 1kta s TYR 325 N 1.90 2.65 -0.77 5.38 6.04 0.22 -1.19 117.35 131.59 1kta s TYR 325 Ca 0.09 -1.91 -0.01 0.00 0.04 0.00 0.00 57.07 55.27 1kta s TYR 325 Cb -0.18 -1.68 0.00 0.00 -1.04 0.00 0.00 41.96 39.06 1kta s TYR 325 CO 0.12 -0.80 0.65 1.63 -1.54 0.00 0.00 175.55 175.60 1kta n LYS 326 N 4.60 -4.31 -0.55 4.97 5.02 -1.26 -1.23 118.16 125.40 1kta n LYS 326 Ca -0.13 0.52 0.00 0.00 -2.02 0.00 0.00 58.31 56.69 1kta n LYS 326 Cb 0.44 -4.59 0.00 0.00 -0.02 0.00 0.00 35.03 30.86 1kta n LYS 326 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1kta n ASP 327 N -2.08 0.00 -4.56 4.39 10.43 -1.26 -4.91 116.55 118.56 1kta n ASP 327 Ca -0.14 0.00 -0.37 0.00 2.57 0.00 0.00 54.79 56.85 1kta n ASP 327 Cb 0.59 -1.92 -0.11 0.00 1.84 0.00 0.00 41.12 41.51 1kta n ASP 327 CO 0.00 0.00 0.00 -0.60 -1.07 0.00 0.00 177.20 175.53 1kta s ARG 328 N -0.73 3.87 -0.28 -1.24 3.52 -0.37 -5.06 118.95 118.67 1kta s ARG 328 Ca 0.00 -0.37 -0.19 0.00 -0.13 0.00 0.00 55.73 55.04 1kta s ARG 328 Cb 0.00 -3.51 -0.02 0.00 -1.56 0.00 0.00 34.95 29.86 1kta s ARG 328 CO 0.00 -0.12 0.57 -0.80 -0.81 0.00 0.00 175.30 174.14 1kta s ASN 329 N 1.54 6.48 -0.22 -2.12 0.01 -1.26 -0.61 114.94 118.75 1kta s ASN 329 Ca 0.07 0.51 -0.10 0.00 -0.71 0.00 0.00 52.86 52.62 1kta s ASN 329 Cb -0.15 -2.31 -0.05 0.00 0.41 0.00 0.00 41.25 39.15 1kta s ASN 329 CO 0.07 -0.37 0.14 -0.76 -1.51 0.00 0.00 177.10 174.68 1kta s LEU 330 N 2.44 4.14 -0.03 0.60 1.43 0.12 -4.96 118.68 122.42 1kta s LEU 330 Ca 0.23 0.16 -0.25 0.00 -1.03 0.00 0.00 54.13 53.24 1kta s LEU 330 Cb -0.15 -2.09 -0.04 0.00 0.03 0.00 0.00 46.19 43.93 1kta s LEU 330 CO 0.10 0.12 0.77 -2.28 0.23 0.00 0.00 176.35 175.28 1kta s HIS 331 N 0.75 3.63 -0.28 0.29 5.65 -1.26 -1.68 115.29 122.39 1kta s HIS 331 Ca 0.08 1.39 -0.08 0.00 0.25 0.00 0.00 55.06 56.70 1kta s HIS 331 Cb -0.12 -2.87 -0.01 0.00 -1.18 0.00 0.00 32.58 28.39 1kta s HIS 331 CO 0.02 0.11 0.09 0.42 -0.65 0.00 0.00 174.74 174.72 1kta s ILE 332 N 0.66 4.24 -0.61 0.89 -1.09 0.60 -4.97 121.20 120.93 1kta s ILE 332 Ca 0.41 -0.41 0.00 0.00 -2.23 0.00 0.00 60.65 58.42 1kta s ILE 332 Cb -0.19 -3.09 0.00 0.00 -1.58 0.00 0.00 42.46 37.60 1kta s ILE 332 CO 0.21 0.19 0.31 -0.81 -1.23 0.00 0.00 174.94 173.62 1kta n PRO 333 N 4.92 0.45 0.19 2.79 -0.04 -1.26 -4.43 135.00 137.61 1kta n PRO 333 Ca -0.15 0.00 -0.17 0.00 -0.04 0.00 0.00 63.50 63.14 1kta n PRO 333 Cb 0.50 -1.24 -0.10 0.00 -0.04 0.00 0.00 33.50 32.62 1kta n PRO 333 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 1kta h THR 334 N 0.21 0.02 0.00 0.52 2.02 -1.75 -2.57 112.91 111.38 1kta h THR 334 Ca 0.00 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 1kta h THR 334 Cb 0.31 0.02 -0.00 0.00 -1.74 0.00 0.00 68.15 66.75 1kta h THR 334 CO 0.00 0.00 -0.05 0.24 0.37 0.00 0.00 175.52 176.08 1kta h MET 335 N -0.85 0.00 -0.00 6.66 2.86 -1.86 -1.79 114.93 119.95 1kta h MET 335 Ca -0.02 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 1kta h MET 335 Cb 0.80 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.46 1kta h MET 335 CO -0.19 0.05 -0.07 -0.85 1.06 0.00 0.00 176.91 176.90 1kta n GLU 336 N -3.68 0.17 -1.08 1.72 0.00 -0.98 -1.96 120.64 114.83 1kta n GLU 336 Ca -0.02 -0.02 -0.14 0.00 0.00 0.00 0.00 57.16 56.97 1kta n GLU 336 Cb 0.14 -1.50 0.23 0.00 0.00 0.00 0.00 31.44 30.32 1kta n GLU 336 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1kta n ASN 337 N -1.39 4.04 -3.27 -1.84 3.02 -0.68 -4.92 115.26 110.22 1kta n ASN 337 Ca 0.09 -3.46 -0.13 0.00 -0.03 0.00 0.00 54.58 51.05 1kta n ASN 337 Cb 0.31 -0.77 0.00 0.00 -0.61 0.00 0.00 39.78 38.71 1kta n ASN 337 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1kta n GLY 338 N -0.75 -0.47 0.37 7.41 0.00 -0.83 -1.62 105.19 109.31 1kta n GLY 338 Ca 0.49 0.21 0.00 0.00 0.00 0.00 0.00 46.02 46.72 1kta n GLY 338 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1kta n PRO 339 N -1.71 -0.11 0.05 1.61 -0.04 -1.22 -4.71 135.00 128.86 1kta n PRO 339 Ca -0.11 -0.04 -0.11 0.00 -0.04 0.00 0.00 63.50 63.20 1kta n PRO 339 Cb 0.26 0.08 -0.05 0.00 -0.04 0.00 0.00 33.50 33.75 1kta n PRO 339 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 1kta h GLU 340 N 0.28 -0.22 -0.20 0.54 4.81 -1.61 0.70 114.58 118.88 1kta h GLU 340 Ca 0.00 0.02 -0.08 0.00 -0.13 0.00 0.00 59.36 59.16 1kta h GLU 340 Cb 0.00 0.05 -0.00 0.00 0.63 0.00 0.00 28.75 29.43 1kta h GLU 340 CO 0.00 -0.15 -0.20 1.25 -0.73 0.00 0.00 179.01 179.18 1kta h LEU 341 N -0.23 0.52 -0.53 1.64 5.85 -1.85 -1.94 115.31 118.76 1kta h LEU 341 Ca 0.05 -0.48 0.08 0.00 0.84 0.00 0.00 57.88 58.37 1kta h LEU 341 Cb 0.29 -0.15 -0.06 0.00 0.37 0.00 0.00 40.66 41.11 1kta h LEU 341 CO -0.14 0.89 0.17 0.40 -0.34 0.00 0.00 178.44 179.42 1kta h ILE 342 N 0.16 0.78 -0.55 4.05 2.04 -1.88 -0.54 117.51 121.56 1kta h ILE 342 Ca 0.03 -0.12 -0.00 0.00 1.00 0.00 0.00 64.86 65.77 1kta h ILE 342 Cb 0.74 0.41 -0.03 0.00 -0.74 0.00 0.00 36.82 37.21 1kta h ILE 342 CO 0.05 0.06 0.34 -0.07 0.00 0.00 0.00 178.15 178.53 1kta h LEU 343 N 0.34 0.66 -0.57 1.44 3.38 0.52 -0.09 115.31 120.98 1kta h LEU 343 Ca 0.26 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.17 1kta h LEU 343 Cb 0.31 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 1kta h LEU 343 CO -0.28 0.51 0.33 -0.09 0.09 0.00 0.00 178.44 179.00 1kta h ARG 344 N 0.74 0.79 -0.46 1.13 2.43 -0.76 0.16 114.38 118.42 1kta h ARG 344 Ca 0.20 -0.08 -0.03 0.00 -0.81 0.00 0.00 59.98 59.26 1kta h ARG 344 Cb -0.03 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.34 1kta h ARG 344 CO -0.04 0.59 0.18 0.74 -1.51 0.00 0.00 179.97 179.93 1kta h PHE 345 N 0.77 0.71 -0.54 2.20 0.05 -0.70 -0.76 116.94 118.66 1kta h PHE 345 Ca 0.20 -0.06 0.00 0.00 3.82 0.00 0.00 57.97 61.94 1kta h PHE 345 Cb 0.02 -0.21 -0.03 0.00 2.00 0.00 0.00 35.95 37.73 1kta h PHE 345 CO -0.02 0.60 0.35 1.96 -0.18 0.00 0.00 178.31 181.03 1kta h GLN 346 N 0.60 0.72 -0.10 1.51 4.20 -0.61 -0.47 115.11 120.96 1kta h GLN 346 Ca 0.15 -0.05 0.03 0.00 0.06 0.00 0.00 58.65 58.85 1kta h GLN 346 Cb 0.20 -0.16 -0.03 0.00 0.30 0.00 0.00 27.48 27.79 1kta h GLN 346 CO -0.01 0.49 -0.10 -0.22 -0.67 0.00 0.00 178.83 178.32 1kta h LYS 347 N 0.73 -0.12 -0.48 1.46 3.64 -0.42 -1.27 116.57 120.12 1kta h LYS 347 Ca 0.20 0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.55 1kta h LYS 347 Cb -0.07 0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 31.76 1kta h LYS 347 CO -0.04 -0.08 0.18 1.49 -2.27 0.00 0.00 179.45 178.73 1kta h GLU 348 N -0.12 0.73 -0.69 1.90 4.81 -0.82 -2.54 114.58 117.85 1kta h GLU 348 Ca 0.07 -0.14 -0.03 0.00 -0.13 0.00 0.00 59.36 59.13 1kta h GLU 348 Cb 0.22 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.46 1kta h GLU 348 CO -0.17 0.66 0.31 -0.07 -0.73 0.00 0.00 179.01 179.01 1kta h LEU 349 N 0.64 0.93 -0.26 1.64 3.38 -0.92 -1.72 115.31 119.01 1kta h LEU 349 Ca 0.16 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1kta h LEU 349 Cb 0.21 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1kta h LEU 349 CO -0.01 0.83 0.16 0.50 0.09 0.00 0.00 178.44 180.01 1kta h LYS 350 N 0.98 0.34 -0.72 1.13 3.64 -1.15 0.38 116.57 121.17 1kta h LYS 350 Ca 0.24 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.59 1kta h LYS 350 Cb 0.16 -0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 31.87 1kta h LYS 350 CO -0.02 0.25 0.46 0.93 -2.27 0.00 0.00 179.45 178.80 1kta h GLU 351 N 0.33 0.95 0.06 1.90 5.08 -1.27 -0.12 114.58 121.52 1kta h GLU 351 Ca 0.09 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1kta h GLU 351 Cb -0.01 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.03 1kta h GLU 351 CO -0.02 0.64 -0.03 0.82 -1.00 0.00 0.00 179.01 179.43 1kta h ILE 352 N 0.98 1.27 -0.59 3.13 2.04 -0.87 -2.03 117.51 121.45 1kta h ILE 352 Ca 0.26 -1.46 -0.06 0.00 1.00 0.00 0.00 64.86 64.60 1kta h ILE 352 Cb -0.09 2.18 -0.03 0.00 -0.74 0.00 0.00 36.82 38.15 1kta h ILE 352 CO -0.05 0.35 0.13 1.56 0.00 0.00 0.00 178.15 180.13 1kta h GLN 353 N -0.77 0.93 -0.81 2.37 4.20 -0.10 -2.86 115.11 118.08 1kta h GLN 353 Ca -0.01 -0.21 -0.01 0.00 0.06 0.00 0.00 58.65 58.48 1kta h GLN 353 Cb 0.63 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 28.27 1kta h GLN 353 CO 0.01 0.84 0.01 0.66 -0.67 0.00 0.00 178.83 179.69 1kta n TYR 354 N -4.25 1.04 -1.26 2.96 4.02 -0.07 -4.74 117.16 114.85 1kta n TYR 354 Ca 0.04 -0.39 -0.09 0.00 -0.01 0.00 0.00 57.90 57.46 1kta n TYR 354 Cb 0.25 -0.31 -0.04 0.00 -0.02 0.00 0.00 39.34 39.22 1kta n TYR 354 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1kta n GLY 355 N 0.28 1.02 0.22 2.72 0.00 -1.08 -4.28 105.19 104.06 1kta n GLY 355 Ca 0.14 -0.26 0.13 0.00 0.00 0.00 0.00 46.02 46.03 1kta n GLY 355 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 1kta h ILE 356 N 0.00 0.00 -3.33 -0.61 3.07 -1.63 -3.41 117.51 111.60 1kta h ILE 356 Ca -0.19 -0.85 -0.34 0.00 1.55 0.00 0.00 64.86 65.02 1kta h ILE 356 Cb 0.81 1.85 -0.37 0.00 -0.27 0.00 0.00 36.82 38.83 1kta h ILE 356 CO 0.27 0.00 -0.72 0.00 -1.05 0.00 0.00 178.15 176.65 1kta s ARG 357 N -3.28 -0.05 0.29 0.16 1.70 -0.94 -5.04 118.95 111.78 1kta s ARG 357 Ca 0.06 0.36 -0.28 0.00 -0.47 0.00 0.00 55.73 55.40 1kta s ARG 357 Cb 0.06 -0.42 -0.14 0.00 -0.57 0.00 0.00 34.95 33.89 1kta s ARG 357 CO 0.64 -0.29 1.07 0.00 -1.08 0.00 0.00 175.30 175.64 1kta n ALA 358 N 5.04 0.04 -3.58 7.88 0.00 -1.26 -4.53 120.51 124.11 1kta n ALA 358 Ca -0.09 0.39 -0.14 0.00 0.00 0.00 0.00 53.44 53.60 1kta n ALA 358 Cb 0.50 -2.07 -0.07 0.00 0.00 0.00 0.00 19.45 17.81 1kta n ALA 358 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1kta s HIS 359 N -0.99 -0.73 -0.20 0.00 2.46 -1.26 -5.02 115.29 109.55 1kta s HIS 359 Ca 0.59 1.73 0.27 0.00 0.47 0.00 0.00 55.06 58.12 1kta s HIS 359 Cb -0.68 0.27 1.23 0.00 -0.13 0.00 0.00 32.58 33.26 1kta s HIS 359 CO 0.60 -0.39 1.82 1.05 -2.47 0.00 0.00 174.74 175.35 1kta h GLU 360 N 4.84 0.00 0.00 2.88 4.11 -2.00 -2.78 114.58 121.63 1kta h GLU 360 Ca -0.29 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.14 1kta h GLU 360 Cb 1.16 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.41 1kta h GLU 360 CO 0.11 0.00 -0.03 -1.49 0.07 0.00 0.00 179.01 177.67 1kta h TRP 361 N 0.00 0.00 -3.05 2.06 6.55 -1.96 -3.44 115.95 116.11 1kta h TRP 361 Ca 0.00 0.00 -0.61 0.00 0.95 0.00 0.00 58.89 59.23 1kta h TRP 361 Cb 0.29 0.00 -0.06 0.00 -0.86 0.00 0.00 29.16 28.54 1kta h TRP 361 CO 0.00 0.03 -0.20 -1.64 -1.05 0.00 0.00 178.44 175.59 1kta s MET 362 N -3.64 3.96 -0.26 0.49 -1.94 -1.05 0.26 119.30 117.13 1kta s MET 362 Ca 0.01 0.42 -0.03 0.00 -1.71 0.00 0.00 55.69 54.39 1kta s MET 362 Cb 0.09 -3.24 0.02 0.00 2.01 0.00 0.00 34.83 33.71 1kta s MET 362 CO 0.57 0.64 -0.03 0.12 -0.01 0.00 0.00 175.02 176.31 1kta s PHE 363 N -0.93 3.10 0.25 -0.03 5.36 0.26 -4.94 117.98 121.04 1kta s PHE 363 Ca 0.24 -1.46 -0.31 0.00 -0.96 0.00 0.00 56.93 54.44 1kta s PHE 363 Cb -0.17 -2.10 -0.12 0.00 -0.34 0.00 0.00 43.02 40.29 1kta s PHE 363 CO 0.13 -0.70 1.62 -2.30 -1.46 0.00 0.00 175.22 172.51 1kta n PRO 364 N 4.71 2.64 -0.15 10.12 -0.02 -1.26 -0.57 135.00 150.47 1kta n PRO 364 Ca -0.16 0.94 0.00 0.00 -2.02 0.00 0.00 63.50 62.27 1kta n PRO 364 Cb 0.47 -2.74 0.00 0.00 -0.02 0.00 0.00 33.50 31.21 1kta n PRO 364 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81