#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3juw s GLN 6 N 0.00 4.32 0.06 5.56 2.00 -1.26 -4.83 119.66 125.51 3juw s GLN 6 Ca 0.00 1.78 -0.27 0.00 -2.00 0.00 0.00 55.36 54.87 3juw s GLN 6 Cb 0.00 -3.57 -0.05 0.00 0.80 0.00 0.00 33.01 30.18 3juw s GLN 6 CO 0.00 -0.51 0.85 0.08 -0.50 0.00 0.00 175.29 175.21 3juw s VAL 7 N 2.34 4.68 0.16 1.34 1.01 -1.26 -4.52 120.40 124.16 3juw s VAL 7 Ca 0.59 1.81 0.08 0.00 0.00 0.00 0.00 61.98 64.45 3juw s VAL 7 Cb -0.27 -4.20 -0.04 0.00 0.00 0.00 0.00 36.38 31.87 3juw s VAL 7 CO 0.23 0.32 -0.04 -0.76 0.00 0.00 0.00 175.10 174.86 3juw s LEU 8 N 0.10 3.20 -0.02 3.92 1.43 -0.21 -4.98 118.68 122.12 3juw s LEU 8 Ca 0.43 -0.43 0.05 0.00 -1.03 0.00 0.00 54.13 53.14 3juw s LEU 8 Cb -0.21 -1.88 -0.01 0.00 0.03 0.00 0.00 46.19 44.11 3juw s LEU 8 CO 0.26 0.11 -0.16 -0.54 0.23 0.00 0.00 176.35 176.24 3juw s LYS 9 N -2.79 1.42 0.52 1.70 1.02 -1.26 -0.54 119.74 119.81 3juw s LYS 9 Ca 0.26 -0.57 0.00 0.00 0.02 0.00 0.00 55.97 55.68 3juw s LYS 9 Cb -0.09 -1.32 0.00 0.00 -0.52 0.00 0.00 37.83 35.89 3juw s LYS 9 CO 0.17 0.30 0.01 0.25 -0.92 0.00 0.00 175.35 175.17 3juw n THR 10 N 2.85 0.00 -0.35 2.17 -2.24 0.27 -4.99 114.28 112.00 3juw n THR 10 Ca -0.16 -2.45 0.25 0.00 -2.27 0.00 0.00 64.05 59.42 3juw n THR 10 Cb 0.54 0.48 0.50 0.00 -2.10 0.00 0.00 70.33 69.74 3juw n THR 10 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 3juw h ASP 11 N 1.23 0.48 0.00 3.42 3.32 -2.01 -3.17 116.42 119.69 3juw h ASP 11 Ca -0.43 0.16 0.00 0.00 0.02 0.00 0.00 57.03 56.78 3juw h ASP 11 Cb 1.31 0.11 0.00 0.00 0.22 0.00 0.00 39.33 40.96 3juw h ASP 11 CO 0.71 -0.08 0.00 0.54 -1.72 0.00 0.00 179.24 178.69 3juw n ARG 12 N -4.91 0.69 -3.91 3.56 1.74 -1.26 -5.05 116.66 107.52 3juw n ARG 12 Ca 0.31 -0.70 -0.11 0.00 -0.77 0.00 0.00 57.85 56.58 3juw n ARG 12 Cb 1.01 -0.76 -0.11 0.00 -1.02 0.00 0.00 32.46 31.59 3juw n ARG 12 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3juw s LEU 13 N -0.30 1.80 -0.15 0.55 1.43 -1.20 -4.36 118.68 116.45 3juw s LEU 13 Ca 0.00 -0.27 -0.03 0.00 -1.03 0.00 0.00 54.13 52.80 3juw s LEU 13 Cb 0.00 0.44 -0.03 0.00 0.03 0.00 0.00 46.19 46.63 3juw s LEU 13 CO 0.00 -0.31 -0.04 -0.69 0.23 0.00 0.00 176.35 175.54 3juw s VAL 14 N -1.25 3.88 -0.35 -1.59 1.01 0.45 -0.57 120.40 121.98 3juw s VAL 14 Ca -0.14 -0.37 -0.03 0.00 0.00 0.00 0.00 61.98 61.45 3juw s VAL 14 Cb -0.08 -2.69 0.07 0.00 0.00 0.00 0.00 36.38 33.68 3juw s VAL 14 CO 0.01 0.50 0.09 -0.76 0.00 0.00 0.00 175.10 174.94 3juw s LEU 15 N 0.31 4.46 -0.19 3.92 1.43 0.30 0.53 118.68 129.43 3juw s LEU 15 Ca -0.04 -1.51 -0.04 0.00 -1.03 0.00 0.00 54.13 51.52 3juw s LEU 15 Cb -0.14 -1.79 -0.02 0.00 0.03 0.00 0.00 46.19 44.28 3juw s LEU 15 CO 0.03 -0.37 -0.04 -0.70 0.23 0.00 0.00 176.35 175.50 3juw s GLU 16 N 1.25 3.50 0.23 1.70 2.12 -0.63 -1.04 118.70 125.83 3juw s GLU 16 Ca 0.00 -0.58 -0.31 0.00 0.36 0.00 0.00 54.97 54.44 3juw s GLU 16 Cb -0.21 -2.96 -0.14 0.00 0.26 0.00 0.00 34.13 31.08 3juw s GLU 16 CO -0.01 -0.00 1.19 -2.30 -0.54 0.00 0.00 175.26 173.59 3juw n PRO 17 N 4.23 1.48 -2.60 4.30 -0.02 -1.26 0.11 135.00 141.25 3juw n PRO 17 Ca -0.18 0.53 -0.41 0.00 -2.02 0.00 0.00 63.50 61.42 3juw n PRO 17 Cb 0.52 -2.03 -0.04 0.00 -0.02 0.00 0.00 33.50 31.93 3juw n PRO 17 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 3juw s GLN 18 N -0.79 4.62 0.00 -0.52 -0.21 0.05 -4.74 119.66 118.07 3juw s GLN 18 Ca 0.67 1.61 0.00 0.00 0.02 0.00 0.00 55.36 57.66 3juw s GLN 18 Cb -0.74 -3.33 0.00 0.00 1.00 0.00 0.00 33.01 29.94 3juw s GLN 18 CO 0.54 0.09 0.00 -1.13 -2.12 0.00 0.00 175.29 172.67 3juw n SER 19 N 2.77 0.00 0.00 5.90 3.41 -1.26 -4.50 113.62 119.93 3juw n SER 19 Ca 0.03 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.64 3juw n SER 19 Cb 0.48 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.43 3juw n SER 19 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3juw n ALA 21 N -3.00 0.00 -1.11 7.33 0.00 -1.26 -4.37 120.51 118.10 3juw n ALA 21 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.34 3juw n ALA 21 Cb 0.00 0.00 0.27 0.00 0.00 0.00 0.00 19.45 19.72 3juw n ALA 21 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3juw n ARG 22 N 0.00 3.28 -0.17 0.00 1.74 -1.26 -4.75 116.66 115.50 3juw n ARG 22 Ca 0.00 -3.08 -0.03 0.00 -0.77 0.00 0.00 57.85 53.97 3juw n ARG 22 Cb 0.00 -2.19 0.06 0.00 -1.02 0.00 0.00 32.46 29.32 3juw n ARG 22 CO 0.00 0.00 0.00 0.35 -1.52 0.00 0.00 177.63 176.46 3juw h PHE 23 N 2.18 0.42 -0.68 -1.55 3.57 -1.99 -1.16 116.94 117.71 3juw h PHE 23 Ca 0.35 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.91 3juw h PHE 23 Cb 2.43 -0.11 -0.04 0.00 2.79 0.00 0.00 35.95 41.02 3juw h PHE 23 CO 1.35 0.17 0.43 -0.44 -2.23 0.00 0.00 178.31 177.59 3juw h ASP 24 N 0.44 0.70 -0.13 0.41 3.32 -1.99 0.16 116.42 119.34 3juw h ASP 24 Ca 0.24 -0.00 -0.19 0.00 0.02 0.00 0.00 57.03 57.10 3juw h ASP 24 Cb 0.21 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.61 3juw h ASP 24 CO -0.20 0.49 -0.63 -0.61 -1.72 0.00 0.00 179.24 176.56 3juw h GLN 25 N 0.84 0.74 0.06 3.56 4.15 -1.84 -2.21 115.11 120.41 3juw h GLN 25 Ca 0.27 -0.52 -0.28 0.00 0.77 0.00 0.00 58.65 58.89 3juw h GLN 25 Cb 0.02 0.08 0.02 0.00 0.21 0.00 0.00 27.48 27.81 3juw h GLN 25 CO -0.11 1.14 -1.14 2.35 -1.93 0.00 0.00 178.83 179.14 3juw h TRP 26 N 0.55 1.01 -0.44 3.99 7.01 -1.04 -3.22 115.95 123.81 3juw h TRP 26 Ca -0.01 -0.59 0.02 0.00 2.11 0.00 0.00 58.89 60.41 3juw h TRP 26 Cb 1.23 -0.10 -0.03 0.00 -2.10 0.00 0.00 29.16 28.17 3juw h TRP 26 CO 0.07 1.43 0.27 0.35 -2.79 0.00 0.00 178.44 177.77 3juw h PHE 27 N 0.33 0.51 0.00 2.65 3.57 -0.97 -0.77 116.94 122.26 3juw h PHE 27 Ca -0.16 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.36 3juw h PHE 27 Cb 1.81 -0.17 0.00 0.00 2.79 0.00 0.00 35.95 40.38 3juw h PHE 27 CO 0.11 0.30 0.00 0.00 -2.23 0.00 0.00 178.31 176.49 3juw n ALA 28 N -2.24 1.49 0.00 2.41 0.00 -0.83 -1.79 120.51 119.54 3juw n ALA 28 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.46 3juw n ALA 28 Cb 0.05 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.50 3juw n ALA 28 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3juw n GLU 30 N 0.98 0.00 0.17 0.00 -0.58 -0.30 -2.81 120.64 118.10 3juw n GLU 30 Ca 0.00 0.00 0.12 0.00 -0.42 0.00 0.00 57.16 56.86 3juw n GLU 30 Cb 0.00 0.00 0.19 0.00 -0.57 0.00 0.00 31.44 31.06 3juw n GLU 30 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3juw h ARG 31 N 0.00 0.00 -0.00 3.49 3.08 -1.54 -3.11 114.38 116.31 3juw h ARG 31 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3juw h ARG 31 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 3juw h ARG 31 CO 0.00 0.00 -0.39 1.04 -1.07 0.00 0.00 179.97 179.55 3juw n GLN 32 N -2.80 0.28 -2.40 0.04 6.02 -1.12 -4.58 117.38 112.81 3juw n GLN 32 Ca 0.04 -0.15 -0.43 0.00 -0.01 0.00 0.00 57.00 56.44 3juw n GLN 32 Cb 0.51 -1.50 -0.02 0.00 1.02 0.00 0.00 30.24 30.25 3juw n GLN 32 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 3juw s ARG 33 N -2.83 3.54 -1.14 -1.09 3.52 -1.18 -4.90 118.95 114.88 3juw s ARG 33 Ca 0.16 0.78 -0.19 0.00 -0.13 0.00 0.00 55.73 56.34 3juw s ARG 33 Cb 0.18 -4.03 0.08 0.00 -1.56 0.00 0.00 34.95 29.63 3juw s ARG 33 CO 0.63 -1.61 1.52 0.34 -0.81 0.00 0.00 175.30 175.37 3juw s ASP 34 N 3.81 6.72 -0.29 -2.12 2.15 -1.26 -2.86 116.67 122.82 3juw s ASP 34 Ca 0.57 -2.09 -0.16 0.00 0.43 0.00 0.00 52.55 51.30 3juw s ASP 34 Cb -0.12 -2.53 0.15 0.00 -0.30 0.00 0.00 42.92 40.12 3juw s ASP 34 CO 0.31 -1.23 1.00 -1.61 -0.17 0.00 0.00 175.17 173.47 3juw s GLU 35 N 4.01 0.35 0.26 4.34 2.02 -1.26 -5.02 118.70 123.40 3juw s GLU 35 Ca 0.47 0.60 -0.30 0.00 0.02 0.00 0.00 54.97 55.76 3juw s GLU 35 Cb 0.01 0.07 -0.13 0.00 0.10 0.00 0.00 34.13 34.18 3juw s GLU 35 CO -0.02 -0.07 1.30 0.00 0.02 0.00 0.00 175.26 176.49 3juw n ALA 36 N 3.59 0.77 -0.25 5.21 0.00 -1.26 -1.75 120.51 126.81 3juw n ALA 36 Ca -0.18 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.66 3juw n ALA 36 Cb 0.57 -2.21 0.00 0.00 0.00 0.00 0.00 19.45 17.81 3juw n ALA 36 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3juw n GLY 37 N 1.72 0.72 1.53 0.00 0.00 -1.26 -4.83 105.19 103.06 3juw n GLY 37 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 3juw n GLY 37 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3juw n HIS 38 N -2.00 -1.12 0.33 1.61 -0.00 -0.72 -4.68 115.22 108.64 3juw n HIS 38 Ca 0.00 0.20 0.22 0.00 -0.00 0.00 0.00 57.72 58.14 3juw n HIS 38 Cb 0.00 0.30 1.20 0.00 -0.00 0.00 0.00 29.99 31.48 3juw n HIS 38 CO 0.00 0.00 0.00 0.07 -0.00 0.00 0.00 176.34 176.41 3juw h ARG 39 N 0.00 0.00 -0.07 -0.41 0.11 -1.29 -3.09 114.38 109.63 3juw h ARG 39 Ca 0.00 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 60.07 3juw h ARG 39 Cb 0.00 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.08 3juw h ARG 39 CO 0.00 0.00 -0.04 -0.40 0.10 0.00 0.00 179.97 179.63 3juw n ASP 40 N -3.05 2.65 -4.72 0.08 5.68 -1.26 -4.91 116.55 111.01 3juw n ASP 40 Ca -0.03 -3.16 -0.42 0.00 -0.50 0.00 0.00 54.79 50.68 3juw n ASP 40 Cb 0.07 -0.47 -0.03 0.00 -1.14 0.00 0.00 41.12 39.55 3juw n ASP 40 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 3juw s LEU 41 N -2.91 4.41 0.97 -2.12 1.02 -1.17 -4.91 118.68 113.97 3juw s LEU 41 Ca 0.35 2.10 -0.12 0.00 0.02 0.00 0.00 54.13 56.49 3juw s LEU 41 Cb 0.31 -3.59 0.17 0.00 0.02 0.00 0.00 46.19 43.10 3juw s LEU 41 CO 0.03 -0.42 1.09 0.42 0.02 0.00 0.00 176.35 177.50 3juw s THR 42 N 0.56 2.30 0.21 5.49 -4.23 -1.26 -4.84 115.64 113.87 3juw s THR 42 Ca 0.56 0.10 -0.04 0.00 -1.18 0.00 0.00 61.69 61.13 3juw s THR 42 Cb -0.31 -2.55 0.01 0.00 1.34 0.00 0.00 72.50 70.99 3juw s THR 42 CO 0.32 -0.13 1.60 -0.08 -0.54 0.00 0.00 174.62 175.80 3juw h GLU 43 N -1.81 0.69 -0.67 3.99 4.81 -1.99 -1.64 114.58 117.96 3juw h GLU 43 Ca -0.53 -0.31 -0.07 0.00 -0.13 0.00 0.00 59.36 58.32 3juw h GLU 43 Cb 1.31 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.65 3juw h GLU 43 CO 0.56 0.92 0.15 0.22 -0.73 0.00 0.00 179.01 180.12 3juw h ASP 44 N 0.59 1.02 -0.61 1.04 3.58 -1.99 0.47 116.42 120.52 3juw h ASP 44 Ca 0.07 -0.22 -0.05 0.00 0.42 0.00 0.00 57.03 57.25 3juw h ASP 44 Cb 0.83 -0.27 -0.03 0.00 1.72 0.00 0.00 39.33 41.58 3juw h ASP 44 CO 0.07 0.99 0.20 1.56 -2.88 0.00 0.00 179.24 179.18 3juw h GLN 45 N 1.02 0.98 -0.30 0.28 4.20 -1.84 0.35 115.11 119.81 3juw h GLN 45 Ca 0.21 -0.19 -0.10 0.00 0.06 0.00 0.00 58.65 58.62 3juw h GLN 45 Cb 0.38 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 28.00 3juw h GLN 45 CO 0.00 0.84 -0.22 0.00 -0.67 0.00 0.00 178.83 178.78 3juw h ALA 46 N 1.27 0.43 -0.53 3.87 0.00 -0.98 -0.90 119.26 122.42 3juw h ALA 46 Ca 0.21 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.75 3juw h ALA 46 Cb 0.27 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 3juw h ALA 46 CO -0.01 0.39 0.33 2.35 0.00 0.00 0.00 179.25 182.31 3juw h TRP 47 N 0.42 0.68 -0.24 0.00 2.91 -0.66 -0.95 115.95 118.11 3juw h TRP 47 Ca 0.06 0.01 -0.07 0.00 1.13 0.00 0.00 58.89 60.02 3juw h TRP 47 Cb 0.77 -0.23 -0.01 0.00 -0.51 0.00 0.00 29.16 29.18 3juw h TRP 47 CO 0.07 0.45 -0.14 -0.07 -1.03 0.00 0.00 178.44 177.72 3juw h LEU 48 N 0.71 0.39 -0.46 0.65 3.38 -0.75 -0.12 115.31 119.11 3juw h LEU 48 Ca 0.19 -0.10 -0.09 0.00 0.09 0.00 0.00 57.88 57.97 3juw h LEU 48 Cb -0.05 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 3juw h LEU 48 CO -0.04 0.56 -0.06 -0.09 0.09 0.00 0.00 178.44 178.90 3juw h ARG 49 N 0.37 0.86 -0.30 1.13 2.43 -0.59 -1.24 114.38 117.03 3juw h ARG 49 Ca 0.07 -0.31 -0.16 0.00 -0.81 0.00 0.00 59.98 58.78 3juw h ARG 49 Cb 0.47 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.96 3juw h ARG 49 CO 0.03 0.94 -0.44 1.25 -1.51 0.00 0.00 179.97 180.23 3juw h LEU 50 N 0.70 0.84 -0.92 3.80 5.85 -0.99 -1.92 115.31 122.67 3juw h LEU 50 Ca 0.12 -0.40 0.14 0.00 0.84 0.00 0.00 57.88 58.58 3juw h LEU 50 Cb 0.59 -0.24 -0.09 0.00 0.37 0.00 0.00 40.66 41.29 3juw h LEU 50 CO 0.04 1.16 0.53 0.00 -0.34 0.00 0.00 178.44 179.82 3juw h ALA 52 N 1.56 1.03 -0.60 0.00 0.00 -0.91 -0.90 119.26 119.44 3juw h ALA 52 Ca 0.49 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 55.07 3juw h ALA 52 Cb 0.63 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 3juw h ALA 52 CO -0.33 0.60 0.22 0.00 0.00 0.00 0.00 179.25 179.74 3juw h ARG 53 N 0.77 0.91 -0.65 0.00 2.47 -0.51 -2.57 114.38 114.80 3juw h ARG 53 Ca 0.14 -0.17 -0.05 0.00 -1.26 0.00 0.00 59.98 58.63 3juw h ARG 53 Cb 0.51 -0.14 -0.03 0.00 -1.65 0.00 0.00 29.97 28.66 3juw h ARG 53 CO 0.03 0.78 0.20 0.37 0.56 0.00 0.00 179.97 181.91 3juw h GLN 54 N 0.84 1.01 -0.48 0.04 4.15 -1.01 -2.78 115.11 116.87 3juw h GLN 54 Ca 0.20 -0.22 0.00 0.00 0.77 0.00 0.00 58.65 59.40 3juw h GLN 54 Cb 0.23 -0.14 0.00 0.00 0.21 0.00 0.00 27.48 27.78 3juw h GLN 54 CO -0.01 0.89 0.00 0.41 -1.93 0.00 0.00 178.83 178.18 3juw n GLY 55 N -0.72 0.00 1.04 2.39 0.00 -0.37 -1.61 105.19 105.92 3juw n GLY 55 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 3juw n GLY 55 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 3juw n TRP 57 N 0.46 0.00 -0.17 1.61 7.02 -1.05 -1.15 117.44 124.16 3juw n TRP 57 Ca 0.00 0.00 -0.09 0.00 -1.02 0.00 0.00 57.50 56.39 3juw n TRP 57 Cb 0.00 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 28.89 3juw n TRP 57 CO 0.00 0.00 0.00 0.22 -2.02 0.00 0.00 177.69 175.89 3juw h ASP 58 N 0.00 0.79 0.72 -0.99 3.58 -1.60 -1.40 116.42 117.52 3juw h ASP 58 Ca 0.00 -0.27 -0.26 0.00 0.42 0.00 0.00 57.03 56.92 3juw h ASP 58 Cb 0.00 -0.21 -0.01 0.00 1.72 0.00 0.00 39.33 40.83 3juw h ASP 58 CO 0.00 0.86 -1.24 0.00 -2.88 0.00 0.00 179.24 175.98 3juw h ALA 59 N 0.96 0.26 0.00 -0.78 0.00 -1.42 -3.40 119.26 114.89 3juw h ALA 59 Ca 0.15 -0.97 0.00 0.00 0.00 0.00 0.00 54.91 54.08 3juw h ALA 59 Cb 0.41 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.24 3juw h ALA 59 CO 0.01 1.14 0.00 0.66 0.00 0.00 0.00 179.25 181.06 3juw n TYR 60 N -3.42 0.00 -2.18 0.00 4.01 -1.24 -5.01 117.16 109.32 3juw n TYR 60 Ca -0.07 0.00 -0.15 0.00 -0.16 0.00 0.00 57.90 57.51 3juw n TYR 60 Cb 1.00 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 40.01 3juw n TYR 60 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3juw n ALA 61 N -0.62 -0.60 -3.06 -0.72 0.00 -0.53 -4.97 120.51 110.02 3juw n ALA 61 Ca 0.00 0.16 -0.09 0.00 0.00 0.00 0.00 53.44 53.50 3juw n ALA 61 Cb 0.00 -1.70 -0.05 0.00 0.00 0.00 0.00 19.45 17.70 3juw n ALA 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3juw n GLY 63 N -0.30 -0.61 3.85 0.00 0.00 -1.26 -3.62 105.19 103.24 3juw n GLY 63 Ca -0.07 -0.54 -0.32 0.00 0.00 0.00 0.00 46.02 45.08 3juw n GLY 63 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3juw s PHE 64 N -4.00 3.38 0.05 1.61 0.40 -1.18 -2.28 117.98 115.97 3juw s PHE 64 Ca 0.00 1.16 0.08 0.00 -0.60 0.00 0.00 56.93 57.58 3juw s PHE 64 Cb 0.00 -2.49 -0.03 0.00 0.51 0.00 0.00 43.02 41.01 3juw s PHE 64 CO 0.00 0.12 -0.23 0.71 0.70 0.00 0.00 175.22 176.51 3juw s TYR 65 N -1.97 2.05 0.23 0.36 1.51 0.13 -0.77 117.35 118.90 3juw s TYR 65 Ca 0.53 -0.39 -0.30 0.00 -1.01 0.00 0.00 57.07 55.90 3juw s TYR 65 Cb -0.10 -1.22 -0.09 0.00 -0.11 0.00 0.00 41.96 40.44 3juw s TYR 65 CO 0.18 0.12 1.03 0.71 -1.11 0.00 0.00 175.55 176.48 3juw s TYR 66 N -0.82 3.75 -0.34 2.71 2.02 0.12 -1.97 117.35 122.81 3juw s TYR 66 Ca 0.10 1.77 -0.15 0.00 -0.37 0.00 0.00 57.07 58.42 3juw s TYR 66 Cb -0.09 -3.16 -0.01 0.00 -0.40 0.00 0.00 41.96 38.30 3juw s TYR 66 CO 0.02 -0.14 0.34 -0.51 -1.57 0.00 0.00 175.55 173.69 3juw s LEU 67 N -1.05 4.46 -0.08 -1.29 1.43 -0.38 -1.60 118.68 120.16 3juw s LEU 67 Ca 0.44 -0.27 0.00 0.00 -1.03 0.00 0.00 54.13 53.27 3juw s LEU 67 Cb -0.29 -2.30 -0.03 0.00 0.03 0.00 0.00 46.19 43.60 3juw s LEU 67 CO 0.36 -0.32 -0.08 -0.76 0.23 0.00 0.00 176.35 175.78 3juw s LEU 68 N 1.96 3.08 -0.01 1.79 1.43 0.19 0.04 118.68 127.15 3juw s LEU 68 Ca 0.11 -0.09 -0.30 0.00 -1.03 0.00 0.00 54.13 52.82 3juw s LEU 68 Cb -0.17 -1.68 -0.06 0.00 0.03 0.00 0.00 46.19 44.32 3juw s LEU 68 CO 0.11 0.31 1.53 -0.62 0.23 0.00 0.00 176.35 177.92 3juw s ASP 69 N -0.52 6.74 0.54 2.29 2.15 -0.31 -0.41 116.67 127.15 3juw s ASP 69 Ca 0.08 2.21 0.31 0.00 0.43 0.00 0.00 52.55 55.58 3juw s ASP 69 Cb -0.12 -2.55 1.53 0.00 -0.30 0.00 0.00 42.92 41.49 3juw s ASP 69 CO 0.02 -0.83 2.08 -0.65 -0.17 0.00 0.00 175.17 175.62 3juw h PRO 70 N 8.55 0.00 0.00 4.34 0.11 -1.91 0.19 132.00 143.27 3juw h PRO 70 Ca -0.39 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.71 3juw h PRO 70 Cb 1.18 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.29 3juw h PRO 70 CO 0.93 0.09 -0.27 0.28 -0.21 0.00 0.00 178.00 178.82 3juw h VAL 71 N 0.00 0.14 0.00 3.15 2.07 -1.93 -3.42 116.25 116.27 3juw h VAL 71 Ca -0.00 -1.13 0.00 0.00 0.82 0.00 0.00 66.70 66.39 3juw h VAL 71 Cb 0.36 0.30 0.00 0.00 -1.52 0.00 0.00 31.29 30.43 3juw h VAL 71 CO 0.01 0.05 -1.20 -1.54 0.02 0.00 0.00 177.57 174.91 3juw n SER 72 N -4.69 0.61 0.00 0.57 3.41 -1.20 -4.97 113.62 107.35 3juw n SER 72 Ca -0.05 0.13 0.00 0.00 -0.26 0.00 0.00 58.87 58.69 3juw n SER 72 Cb 0.17 0.84 0.00 0.00 -0.26 0.00 0.00 64.21 64.96 3juw n SER 72 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3juw n GLY 73 N 1.25 1.35 0.00 5.00 0.00 0.65 -5.00 105.19 108.43 3juw n GLY 73 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3juw n GLY 73 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3juw n GLU 74 N -2.00 0.51 0.00 1.61 1.02 -1.26 -4.65 120.64 115.87 3juw n GLU 74 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 3juw n GLU 74 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 3juw n GLU 74 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3juw n ARG 76 N 0.00 0.00 -2.12 3.49 3.00 0.11 -1.16 116.66 119.98 3juw n ARG 76 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.84 3juw n ARG 76 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.46 3juw n ARG 76 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 3juw n GLY 77 N 0.00 -0.04 3.55 -0.13 0.00 -1.23 -0.88 105.19 106.45 3juw n GLY 77 Ca 0.00 -1.29 -0.16 0.00 0.00 0.00 0.00 46.02 44.57 3juw n GLY 77 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3juw s GLU 78 N -2.00 0.97 0.17 1.61 -1.05 -0.62 -1.25 118.70 116.53 3juw s GLU 78 Ca 0.00 0.45 -0.20 0.00 -0.15 0.00 0.00 54.97 55.07 3juw s GLU 78 Cb 0.00 0.46 0.05 0.00 -0.44 0.00 0.00 34.13 34.20 3juw s GLU 78 CO 0.00 -0.26 0.54 0.00 0.95 0.00 0.00 175.26 176.50 3juw s ALA 79 N -0.76 -1.23 0.00 -0.84 0.00 -0.83 -1.27 121.76 116.83 3juw s ALA 79 Ca -0.07 0.09 0.00 0.00 0.00 0.00 0.00 51.96 51.98 3juw s ALA 79 Cb -0.01 0.83 0.00 0.00 0.00 0.00 0.00 23.12 23.94 3juw s ALA 79 CO 0.07 -0.78 0.00 0.41 0.00 0.00 0.00 175.76 175.46 3juw n GLY 80 N -0.34 0.16 3.17 0.00 0.00 -0.74 0.17 105.19 107.60 3juw n GLY 80 Ca -0.14 -1.13 -0.22 0.00 0.00 0.00 0.00 46.02 44.54 3juw n GLY 80 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3juw s PHE 81 N -4.00 1.37 0.06 1.61 0.08 -0.96 -1.47 117.98 114.67 3juw s PHE 81 Ca 0.00 -0.35 -0.01 0.00 0.12 0.00 0.00 56.93 56.70 3juw s PHE 81 Cb 0.00 -0.82 -0.04 0.00 -0.57 0.00 0.00 43.02 41.59 3juw s PHE 81 CO 0.00 0.04 -0.03 1.14 -0.10 0.00 0.00 175.22 176.27 3juw s GLN 82 N -1.08 0.64 -0.12 0.44 -2.07 -0.07 -3.07 119.66 114.32 3juw s GLN 82 Ca 0.03 -1.24 0.02 0.00 -1.82 0.00 0.00 55.36 52.36 3juw s GLN 82 Cb -0.08 0.16 0.01 0.00 -1.09 0.00 0.00 33.01 32.01 3juw s GLN 82 CO 0.01 -0.10 -0.19 -0.06 -1.32 0.00 0.00 175.29 173.63 3juw s PHE 83 N -3.89 2.31 0.02 9.60 0.40 -1.26 -1.05 117.98 124.11 3juw s PHE 83 Ca 0.08 -1.10 -0.03 0.00 -0.60 0.00 0.00 56.93 55.27 3juw s PHE 83 Cb 0.08 -1.60 -0.01 0.00 0.51 0.00 0.00 43.02 41.99 3juw s PHE 83 CO -0.09 -0.52 0.04 1.03 0.70 0.00 0.00 175.22 176.38 3juw s ARG 84 N 0.84 0.45 -0.59 0.44 1.81 -1.26 -4.99 118.95 115.65 3juw s ARG 84 Ca -0.08 -0.65 0.06 0.00 -1.72 0.00 0.00 55.73 53.34 3juw s ARG 84 Cb -0.15 0.17 0.27 0.00 -0.45 0.00 0.00 34.95 34.78 3juw s ARG 84 CO -0.00 -0.09 0.75 0.54 -0.68 0.00 0.00 175.30 175.81 3juw n ARG 85 N 1.22 2.33 0.00 3.54 1.74 -1.26 -1.84 116.66 122.39 3juw n ARG 85 Ca -0.22 -4.46 0.12 0.00 -0.77 0.00 0.00 57.85 52.53 3juw n ARG 85 Cb 0.57 -2.09 0.60 0.00 -1.02 0.00 0.00 32.46 30.51 3juw n ARG 85 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3juw n ARG 86 N 0.75 0.23 -1.04 5.56 1.74 -1.26 -4.89 116.66 117.75 3juw n ARG 86 Ca 0.29 0.06 0.00 0.00 -0.77 0.00 0.00 57.85 57.43 3juw n ARG 86 Cb 0.43 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.37 3juw n ARG 86 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3juw n GLY 87 N 0.92 0.98 0.87 -0.13 0.00 -1.26 -4.97 105.19 101.60 3juw n GLY 87 Ca 0.10 -0.54 0.11 0.00 0.00 0.00 0.00 46.02 45.69 3juw n GLY 87 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3juw n PHE 88 N -2.70 0.40 0.00 1.61 3.72 -1.26 -5.05 117.46 114.18 3juw n PHE 88 Ca 0.00 -0.20 0.00 0.00 -0.05 0.00 0.00 57.45 57.20 3juw n PHE 88 Cb 0.23 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.77 3juw n PHE 88 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3juw n GLY 89 N 1.32 2.10 0.19 1.37 0.00 -1.26 -4.59 105.19 104.32 3juw n GLY 89 Ca 0.18 -2.01 0.14 0.00 0.00 0.00 0.00 46.02 44.33 3juw n GLY 89 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3juw h PRO 90 N 0.00 0.00 0.00 1.61 0.13 -1.97 0.22 132.00 132.00 3juw h PRO 90 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 3juw h PRO 90 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 3juw h PRO 90 CO 0.00 0.00 0.00 0.78 -0.23 0.00 0.00 178.00 178.55 3juw h GLY 91 N 2.49 0.00 0.00 1.56 0.00 -2.01 -3.40 103.07 101.70 3juw h GLY 91 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3juw h GLY 91 CO 0.00 0.00 -0.47 0.33 0.00 0.00 0.00 176.54 176.40 3juw n PHE 92 N -2.73 -0.26 -1.79 5.60 7.35 -0.49 -4.96 117.46 120.18 3juw n PHE 92 Ca 0.01 0.05 -0.38 0.00 -0.76 0.00 0.00 57.45 56.37 3juw n PHE 92 Cb 0.29 0.15 0.05 0.00 0.35 0.00 0.00 39.48 40.31 3juw n PHE 92 CO 0.00 0.00 0.00 -0.51 -0.76 0.00 0.00 176.76 175.49 3juw s ASP 93 N -5.26 5.14 -1.46 -2.13 1.11 0.67 -3.23 116.67 111.51 3juw s ASP 93 Ca 0.00 2.72 -0.04 0.00 0.18 0.00 0.00 52.55 55.41 3juw s ASP 93 Cb 0.00 -2.63 0.02 0.00 1.07 0.00 0.00 42.92 41.38 3juw s ASP 93 CO 0.00 -1.66 0.40 0.59 1.18 0.00 0.00 175.17 175.69 3juw n ASN 94 N -1.22 -5.21 -4.47 0.27 4.13 -0.77 -4.74 115.26 103.24 3juw n ASN 94 Ca 0.12 -0.20 -0.25 0.00 1.68 0.00 0.00 54.58 55.93 3juw n ASN 94 Cb 0.46 -4.28 -0.10 0.00 -1.54 0.00 0.00 39.78 34.32 3juw n ASN 94 CO 0.00 0.00 0.00 -1.00 0.28 0.00 0.00 177.26 176.54 3juw s HIS 95 N -3.02 2.32 0.05 3.10 3.76 -1.20 -5.03 115.29 115.28 3juw s HIS 95 Ca 0.24 -0.33 -0.30 0.00 -0.15 0.00 0.00 55.06 54.52 3juw s HIS 95 Cb -0.11 -1.04 -0.08 0.00 1.11 0.00 0.00 32.58 32.46 3juw s HIS 95 CO 0.29 0.67 1.75 -2.14 -0.85 0.00 0.00 174.74 174.46 3juw s PRO 96 N -3.34 4.17 -0.22 8.40 0.02 -1.26 -4.64 135.00 138.14 3juw s PRO 96 Ca 0.28 2.41 -0.05 0.00 0.02 0.00 0.00 61.00 63.66 3juw s PRO 96 Cb -0.06 -3.77 -0.02 0.00 0.02 0.00 0.00 34.50 30.67 3juw s PRO 96 CO 0.14 -0.82 -0.00 -2.00 -0.33 0.00 0.00 177.00 173.99 3juw s GLU 97 N 3.24 3.53 0.32 5.54 2.12 -0.21 -1.16 118.70 132.08 3juw s GLU 97 Ca 0.78 -0.55 -0.26 0.00 0.36 0.00 0.00 54.97 55.29 3juw s GLU 97 Cb -0.40 -3.09 -0.10 0.00 0.26 0.00 0.00 34.13 30.80 3juw s GLU 97 CO 0.34 -0.10 0.95 0.00 -0.54 0.00 0.00 175.26 175.91 3juw s ALA 98 N 1.29 3.21 -0.02 6.30 0.00 0.11 -0.90 121.76 131.75 3juw s ALA 98 Ca 0.04 0.54 -0.30 0.00 0.00 0.00 0.00 51.96 52.24 3juw s ALA 98 Cb -0.15 -3.19 0.08 0.00 0.00 0.00 0.00 23.12 19.86 3juw s ALA 98 CO 0.00 0.15 0.70 0.00 0.00 0.00 0.00 175.76 176.62 3juw s ALA 99 N -1.59 -1.76 0.05 0.00 0.00 -0.54 -4.55 121.76 113.37 3juw s ALA 99 Ca 0.50 1.20 -0.27 0.00 0.00 0.00 0.00 51.96 53.39 3juw s ALA 99 Cb -0.19 0.10 0.07 0.00 0.00 0.00 0.00 23.12 23.09 3juw s ALA 99 CO 0.24 -0.44 0.63 1.67 0.00 0.00 0.00 175.76 177.86 3juw s TRP 100 N -1.66 -0.58 -0.26 0.00 -2.14 -1.26 -1.79 118.94 111.24 3juw s TRP 100 Ca -0.08 0.72 -0.22 0.00 2.66 0.00 0.00 56.10 59.18 3juw s TRP 100 Cb -0.00 0.47 0.07 0.00 -3.10 0.00 0.00 33.47 30.90 3juw s TRP 100 CO 0.05 -0.71 0.69 0.00 -2.66 0.00 0.00 176.95 174.31 3juw s ALA 101 N -2.41 -1.75 -0.06 2.67 0.00 -0.40 -4.99 121.76 114.81 3juw s ALA 101 Ca -0.05 2.09 0.03 0.00 0.00 0.00 0.00 51.96 54.02 3juw s ALA 101 Cb -0.00 -1.22 -0.02 0.00 0.00 0.00 0.00 23.12 21.87 3juw s ALA 101 CO -0.01 -0.34 -0.15 0.08 0.00 0.00 0.00 175.76 175.34 3juw s VAL 102 N 0.74 2.98 0.42 0.00 1.01 -1.26 -1.59 120.40 122.69 3juw s VAL 102 Ca -0.03 -0.74 -0.25 0.00 0.00 0.00 0.00 61.98 60.96 3juw s VAL 102 Cb -0.05 -2.17 -0.10 0.00 0.00 0.00 0.00 36.38 34.06 3juw s VAL 102 CO -0.05 0.58 1.15 0.00 0.00 0.00 0.00 175.10 176.77 3juw n ALA 103 N 2.56 0.75 -0.28 5.51 0.00 -0.06 -4.78 120.51 124.20 3juw n ALA 103 Ca -0.17 0.24 0.04 0.00 0.00 0.00 0.00 53.44 53.55 3juw n ALA 103 Cb 0.52 -2.18 0.18 0.00 0.00 0.00 0.00 19.45 17.97 3juw n ALA 103 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3juw h SER 104 N 1.80 0.57 0.00 0.00 4.64 -1.91 -1.22 113.55 117.42 3juw h SER 104 Ca -0.46 0.07 0.00 0.00 -0.47 0.00 0.00 61.79 60.93 3juw h SER 104 Cb 1.32 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 3juw h SER 104 CO 0.58 0.30 0.19 0.00 -0.87 0.00 0.00 176.83 177.03 3juw h ALA 105 N 1.48 1.19 0.00 5.18 0.00 -1.98 -2.72 119.26 122.41 3juw h ALA 105 Ca 0.41 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.32 3juw h ALA 105 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.25 3juw h ALA 105 CO -0.29 -0.19 -0.05 0.72 0.00 0.00 0.00 179.25 179.44 3juw n HIS 106 N -2.86 0.00 -1.46 0.00 -0.00 -0.48 -5.05 115.22 105.37 3juw n HIS 106 Ca -0.02 -0.54 -0.31 0.00 -0.00 0.00 0.00 57.72 56.85 3juw n HIS 106 Cb 0.25 -0.07 0.06 0.00 -0.00 0.00 0.00 29.99 30.23 3juw n HIS 106 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 176.34 175.69 3juw s GLN 107 N -1.36 2.70 -0.43 -0.41 -0.21 -1.03 -4.07 119.66 114.86 3juw s GLN 107 Ca 0.10 1.03 0.00 0.00 0.02 0.00 0.00 55.36 56.51 3juw s GLN 107 Cb 0.09 -1.96 0.00 0.00 1.00 0.00 0.00 33.01 32.14 3juw s GLN 107 CO 0.01 -1.29 0.00 0.41 -2.12 0.00 0.00 175.29 172.30 3juw n GLY 108 N -1.73 0.62 0.13 3.09 0.00 -1.26 -4.92 105.19 101.12 3juw n GLY 108 Ca 0.08 -0.85 0.03 0.00 0.00 0.00 0.00 46.02 45.28 3juw n GLY 108 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3juw n ARG 109 N -2.63 2.59 -1.02 1.61 5.12 -1.26 -4.98 116.66 116.10 3juw n ARG 109 Ca -0.04 -1.87 -0.01 0.00 -1.93 0.00 0.00 57.85 54.00 3juw n ARG 109 Cb 0.20 -1.18 -0.00 0.00 -1.16 0.00 0.00 32.46 30.32 3juw n ARG 109 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3juw n GLY 110 N -0.59 0.46 0.27 -0.13 0.00 -1.26 -4.96 105.19 98.98 3juw n GLY 110 Ca 0.06 -0.17 -0.02 0.00 0.00 0.00 0.00 46.02 45.89 3juw n GLY 110 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3juw h LEU 111 N 0.00 0.65 -0.50 0.99 4.07 -1.93 -2.00 115.31 116.59 3juw h LEU 111 Ca -0.01 0.02 -0.08 0.00 0.08 0.00 0.00 57.88 57.89 3juw h LEU 111 Cb 0.19 -0.12 -0.02 0.00 1.08 0.00 0.00 40.66 41.79 3juw h LEU 111 CO 0.02 0.43 0.02 0.00 -1.08 0.00 0.00 178.44 177.83 3juw h ALA 112 N 1.34 0.67 -0.42 1.53 0.00 -1.94 -0.84 119.26 119.59 3juw h ALA 112 Ca 0.31 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3juw h ALA 112 Cb 0.13 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 3juw h ALA 112 CO -0.16 0.46 0.28 0.00 0.00 0.00 0.00 179.25 179.84 3juw h ALA 113 N 0.94 0.54 -0.26 0.00 0.00 -1.96 -3.06 119.26 115.46 3juw h ALA 113 Ca 0.14 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 3juw h ALA 113 Cb 0.49 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 3juw h ALA 113 CO 0.02 -0.01 0.13 1.49 0.00 0.00 0.00 179.25 180.88 3juw h GLU 114 N 0.58 0.37 -0.03 0.00 4.81 -1.09 0.15 114.58 119.36 3juw h GLU 114 Ca 0.16 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.33 3juw h GLU 114 Cb -0.06 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.25 3juw h GLU 114 CO -0.03 0.36 0.00 0.00 -0.73 0.00 0.00 179.01 178.61 3juw n ALA 115 N -2.23 1.19 0.00 2.92 0.00 -0.34 -2.67 120.51 119.38 3juw n ALA 115 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.41 3juw n ALA 115 Cb 0.10 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.55 3juw n ALA 115 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 3juw n GLN 117 N 0.22 0.00 -0.17 0.00 7.27 0.52 -1.26 117.38 123.96 3juw n GLN 117 Ca 0.00 0.00 -0.10 0.00 0.07 0.00 0.00 57.00 56.97 3juw n GLN 117 Cb 0.01 0.00 0.00 0.00 2.41 0.00 0.00 30.24 32.66 3juw n GLN 117 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3juw h ALA 118 N 0.00 0.66 -0.46 1.69 0.00 -1.74 -2.23 119.26 117.18 3juw h ALA 118 Ca 0.00 -0.26 -0.12 0.00 0.00 0.00 0.00 54.91 54.53 3juw h ALA 118 Cb 0.00 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 3juw h ALA 118 CO 0.00 0.43 -0.17 -0.07 0.00 0.00 0.00 179.25 179.44 3juw h LEU 119 N 0.71 0.90 -0.89 0.00 3.38 -1.45 -2.27 115.31 115.68 3juw h LEU 119 Ca 0.14 -0.31 -0.04 0.00 0.09 0.00 0.00 57.88 57.76 3juw h LEU 119 Cb 0.47 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.93 3juw h LEU 119 CO 0.02 1.06 0.36 -0.07 0.09 0.00 0.00 178.44 179.89 3juw h LEU 120 N 0.78 1.06 -0.42 1.67 3.38 -1.80 -0.78 115.31 119.21 3juw h LEU 120 Ca 0.11 -0.14 -0.17 0.00 0.09 0.00 0.00 57.88 57.78 3juw h LEU 120 Cb 0.71 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 41.19 3juw h LEU 120 CO 0.05 0.91 -0.50 0.00 0.09 0.00 0.00 178.44 179.00 3juw h ALA 121 N 1.24 0.59 -0.70 1.53 0.00 -1.26 -0.64 119.26 120.02 3juw h ALA 121 Ca 0.27 -0.49 -0.07 0.00 0.00 0.00 0.00 54.91 54.61 3juw h ALA 121 Cb 0.15 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 3juw h ALA 121 CO -0.03 0.68 0.15 1.25 0.00 0.00 0.00 179.25 181.30 3juw h HIS 122 N 0.61 1.19 -0.48 0.00 -0.00 -1.34 -2.70 115.15 112.43 3juw h HIS 122 Ca 0.03 -0.15 -0.03 0.00 -0.00 0.00 0.00 60.37 60.21 3juw h HIS 122 Cb 1.07 -0.33 -0.02 0.00 -0.00 0.00 0.00 27.41 28.13 3juw h HIS 122 CO 0.06 0.98 0.17 1.25 -0.00 0.00 0.00 177.93 180.39 3juw h HIS 123 N 1.07 0.75 -0.52 5.26 6.17 -0.85 -2.25 115.15 124.77 3juw h HIS 123 Ca 0.22 -0.07 0.06 0.00 0.71 0.00 0.00 60.37 61.29 3juw h HIS 123 Cb 0.39 -0.22 -0.05 0.00 2.52 0.00 0.00 27.41 30.06 3juw h HIS 123 CO 0.03 0.64 0.24 -0.44 0.71 0.00 0.00 177.93 179.11 3juw h ASP 124 N 0.63 0.32 -0.79 3.26 3.32 -0.88 -2.34 116.42 119.94 3juw h ASP 124 Ca 0.16 0.04 -0.03 0.00 0.02 0.00 0.00 57.03 57.22 3juw h ASP 124 Cb 0.23 -0.01 -0.04 0.00 0.22 0.00 0.00 39.33 39.73 3juw h ASP 124 CO -0.01 0.22 0.40 0.03 -1.72 0.00 0.00 179.24 178.15 3juw h ARG 125 N 0.46 1.13 0.07 3.56 3.08 -1.33 -1.18 114.38 120.18 3juw h ARG 125 Ca 0.24 -0.16 -0.00 0.00 0.07 0.00 0.00 59.98 60.13 3juw h ARG 125 Cb 0.19 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 30.03 3juw h ARG 125 CO -0.19 0.87 -0.04 0.77 -1.07 0.00 0.00 179.97 180.31 3juw h SER 126 N 1.12 -0.08 -0.37 7.04 0.02 -0.98 -3.35 113.55 116.94 3juw h SER 126 Ca 0.27 -0.51 0.00 0.00 -0.84 0.00 0.00 61.79 60.72 3juw h SER 126 Cb 0.10 0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.66 3juw h SER 126 CO -0.04 0.51 0.00 -1.54 -1.14 0.00 0.00 176.83 174.62 3juw n SER 127 N -4.85 3.40 -2.34 3.07 3.41 -0.92 -4.96 113.62 110.44 3juw n SER 127 Ca -0.08 -2.31 -0.17 0.00 -0.26 0.00 0.00 58.87 56.05 3juw n SER 127 Cb 0.29 -0.36 0.03 0.00 -0.26 0.00 0.00 64.21 63.91 3juw n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3juw n GLY 128 N 0.35 -0.19 1.95 5.00 0.00 -0.51 -4.26 105.19 107.52 3juw n GLY 128 Ca 0.16 -0.10 -0.04 0.00 0.00 0.00 0.00 46.02 46.05 3juw n GLY 128 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3juw n ARG 129 N -3.24 -0.56 -2.61 1.61 3.00 -0.82 -5.01 116.66 109.03 3juw n ARG 129 Ca -0.07 0.25 -0.24 0.00 -0.00 0.00 0.00 57.85 57.78 3juw n ARG 129 Cb 0.58 -2.61 0.03 0.00 0.00 0.00 0.00 32.46 30.46 3juw n ARG 129 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.63 178.77 3juw s GLN 130 N -3.34 2.84 0.32 -0.14 -2.07 -1.26 -5.04 119.66 110.96 3juw s GLN 130 Ca 0.11 -0.31 -0.29 0.00 -1.82 0.00 0.00 55.36 53.05 3juw s GLN 130 Cb -0.01 -2.39 -0.11 0.00 -1.09 0.00 0.00 33.01 29.41 3juw s GLN 130 CO 0.19 -0.62 1.49 0.50 -1.32 0.00 0.00 175.29 175.54 3juw s ARG 131 N -4.84 4.18 0.05 9.60 3.52 -1.26 -4.91 118.95 125.29 3juw s ARG 131 Ca 0.53 2.48 0.08 0.00 -0.13 0.00 0.00 55.73 58.69 3juw s ARG 131 Cb -0.10 -3.03 -0.03 0.00 -1.56 0.00 0.00 34.95 30.23 3juw s ARG 131 CO 0.42 -0.50 -0.23 0.08 -0.81 0.00 0.00 175.30 174.26 3juw s VAL 132 N -0.50 1.83 0.41 7.11 1.01 -0.93 -4.44 120.40 124.89 3juw s VAL 132 Ca 0.57 -1.31 0.07 0.00 0.00 0.00 0.00 61.98 61.31 3juw s VAL 132 Cb -0.45 -1.59 -0.08 0.00 0.00 0.00 0.00 36.38 34.26 3juw s VAL 132 CO 0.52 0.22 0.01 0.68 0.00 0.00 0.00 175.10 176.54 3juw s VAL 133 N -0.85 2.03 -0.02 2.92 -7.23 -0.31 -0.68 120.40 116.27 3juw s VAL 133 Ca 0.09 -2.00 -0.16 0.00 -1.81 0.00 0.00 61.98 58.10 3juw s VAL 133 Cb -0.09 -2.98 0.03 0.00 0.56 0.00 0.00 36.38 33.89 3juw s VAL 133 CO 0.02 -0.01 0.35 0.00 -0.31 0.00 0.00 175.10 175.15 3juw s ALA 134 N -2.70 -0.89 -0.21 1.32 0.00 -0.62 0.05 121.76 118.71 3juw s ALA 134 Ca 0.35 0.44 -0.01 0.00 0.00 0.00 0.00 51.96 52.74 3juw s ALA 134 Cb 0.09 0.06 0.01 0.00 0.00 0.00 0.00 23.12 23.29 3juw s ALA 134 CO 0.18 -0.27 -0.13 -1.17 0.00 0.00 0.00 175.76 174.38 3juw s LEU 135 N -1.29 2.58 0.01 0.00 2.96 -1.26 -1.26 118.68 120.41 3juw s LEU 135 Ca -0.13 -0.63 0.01 0.00 -0.22 0.00 0.00 54.13 53.16 3juw s LEU 135 Cb -0.05 -1.59 -0.01 0.00 0.50 0.00 0.00 46.19 45.04 3juw s LEU 135 CO 0.05 -0.03 -0.03 -0.63 -1.32 0.00 0.00 176.35 174.38 3juw s ILE 136 N 1.35 0.23 0.27 6.68 1.01 -0.91 -4.99 121.20 124.84 3juw s ILE 136 Ca 0.04 -0.33 -0.29 0.00 0.00 0.00 0.00 60.65 60.07 3juw s ILE 136 Cb -0.14 -0.24 -0.10 0.00 0.01 0.00 0.00 42.46 42.00 3juw s ILE 136 CO -0.08 -0.07 1.28 0.00 0.00 0.00 0.00 174.94 176.06 3juw s ALA 137 N -0.40 3.50 0.40 9.38 0.00 -1.26 -0.32 121.76 133.06 3juw s ALA 137 Ca -0.03 1.14 0.07 0.00 0.00 0.00 0.00 51.96 53.15 3juw s ALA 137 Cb -0.03 -3.46 0.82 0.00 0.00 0.00 0.00 23.12 20.45 3juw s ALA 137 CO -0.00 -0.52 2.00 -0.09 0.00 0.00 0.00 175.76 177.15 3juw h ARG 138 N 4.33 0.45 0.00 0.00 2.43 -1.67 -0.10 114.38 119.83 3juw h ARG 138 Ca -0.47 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.65 3juw h ARG 138 Cb 1.22 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.68 3juw h ARG 138 CO 0.71 0.38 0.00 -1.13 -1.51 0.00 0.00 179.97 178.42 3juw n SER 139 N -4.41 0.00 -4.00 -3.80 3.41 -1.26 -4.51 113.62 99.06 3juw n SER 139 Ca 0.02 -1.71 -0.40 0.00 -0.26 0.00 0.00 58.87 56.52 3juw n SER 139 Cb 0.13 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.06 3juw n SER 139 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 3juw n ASN 140 N -0.62 5.44 0.12 4.04 2.85 -0.05 -4.91 115.26 122.13 3juw n ASN 140 Ca 0.05 -3.30 -0.13 0.00 -0.11 0.00 0.00 54.58 51.10 3juw n ASN 140 Cb 0.02 -1.16 -0.06 0.00 1.24 0.00 0.00 39.78 39.83 3juw n ASN 140 CO 0.00 0.00 0.00 -0.07 -2.11 0.00 0.00 177.26 175.08 3juw h LEU 141 N 5.57 -0.66 -0.64 1.20 3.38 -1.83 -1.00 115.31 121.33 3juw h LEU 141 Ca 0.19 0.07 0.10 0.00 0.09 0.00 0.00 57.88 58.34 3juw h LEU 141 Cb 0.71 0.25 -0.08 0.00 0.09 0.00 0.00 40.66 41.62 3juw h LEU 141 CO 1.11 -0.33 0.23 -0.65 0.09 0.00 0.00 178.44 178.89 3juw h PRO 142 N -0.45 0.38 -0.53 1.13 0.11 -1.98 -1.07 132.00 129.59 3juw h PRO 142 Ca 0.02 -0.02 -0.08 0.00 0.11 0.00 0.00 66.00 66.03 3juw h PRO 142 Cb 0.46 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 31.46 3juw h PRO 142 CO -0.12 0.25 0.00 1.03 -0.21 0.00 0.00 178.00 178.96 3juw h SER 143 N 0.40 0.88 0.12 -2.05 0.87 -1.89 -1.02 113.55 110.85 3juw h SER 143 Ca 0.33 -0.23 -0.06 0.00 -1.23 0.00 0.00 61.79 60.60 3juw h SER 143 Cb 0.43 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 62.15 3juw h SER 143 CO -0.34 0.94 -0.21 -0.07 -0.53 0.00 0.00 176.83 176.62 3juw h LEU 144 N 0.84 0.17 -0.07 2.23 3.38 -0.07 -0.71 115.31 121.07 3juw h LEU 144 Ca 0.16 -0.04 -0.12 0.00 0.09 0.00 0.00 57.88 57.96 3juw h LEU 144 Cb 0.49 -0.05 0.01 0.00 0.09 0.00 0.00 40.66 41.20 3juw h LEU 144 CO 0.02 0.40 -0.43 0.03 0.09 0.00 0.00 178.44 178.56 3juw h ARG 145 N 0.17 0.42 -0.26 1.13 3.08 -0.28 -0.58 114.38 118.06 3juw h ARG 145 Ca 0.03 -0.35 0.05 0.00 0.07 0.00 0.00 59.98 59.77 3juw h ARG 145 Cb 0.48 0.08 -0.04 0.00 0.08 0.00 0.00 29.97 30.56 3juw h ARG 145 CO 0.03 1.00 -0.01 1.25 -1.07 0.00 0.00 179.97 181.17 3juw h LEU 146 N -0.05 -0.12 -0.67 3.04 5.85 -1.10 -0.35 115.31 121.92 3juw h LEU 146 Ca -0.03 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.75 3juw h LEU 146 Cb 1.09 0.11 -0.03 0.00 0.37 0.00 0.00 40.66 42.20 3juw h LEU 146 CO 0.09 -0.03 0.43 0.00 -0.34 0.00 0.00 178.44 178.59 3juw h ALA 147 N 1.23 0.84 -0.62 1.25 0.00 -0.86 -0.62 119.26 120.49 3juw h ALA 147 Ca 0.12 -0.06 0.06 0.00 0.00 0.00 0.00 54.91 55.04 3juw h ALA 147 Cb 0.16 -0.27 -0.06 0.00 0.00 0.00 0.00 17.79 17.63 3juw h ALA 147 CO -0.21 0.28 0.32 0.93 0.00 0.00 0.00 179.25 180.57 3juw h GLU 148 N 0.90 0.57 0.00 0.00 5.08 -0.39 -0.68 114.58 120.07 3juw h GLU 148 Ca 0.24 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.54 3juw h GLU 148 Cb -0.08 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.03 3juw h GLU 148 CO -0.05 0.38 -0.14 -0.09 -1.00 0.00 0.00 179.01 178.11 3juw h ARG 149 N 0.59 0.00 -0.00 2.33 1.12 0.18 -1.71 114.38 116.89 3juw h ARG 149 Ca 0.28 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 59.15 3juw h ARG 149 Cb 0.21 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.17 3juw h ARG 149 CO -0.20 0.14 -0.08 1.28 -3.11 0.00 0.00 179.97 178.00 3juw n LEU 150 N -4.23 0.49 0.00 3.80 4.77 -0.36 -4.91 117.00 116.56 3juw n LEU 150 Ca -0.02 -0.04 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 3juw n LEU 150 Cb 0.21 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 3juw n LEU 150 CO 0.35 0.09 0.00 0.61 -1.33 0.00 0.00 177.39 177.10 3juw n GLY 151 N 1.23 0.92 3.84 -0.72 0.00 -0.64 -5.07 105.19 104.74 3juw n GLY 151 Ca 0.16 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.82 3juw n GLY 151 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3juw s PHE 152 N -2.00 3.65 0.01 1.61 0.08 -0.31 -4.47 117.98 116.56 3juw s PHE 152 Ca 0.00 1.07 0.03 0.00 0.12 0.00 0.00 56.93 58.16 3juw s PHE 152 Cb 0.00 -2.37 -0.01 0.00 -0.57 0.00 0.00 43.02 40.07 3juw s PHE 152 CO 0.00 0.49 -0.11 1.03 -0.10 0.00 0.00 175.22 176.53 3juw s ARG 153 N -1.70 0.79 0.24 0.44 1.81 -0.32 -3.87 118.95 116.34 3juw s ARG 153 Ca 0.34 -0.52 -0.30 0.00 -1.72 0.00 0.00 55.73 53.54 3juw s ARG 153 Cb -0.16 -0.75 -0.09 0.00 -0.45 0.00 0.00 34.95 33.50 3juw s ARG 153 CO 0.18 0.19 1.09 0.20 -0.68 0.00 0.00 175.30 176.29 3juw s GLY 154 N -0.66 2.98 0.00 -3.53 0.00 -1.26 -0.62 107.32 104.23 3juw s GLY 154 Ca 0.01 0.86 0.00 0.00 0.00 0.00 0.00 44.72 45.59 3juw s GLY 154 CO 0.00 1.55 0.10 1.58 0.00 0.00 0.00 173.10 176.33 3juw n TYR 155 N 1.64 0.00 -3.49 1.90 0.18 -0.65 -4.94 117.16 111.80 3juw n TYR 155 Ca 0.00 0.00 -0.10 0.00 1.88 0.00 0.00 57.90 59.68 3juw n TYR 155 Cb 0.45 0.00 -0.03 0.00 -0.38 0.00 0.00 39.34 39.39 3juw n TYR 155 CO 0.00 0.00 0.00 0.45 -2.08 0.00 0.00 176.86 175.23 3juw s SER 156 N -0.16 -0.44 0.12 9.48 0.15 -1.20 -5.01 113.70 116.64 3juw s SER 156 Ca 0.00 0.08 0.09 0.00 0.70 0.00 0.00 55.95 56.83 3juw s SER 156 Cb 0.00 0.45 -0.04 0.00 -1.71 0.00 0.00 66.02 64.72 3juw s SER 156 CO 0.00 -0.69 -0.23 1.51 1.20 0.00 0.00 173.24 175.03 3juw s ASP 157 N -2.35 2.86 0.05 5.45 -4.77 -1.26 -0.20 116.67 116.45 3juw s ASP 157 Ca 0.02 -0.72 -0.05 0.00 -3.30 0.00 0.00 52.55 48.50 3juw s ASP 157 Cb -0.01 -0.17 -0.01 0.00 -1.09 0.00 0.00 42.92 41.63 3juw s ASP 157 CO -0.08 0.10 0.09 0.68 0.70 0.00 0.00 175.17 176.67 3juw s VAL 158 N -1.16 0.15 -0.11 2.11 -7.23 0.43 -4.93 120.40 109.67 3juw s VAL 158 Ca 0.10 -1.24 -0.20 0.00 -1.81 0.00 0.00 61.98 58.83 3juw s VAL 158 Cb -0.10 -1.10 -0.04 0.00 0.56 0.00 0.00 36.38 35.70 3juw s VAL 158 CO 0.05 -0.69 0.54 0.00 -0.31 0.00 0.00 175.10 174.69 3juw s ALA 159 N -3.12 3.44 -0.10 1.32 0.00 -1.26 -0.14 121.76 121.90 3juw s ALA 159 Ca -0.01 -0.10 -0.07 0.00 0.00 0.00 0.00 51.96 51.78 3juw s ALA 159 Cb 0.02 -2.73 0.04 0.00 0.00 0.00 0.00 23.12 20.44 3juw s ALA 159 CO -0.07 -0.03 0.25 0.12 0.00 0.00 0.00 175.76 176.03 3juw s PHE 160 N 0.69 -0.31 -1.26 0.00 5.36 -0.50 -4.92 117.98 117.04 3juw s PHE 160 Ca 0.29 0.74 -0.06 0.00 -0.96 0.00 0.00 56.93 56.95 3juw s PHE 160 Cb -0.16 0.08 0.01 0.00 -0.34 0.00 0.00 43.02 42.61 3juw s PHE 160 CO 0.12 -0.18 1.08 -3.47 -1.46 0.00 0.00 175.22 171.31 3juw n ASP 161 N 3.56 -4.71 0.00 6.13 -0.08 -1.26 -1.61 116.55 118.58 3juw n ASP 161 Ca -0.19 -0.55 0.00 0.00 -1.51 0.00 0.00 54.79 52.54 3juw n ASP 161 Cb 0.56 -4.92 0.00 0.00 2.34 0.00 0.00 41.12 39.10 3juw n ASP 161 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 3juw n GLY 162 N -1.66 0.70 3.19 0.27 0.00 -1.26 -4.99 105.19 101.43 3juw n GLY 162 Ca -0.10 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.82 3juw n GLY 162 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3juw s ALA 163 N -3.03 -0.39 0.28 4.61 0.00 -0.63 -5.13 121.76 117.47 3juw s ALA 163 Ca 0.00 -0.27 -0.29 0.00 0.00 0.00 0.00 51.96 51.40 3juw s ALA 163 Cb 0.00 0.30 -0.10 0.00 0.00 0.00 0.00 23.12 23.32 3juw s ALA 163 CO 0.00 -0.38 1.23 0.00 0.00 0.00 0.00 175.76 176.61 3juw s ALA 164 N -2.66 3.47 0.03 0.00 0.00 -1.26 -1.41 121.76 119.93 3juw s ALA 164 Ca -0.04 1.08 0.02 0.00 0.00 0.00 0.00 51.96 53.02 3juw s ALA 164 Cb -0.01 -3.42 -0.02 0.00 0.00 0.00 0.00 23.12 19.67 3juw s ALA 164 CO -0.04 -0.44 -0.07 -1.01 0.00 0.00 0.00 175.76 174.20 3juw s HIS 165 N -0.82 0.60 -0.04 0.00 4.02 0.80 -1.77 115.29 118.09 3juw s HIS 165 Ca 0.49 -0.39 -0.05 0.00 1.02 0.00 0.00 55.06 56.13 3juw s HIS 165 Cb -0.36 -0.37 -0.04 0.00 -1.02 0.00 0.00 32.58 30.79 3juw s HIS 165 CO 0.45 -0.07 0.18 -0.51 1.02 0.00 0.00 174.74 175.81 3juw s LEU 166 N -1.20 4.38 -0.19 0.89 1.02 0.57 -0.43 118.68 123.72 3juw s LEU 166 Ca -0.07 0.42 -0.14 0.00 0.02 0.00 0.00 54.13 54.36 3juw s LEU 166 Cb -0.08 -2.45 -0.04 0.00 0.02 0.00 0.00 46.19 43.63 3juw s LEU 166 CO 0.00 0.31 0.33 -0.76 0.02 0.00 0.00 176.35 176.25 3juw s LEU 167 N -1.62 4.18 0.23 1.79 1.43 0.71 -2.14 118.68 123.27 3juw s LEU 167 Ca 0.23 0.46 0.11 0.00 -1.03 0.00 0.00 54.13 53.91 3juw s LEU 167 Cb -0.13 -2.41 -0.05 0.00 0.03 0.00 0.00 46.19 43.64 3juw s LEU 167 CO 0.14 0.01 -0.17 -0.76 0.23 0.00 0.00 176.35 175.79 3juw s LEU 168 N 0.96 2.67 0.03 1.79 1.02 -0.39 -1.64 118.68 123.12 3juw s LEU 168 Ca 0.17 -0.86 -0.02 0.00 0.02 0.00 0.00 54.13 53.44 3juw s LEU 168 Cb -0.14 -1.28 -0.02 0.00 0.02 0.00 0.00 46.19 44.77 3juw s LEU 168 CO 0.06 0.07 0.01 -1.83 0.02 0.00 0.00 176.35 174.68 3juw s GLU 169 N -3.15 0.42 -0.08 1.70 -1.05 0.21 -1.60 118.70 115.16 3juw s GLU 169 Ca 0.26 -0.70 0.02 0.00 -0.15 0.00 0.00 54.97 54.40 3juw s GLU 169 Cb -0.07 0.16 0.02 0.00 -0.44 0.00 0.00 34.13 33.80 3juw s GLU 169 CO 0.14 -0.08 -0.11 0.50 0.95 0.00 0.00 175.26 176.65 3juw s ARG 170 N -2.02 1.66 0.00 -4.83 3.52 0.14 -1.17 118.95 116.25 3juw s ARG 170 Ca -0.10 -0.38 0.00 0.00 -0.13 0.00 0.00 55.73 55.12 3juw s ARG 170 Cb -0.05 -1.44 0.00 0.00 -1.56 0.00 0.00 34.95 31.90 3juw s ARG 170 CO -0.03 -0.04 0.00 0.00 -0.81 0.00 0.00 175.30 174.43