#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cmb s PHE 2 N 0.00 3.08 -0.03 1.61 5.36 -1.26 -5.30 117.98 121.44 3cmb s PHE 2 Ca 0.00 -0.14 0.01 0.00 -0.96 0.00 0.00 56.93 55.85 3cmb s PHE 2 Cb 0.00 -1.94 0.02 0.00 -0.34 0.00 0.00 43.02 40.76 3cmb s PHE 2 CO 0.00 0.10 -0.05 -0.98 -1.46 0.00 0.00 175.22 172.83 3cmb s ARG 3 N 0.11 0.72 0.85 10.12 1.04 -1.26 -5.13 118.95 125.39 3cmb s ARG 3 Ca 0.01 -0.12 -0.10 0.00 -1.04 0.00 0.00 55.73 54.48 3cmb s ARG 3 Cb -0.13 -0.73 0.11 0.00 -2.04 0.00 0.00 34.95 32.15 3cmb s ARG 3 CO 0.02 -0.04 1.12 -2.14 -0.04 0.00 0.00 175.30 174.23 3cmb s PRO 4 N 0.69 1.57 0.08 3.89 0.02 -1.26 -5.02 135.00 134.97 3cmb s PRO 4 Ca -0.09 1.39 -0.07 0.00 0.02 0.00 0.00 61.00 62.26 3cmb s PRO 4 Cb -0.12 -1.80 -0.05 0.00 0.02 0.00 0.00 34.50 32.54 3cmb s PRO 4 CO 0.00 -2.19 0.34 -0.65 -0.33 0.00 0.00 177.00 174.17 3cmb s GLN 5 N -4.74 3.64 0.41 5.54 1.11 -1.26 -4.98 119.66 119.39 3cmb s GLN 5 Ca 0.65 -0.02 0.21 0.00 0.01 0.00 0.00 55.36 56.21 3cmb s GLN 5 Cb -0.20 -2.98 0.82 0.00 -1.01 0.00 0.00 33.01 29.64 3cmb s GLN 5 CO 0.57 0.56 1.79 -0.44 0.01 0.00 0.00 175.29 177.78 3cmb h ASP 6 N 3.48 0.00 0.66 5.90 3.32 -2.03 -2.62 116.42 125.13 3cmb h ASP 6 Ca -0.48 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.57 3cmb h ASP 6 Cb 1.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.73 3cmb h ASP 6 CO 0.69 0.29 0.00 0.47 -1.72 0.00 0.00 179.24 178.97 3cmb n ASP 7 N -3.48 0.36 -4.54 6.45 10.43 -1.26 -4.93 116.55 119.58 3cmb n ASP 7 Ca -0.00 0.59 -0.29 0.00 2.57 0.00 0.00 54.79 57.65 3cmb n ASP 7 Cb 0.46 -0.66 -0.10 0.00 1.84 0.00 0.00 41.12 42.65 3cmb n ASP 7 CO 0.00 0.00 0.00 -0.36 -1.07 0.00 0.00 177.20 175.77 3cmb s PHE 8 N -3.16 2.65 -0.11 1.24 0.40 -0.99 -0.96 117.98 117.05 3cmb s PHE 8 Ca 0.06 -0.20 -0.05 0.00 -0.60 0.00 0.00 56.93 56.13 3cmb s PHE 8 Cb 0.10 -1.39 -0.04 0.00 0.51 0.00 0.00 43.02 42.20 3cmb s PHE 8 CO 0.35 0.41 0.09 0.95 0.70 0.00 0.00 175.22 177.72 3cmb s THR 9 N -1.20 5.08 0.03 0.64 -4.23 -0.01 -4.82 115.64 111.13 3cmb s THR 9 Ca 0.20 0.05 -0.05 0.00 -1.18 0.00 0.00 61.69 60.71 3cmb s THR 9 Cb -0.11 -3.19 -0.01 0.00 1.34 0.00 0.00 72.50 70.53 3cmb s THR 9 CO 0.12 0.61 0.07 -0.31 -0.54 0.00 0.00 174.62 174.58 3cmb s TYR 10 N -0.93 0.22 0.00 3.99 2.02 -1.26 -1.56 117.35 119.83 3cmb s TYR 10 Ca 0.14 -0.52 0.00 0.00 -0.37 0.00 0.00 57.07 56.32 3cmb s TYR 10 Cb -0.12 -0.16 0.00 0.00 -0.40 0.00 0.00 41.96 41.28 3cmb s TYR 10 CO 0.03 -0.34 0.00 1.28 -1.57 0.00 0.00 175.55 174.95 3cmb n LEU 11 N 0.87 0.00 -4.72 -1.29 4.77 -1.26 -5.07 117.00 110.30 3cmb n LEU 11 Ca -0.19 0.00 -0.63 0.00 -0.03 0.00 0.00 56.01 55.16 3cmb n LEU 11 Cb 0.58 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.58 3cmb n LEU 11 CO 0.23 0.00 1.19 -0.81 -1.33 0.00 0.00 177.39 176.67 3cmb n PRO 13 N 0.00 0.54 0.21 3.23 -0.04 -1.26 -4.84 135.00 132.84 3cmb n PRO 13 Ca 0.00 0.20 0.05 0.00 -0.04 0.00 0.00 63.50 63.70 3cmb n PRO 13 Cb 0.00 -1.78 0.46 0.00 -0.04 0.00 0.00 33.50 32.14 3cmb n PRO 13 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 3cmb h VAL 14 N 4.96 1.13 0.00 0.52 2.07 -1.98 -3.08 116.25 119.87 3cmb h VAL 14 Ca -0.45 -0.87 0.00 0.00 0.82 0.00 0.00 66.70 66.19 3cmb h VAL 14 Cb 1.35 1.48 0.00 0.00 -1.52 0.00 0.00 31.29 32.60 3cmb h VAL 14 CO 0.95 0.25 0.00 0.00 0.02 0.00 0.00 177.57 178.79 3cmb n HIS 15 N -4.17 0.00 0.77 1.57 1.44 -1.26 -1.08 115.22 112.49 3cmb n HIS 15 Ca -0.02 0.00 0.12 0.00 -2.01 0.00 0.00 57.72 55.81 3cmb n HIS 15 Cb 0.31 -0.17 0.26 0.00 0.12 0.00 0.00 29.99 30.51 3cmb n HIS 15 CO 0.00 0.00 0.00 1.19 -2.81 0.00 0.00 176.34 174.72 3cmb n PHE 16 N -1.17 0.30 0.00 -1.40 3.72 -1.16 -5.04 117.46 112.71 3cmb n PHE 16 Ca 0.18 -0.15 0.00 0.00 -0.05 0.00 0.00 57.45 57.43 3cmb n PHE 16 Cb 0.18 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.72 3cmb n PHE 16 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3cmb n GLY 17 N 1.35 -2.98 0.00 1.37 0.00 -0.24 -5.13 105.19 99.56 3cmb n GLY 17 Ca 0.18 -2.14 0.00 0.00 0.00 0.00 0.00 46.02 44.05 3cmb n GLY 17 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cmb n GLY 18 N -0.12 4.07 2.94 -0.02 0.00 -1.26 -4.80 105.19 105.99 3cmb n GLY 18 Ca 0.00 -0.91 -0.10 0.00 0.00 0.00 0.00 46.02 45.00 3cmb n GLY 18 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3cmb s GLY 19 N 0.00 0.14 0.23 -0.02 0.00 -0.60 -4.98 107.32 102.09 3cmb s GLY 19 Ca 0.00 -0.34 -0.32 0.00 0.00 0.00 0.00 44.72 44.07 3cmb s GLY 19 CO 0.00 -0.38 1.55 1.17 0.00 0.00 0.00 173.10 175.44 3cmb n LYS 20 N 2.21 2.37 -1.74 2.90 3.00 -1.26 -0.83 118.16 124.81 3cmb n LYS 20 Ca -0.19 0.85 -0.42 0.00 -0.00 0.00 0.00 58.31 58.55 3cmb n LYS 20 Cb 0.57 -2.60 -0.01 0.00 0.00 0.00 0.00 35.03 32.99 3cmb n LYS 20 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.40 177.74 3cmb n PHE 21 N 2.69 2.77 -3.74 5.64 7.35 -0.13 -4.80 117.46 127.23 3cmb n PHE 21 Ca 0.13 0.34 -0.23 0.00 -0.76 0.00 0.00 57.45 56.93 3cmb n PHE 21 Cb 0.33 -2.56 -0.18 0.00 0.35 0.00 0.00 39.48 37.43 3cmb n PHE 21 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 3cmb s ASP 22 N 0.28 1.63 0.39 -2.13 -1.08 -1.26 -5.02 116.67 109.49 3cmb s ASP 22 Ca 0.61 -0.13 0.28 0.00 -0.52 0.00 0.00 52.55 52.79 3cmb s ASP 22 Cb -0.51 -0.39 1.35 0.00 -1.46 0.00 0.00 42.92 41.91 3cmb s ASP 22 CO 0.53 -0.22 1.84 1.55 0.52 0.00 0.00 175.17 179.39 3cmb h PRO 23 N 8.35 0.00 -0.52 4.34 0.13 -2.03 -1.86 132.00 140.40 3cmb h PRO 23 Ca -0.18 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.85 3cmb h PRO 23 Cb 1.12 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.19 3cmb h PRO 23 CO 0.25 0.00 0.10 0.39 -0.23 0.00 0.00 178.00 178.51 3cmb n GLU 24 N -2.51 3.52 -1.69 0.86 -0.58 -1.26 -4.71 120.64 114.28 3cmb n GLU 24 Ca -0.00 -3.05 -0.44 0.00 -0.42 0.00 0.00 57.16 53.25 3cmb n GLU 24 Cb 0.14 -2.07 -0.03 0.00 -0.57 0.00 0.00 31.44 28.90 3cmb n GLU 24 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06 3cmb n THR 25 N -0.22 0.31 -4.21 2.62 -1.04 -0.70 -4.94 114.28 106.09 3cmb n THR 25 Ca 0.32 -0.06 -0.29 0.00 -2.04 0.00 0.00 64.05 61.98 3cmb n THR 25 Cb 1.17 -1.98 -0.09 0.00 -1.82 0.00 0.00 70.33 67.60 3cmb n THR 25 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 3cmb s LEU 26 N 2.51 3.15 -0.19 -4.42 1.43 -1.26 -1.25 118.68 118.65 3cmb s LEU 26 Ca 0.82 -0.39 -0.07 0.00 -1.03 0.00 0.00 54.13 53.47 3cmb s LEU 26 Cb -0.54 -1.89 -0.04 0.00 0.03 0.00 0.00 46.19 43.75 3cmb s LEU 26 CO 0.39 0.15 0.05 -0.69 0.23 0.00 0.00 176.35 176.47 3cmb s VAL 27 N -1.41 4.53 -0.04 -1.59 1.01 0.05 -4.83 120.40 118.11 3cmb s VAL 27 Ca 0.24 -0.12 0.02 0.00 0.00 0.00 0.00 61.98 62.11 3cmb s VAL 27 Cb -0.10 -3.05 0.01 0.00 0.00 0.00 0.00 36.38 33.24 3cmb s VAL 27 CO 0.16 0.44 -0.07 0.42 0.00 0.00 0.00 175.10 176.04 3cmb s THR 28 N 0.63 0.71 -0.07 3.92 -4.23 -1.26 -0.13 115.64 115.22 3cmb s THR 28 Ca 0.02 -0.26 -0.30 0.00 -1.18 0.00 0.00 61.69 59.97 3cmb s THR 28 Cb -0.13 -0.68 0.09 0.00 1.34 0.00 0.00 72.50 73.11 3cmb s THR 28 CO 0.02 0.25 0.79 0.00 -0.54 0.00 0.00 174.62 175.14 3cmb s GLN 29 N 0.64 0.90 0.50 3.99 -2.07 -1.01 -1.65 119.66 120.95 3cmb s GLN 29 Ca -0.10 0.14 -0.19 0.00 -1.82 0.00 0.00 55.36 53.39 3cmb s GLN 29 Cb -0.13 0.42 -0.08 0.00 -1.09 0.00 0.00 33.01 32.13 3cmb s GLN 29 CO 0.01 -0.30 1.01 0.15 -1.32 0.00 0.00 175.29 174.84 3cmb s LYS 30 N -1.45 3.86 -0.09 9.60 1.02 0.33 -0.86 119.74 132.15 3cmb s LYS 30 Ca -0.06 1.17 -0.07 0.00 0.02 0.00 0.00 55.97 57.03 3cmb s LYS 30 Cb -0.00 -2.12 0.03 0.00 -0.52 0.00 0.00 37.83 35.22 3cmb s LYS 30 CO 0.04 -0.36 0.23 0.00 -0.92 0.00 0.00 175.35 174.34 3cmb s ALA 31 N -2.27 -0.55 -0.05 5.17 0.00 -0.47 -1.38 121.76 122.21 3cmb s ALA 31 Ca 0.63 0.70 0.06 0.00 0.00 0.00 0.00 51.96 53.35 3cmb s ALA 31 Cb -0.13 -0.42 -0.02 0.00 0.00 0.00 0.00 23.12 22.56 3cmb s ALA 31 CO 0.24 -0.12 -0.22 0.99 0.00 0.00 0.00 175.76 176.64 3cmb s THR 32 N 0.34 2.34 -0.01 0.00 2.01 -0.27 -1.22 115.64 118.83 3cmb s THR 32 Ca -0.02 -0.98 0.02 0.00 0.31 0.00 0.00 61.69 61.02 3cmb s THR 32 Cb -0.03 -1.86 -0.00 0.00 0.01 0.00 0.00 72.50 70.61 3cmb s THR 32 CO -0.01 0.58 -0.07 0.00 -0.69 0.00 0.00 174.62 174.42 3cmb s ALA 33 N -0.42 0.58 -0.37 7.40 0.00 0.00 -1.01 121.76 127.94 3cmb s ALA 33 Ca 0.04 -0.29 -0.04 0.00 0.00 0.00 0.00 51.96 51.67 3cmb s ALA 33 Cb -0.12 -0.15 0.08 0.00 0.00 0.00 0.00 23.12 22.93 3cmb s ALA 33 CO 0.01 0.14 0.15 -1.17 0.00 0.00 0.00 175.76 174.89 3cmb s LEU 34 N -0.14 4.77 -0.23 0.00 2.96 0.86 -0.68 118.68 126.24 3cmb s LEU 34 Ca 0.02 -1.63 -0.05 0.00 -0.22 0.00 0.00 54.13 52.26 3cmb s LEU 34 Cb -0.03 -1.83 -0.02 0.00 0.50 0.00 0.00 46.19 44.81 3cmb s LEU 34 CO -0.00 -0.44 -0.01 -0.55 -1.32 0.00 0.00 176.35 174.02 3cmb s SER 35 N 1.69 4.56 0.21 3.68 0.15 0.17 -0.75 113.70 123.40 3cmb s SER 35 Ca 0.03 -0.33 0.11 0.00 0.70 0.00 0.00 55.95 56.46 3cmb s SER 35 Cb -0.22 -1.79 -0.05 0.00 -1.71 0.00 0.00 66.02 62.25 3cmb s SER 35 CO -0.01 -0.02 -0.23 -0.76 1.20 0.00 0.00 173.24 173.42 3cmb s LEU 36 N 1.47 2.47 0.00 3.45 1.43 -0.19 -1.45 118.68 125.85 3cmb s LEU 36 Ca 0.05 -0.89 0.00 0.00 -1.03 0.00 0.00 54.13 52.27 3cmb s LEU 36 Cb -0.14 -1.16 -0.00 0.00 0.03 0.00 0.00 46.19 44.91 3cmb s LEU 36 CO -0.01 0.11 -0.01 -0.94 0.23 0.00 0.00 176.35 175.73 3cmb s SER 37 N -2.81 0.09 0.04 2.29 1.04 -0.55 -0.25 113.70 113.56 3cmb s SER 37 Ca 0.22 -0.03 0.02 0.00 0.48 0.00 0.00 55.95 56.65 3cmb s SER 37 Cb -0.07 -0.01 -0.02 0.00 0.10 0.00 0.00 66.02 66.01 3cmb s SER 37 CO 0.11 0.00 -0.08 0.72 0.98 0.00 0.00 173.24 174.97 3cmb s PHE 38 N -0.06 0.70 -0.01 5.02 -0.12 -0.29 -0.29 117.98 122.93 3cmb s PHE 38 Ca -0.00 -0.49 -0.17 0.00 -0.05 0.00 0.00 56.93 56.22 3cmb s PHE 38 Cb -0.01 -0.42 -0.06 0.00 -0.63 0.00 0.00 43.02 41.91 3cmb s PHE 38 CO -0.00 -0.07 0.47 -2.00 -0.05 0.00 0.00 175.22 173.57 3cmb s GLU 39 N -1.57 4.10 0.00 1.99 2.12 0.07 -1.09 118.70 124.32 3cmb s GLU 39 Ca -0.09 0.52 0.00 0.00 0.36 0.00 0.00 54.97 55.76 3cmb s GLU 39 Cb -0.10 -3.28 0.00 0.00 0.26 0.00 0.00 34.13 31.01 3cmb s GLU 39 CO 0.01 0.55 0.00 -2.37 -0.54 0.00 0.00 175.26 172.90 3cmb n THR 40 N 2.24 0.00 -3.55 -1.70 5.66 -0.36 -0.25 114.28 116.32 3cmb n THR 40 Ca -0.11 0.00 -0.39 0.00 -3.05 0.00 0.00 64.05 60.50 3cmb n THR 40 Cb 0.52 0.00 -0.11 0.00 -1.55 0.00 0.00 70.33 69.19 3cmb n THR 40 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 175.07 170.41 3cmb s GLU 41 N 1.30 3.84 0.16 1.09 2.02 -1.26 -4.82 118.70 121.04 3cmb s GLU 41 Ca 0.00 -0.37 -0.16 0.00 0.02 0.00 0.00 54.97 54.46 3cmb s GLU 41 Cb 0.00 -3.70 0.09 0.00 0.10 0.00 0.00 34.13 30.63 3cmb s GLU 41 CO 0.00 -0.26 1.71 -0.09 0.02 0.00 0.00 175.26 176.65 3cmb h ARG 42 N 8.38 0.14 0.00 1.61 2.43 -1.97 -1.86 114.38 123.12 3cmb h ARG 42 Ca -0.34 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.82 3cmb h ARG 42 Cb 1.18 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.70 3cmb h ARG 42 CO 0.58 0.10 0.00 -0.44 -1.51 0.00 0.00 179.97 178.70 3cmb h ASP 43 N 0.15 0.00 0.21 -3.80 5.19 -2.00 -0.63 116.42 115.54 3cmb h ASP 43 Ca 0.18 0.00 -0.35 0.00 -0.62 0.00 0.00 57.03 56.24 3cmb h ASP 43 Cb 0.24 0.00 0.01 0.00 0.18 0.00 0.00 39.33 39.75 3cmb h ASP 43 CO -0.27 0.00 -1.76 -0.07 -3.12 0.00 0.00 179.24 174.02 3cmb h LEU 44 N 0.00 0.58 -0.44 1.55 3.38 -1.79 -3.33 115.31 115.26 3cmb h LEU 44 Ca 0.00 -0.90 -0.14 0.00 0.09 0.00 0.00 57.88 56.93 3cmb h LEU 44 Cb 0.51 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 3cmb h LEU 44 CO 0.00 1.76 -0.27 0.25 0.09 0.00 0.00 178.44 180.27 3cmb h LEU 45 N 0.10 1.00 -2.35 1.67 5.85 -0.71 -2.87 115.31 118.00 3cmb h LEU 45 Ca -0.34 -0.42 -0.01 0.00 0.84 0.00 0.00 57.88 57.95 3cmb h LEU 45 Cb 2.09 -0.28 -0.00 0.00 0.37 0.00 0.00 40.66 42.84 3cmb h LEU 45 CO 0.17 1.20 -0.04 -0.33 -0.34 0.00 0.00 178.44 179.10 3cmb h GLU 46 N 0.79 0.00 0.00 1.25 5.08 -1.27 0.52 114.58 120.95 3cmb h GLU 46 Ca 0.09 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 3cmb h GLU 46 Cb 0.86 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.11 3cmb h GLU 46 CO 0.08 0.04 0.06 -0.91 -1.00 0.00 0.00 179.01 177.27 3cmb h ASN 47 N 0.00 0.00 -0.11 1.42 2.35 -1.62 -2.19 115.58 115.43 3cmb h ASN 47 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3cmb h ASN 47 Cb 0.13 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.50 3cmb h ASN 47 CO 0.01 0.00 0.00 -1.22 -1.65 0.00 0.00 177.43 174.57 3cmb n TYR 48 N -2.74 0.14 -3.89 1.19 4.01 0.17 -4.93 117.16 111.10 3cmb n TYR 48 Ca -0.02 -0.17 -0.36 0.00 -0.16 0.00 0.00 57.90 57.19 3cmb n TYR 48 Cb 0.11 -0.01 -0.12 0.00 -0.31 0.00 0.00 39.34 39.01 3cmb n TYR 48 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 3cmb s ILE 49 N -0.88 4.29 0.52 -0.72 -1.09 -0.83 -5.02 121.20 117.46 3cmb s ILE 49 Ca 0.15 -0.19 -0.23 0.00 -2.23 0.00 0.00 60.65 58.15 3cmb s ILE 49 Cb 0.09 -2.98 -0.06 0.00 -1.58 0.00 0.00 42.46 37.94 3cmb s ILE 49 CO 0.13 0.38 1.37 -2.84 -1.23 0.00 0.00 174.94 172.75 3cmb s PRO 50 N 1.25 3.31 0.24 2.79 0.02 -1.26 -4.94 135.00 136.40 3cmb s PRO 50 Ca 0.04 2.26 -0.31 0.00 0.02 0.00 0.00 61.00 63.02 3cmb s PRO 50 Cb -0.15 -2.37 -0.14 0.00 0.02 0.00 0.00 34.50 31.87 3cmb s PRO 50 CO 0.03 -1.07 1.25 0.39 -0.33 0.00 0.00 177.00 177.27 3cmb n GLU 51 N -0.79 1.66 0.00 5.54 1.02 -1.26 -1.98 120.64 124.83 3cmb n GLU 51 Ca 0.09 0.59 0.00 0.00 -0.02 0.00 0.00 57.16 57.82 3cmb n GLU 51 Cb 0.44 -2.14 0.00 0.00 -0.02 0.00 0.00 31.44 29.72 3cmb n GLU 51 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3cmb n GLY 52 N 1.82 2.21 3.52 0.62 0.00 -1.26 -5.07 105.19 107.03 3cmb n GLY 52 Ca 0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.81 3cmb n GLY 52 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3cmb s PHE 53 N -2.33 2.75 -0.21 1.61 0.08 -0.84 -1.98 117.98 117.06 3cmb s PHE 53 Ca 0.00 -0.12 -0.06 0.00 0.12 0.00 0.00 56.93 56.87 3cmb s PHE 53 Cb 0.00 -1.60 -0.03 0.00 -0.57 0.00 0.00 43.02 40.82 3cmb s PHE 53 CO 0.00 0.26 0.02 -2.00 -0.10 0.00 0.00 175.22 173.41 3cmb s GLU 54 N -1.05 3.69 -0.20 0.44 2.12 -0.11 -4.90 118.70 118.70 3cmb s GLU 54 Ca 0.14 -0.48 -0.29 0.00 0.36 0.00 0.00 54.97 54.69 3cmb s GLU 54 Cb -0.11 -3.14 -0.02 0.00 0.26 0.00 0.00 34.13 31.12 3cmb s GLU 54 CO 0.03 0.03 1.43 -1.17 -0.54 0.00 0.00 175.26 175.04 3cmb s LEU 55 N 0.99 4.05 0.29 2.70 2.96 -1.26 -0.83 118.68 127.58 3cmb s LEU 55 Ca 0.02 1.63 0.13 0.00 -0.22 0.00 0.00 54.13 55.70 3cmb s LEU 55 Cb -0.14 -3.54 0.40 0.00 0.50 0.00 0.00 46.19 43.41 3cmb s LEU 55 CO 0.02 -1.01 1.61 -0.07 -1.32 0.00 0.00 176.35 175.59 3cmb h LEU 56 N 10.65 0.00 -7.00 -0.68 3.38 -1.03 -3.47 115.31 117.16 3cmb h LEU 56 Ca -0.30 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.62 3cmb h LEU 56 Cb 1.13 0.00 -0.18 0.00 0.09 0.00 0.00 40.66 41.69 3cmb h LEU 56 CO 0.99 0.56 0.22 0.00 0.09 0.00 0.00 178.44 180.30 3cmb s ALA 57 N -3.49 -1.76 -1.33 1.53 0.00 -1.26 -5.07 121.76 110.39 3cmb s ALA 57 Ca -0.00 1.22 -0.15 0.00 0.00 0.00 0.00 51.96 53.02 3cmb s ALA 57 Cb 0.12 0.08 -0.01 0.00 0.00 0.00 0.00 23.12 23.31 3cmb s ALA 57 CO 0.74 -0.43 2.23 -0.35 0.00 0.00 0.00 175.76 177.95 3cmb n PRO 58 N 0.71 2.64 -4.16 0.00 -0.04 -1.26 -4.70 135.00 128.19 3cmb n PRO 58 Ca -0.18 -2.40 -0.17 0.00 -0.04 0.00 0.00 63.50 60.71 3cmb n PRO 58 Cb 0.58 -3.16 -0.15 0.00 -0.04 0.00 0.00 33.50 30.73 3cmb n PRO 58 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 3cmb s GLU 59 N 3.47 0.55 -0.11 0.54 2.12 -1.26 -1.22 118.70 122.79 3cmb s GLU 59 Ca 0.51 -0.15 0.03 0.00 0.36 0.00 0.00 54.97 55.72 3cmb s GLU 59 Cb 0.14 -0.56 0.01 0.00 0.26 0.00 0.00 34.13 33.97 3cmb s GLU 59 CO -0.05 0.04 -0.21 0.08 -0.54 0.00 0.00 175.26 174.58 3cmb s VAL 60 N 0.28 1.89 -0.28 3.70 1.01 -0.25 -4.26 120.40 122.48 3cmb s VAL 60 Ca -0.03 -0.90 -0.13 0.00 0.00 0.00 0.00 61.98 60.91 3cmb s VAL 60 Cb -0.07 -1.65 -0.04 0.00 0.00 0.00 0.00 36.38 34.62 3cmb s VAL 60 CO -0.00 0.52 0.31 -1.10 0.00 0.00 0.00 175.10 174.82 3cmb s GLN 61 N 0.55 3.98 -0.16 2.72 -0.21 0.46 -1.14 119.66 125.87 3cmb s GLN 61 Ca -0.14 -0.10 0.00 0.00 0.02 0.00 0.00 55.36 55.14 3cmb s GLN 61 Cb -0.17 -3.66 0.03 0.00 1.00 0.00 0.00 33.01 30.21 3cmb s GLN 61 CO 0.05 -0.25 -0.13 0.08 -2.12 0.00 0.00 175.29 172.92 3cmb s VAL 62 N 1.96 1.58 -0.05 1.09 1.01 0.66 -1.18 120.40 125.47 3cmb s VAL 62 Ca 0.12 -0.70 -0.01 0.00 0.00 0.00 0.00 61.98 61.39 3cmb s VAL 62 Cb -0.16 -1.52 0.03 0.00 0.00 0.00 0.00 36.38 34.73 3cmb s VAL 62 CO 0.10 0.40 0.01 0.00 0.00 0.00 0.00 175.10 175.61 3cmb s ALA 63 N 1.47 0.48 -0.01 5.51 0.00 -0.34 -1.03 121.76 127.84 3cmb s ALA 63 Ca 0.04 0.04 -0.30 0.00 0.00 0.00 0.00 51.96 51.74 3cmb s ALA 63 Cb -0.13 -0.54 -0.03 0.00 0.00 0.00 0.00 23.12 22.41 3cmb s ALA 63 CO -0.10 -0.28 1.02 0.12 0.00 0.00 0.00 175.76 176.52 3cmb s PHE 64 N 1.57 3.59 -0.04 0.00 2.19 0.07 -0.67 117.98 124.68 3cmb s PHE 64 Ca -0.02 1.61 0.04 0.00 0.33 0.00 0.00 56.93 58.89 3cmb s PHE 64 Cb -0.13 -3.18 -0.00 0.00 -1.31 0.00 0.00 43.02 38.40 3cmb s PHE 64 CO -0.03 -0.27 -0.15 -0.80 1.83 0.00 0.00 175.22 175.80 3cmb s ASN 65 N 1.05 1.94 -0.12 6.13 0.01 0.10 -0.09 114.94 123.96 3cmb s ASN 65 Ca 0.52 -0.32 0.02 0.00 -0.71 0.00 0.00 52.86 52.37 3cmb s ASN 65 Cb -0.22 -0.57 -0.01 0.00 0.41 0.00 0.00 41.25 40.87 3cmb s ASN 65 CO 0.26 0.13 -0.18 -0.75 -1.51 0.00 0.00 177.10 175.05 3cmb s LYS 66 N 0.12 3.22 -0.13 -0.60 2.20 -0.18 -0.20 119.74 124.17 3cmb s LYS 66 Ca -0.05 -0.78 0.01 0.00 -0.36 0.00 0.00 55.97 54.80 3cmb s LYS 66 Cb -0.11 -2.49 -0.00 0.00 -1.51 0.00 0.00 37.83 33.71 3cmb s LYS 66 CO 0.02 0.17 -0.18 -0.06 -0.36 0.00 0.00 175.35 174.95 3cmb s PHE 67 N 0.41 2.72 0.23 4.03 0.08 -0.38 -1.12 117.98 123.95 3cmb s PHE 67 Ca -0.13 -0.93 0.04 0.00 0.12 0.00 0.00 56.93 56.03 3cmb s PHE 67 Cb -0.17 -1.81 -0.05 0.00 -0.57 0.00 0.00 43.02 40.42 3cmb s PHE 67 CO 0.06 -0.38 -0.02 0.95 -0.10 0.00 0.00 175.22 175.74 3cmb s THR 68 N 0.51 1.11 -1.50 0.64 -4.23 -0.48 -2.03 115.64 109.66 3cmb s THR 68 Ca -0.12 -2.04 -0.12 0.00 -1.18 0.00 0.00 61.69 58.23 3cmb s THR 68 Cb -0.16 -2.32 0.07 0.00 1.34 0.00 0.00 72.50 71.43 3cmb s THR 68 CO 0.05 -0.35 0.98 -0.62 -0.54 0.00 0.00 174.62 174.13 3cmb n GLU 69 N -0.42 -5.71 -2.24 3.99 1.02 -1.15 -0.51 120.64 115.63 3cmb n GLU 69 Ca -0.05 0.62 -0.43 0.00 -0.02 0.00 0.00 57.16 57.28 3cmb n GLU 69 Cb 0.64 -5.50 -0.02 0.00 -0.02 0.00 0.00 31.44 26.53 3cmb n GLU 69 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3cmb s ILE 70 N -3.34 3.97 0.10 -3.67 1.01 -0.62 -4.49 121.20 114.16 3cmb s ILE 70 Ca 0.59 1.17 -0.22 0.00 0.00 0.00 0.00 60.65 62.20 3cmb s ILE 70 Cb -0.29 -3.76 -0.12 0.00 0.01 0.00 0.00 42.46 38.30 3cmb s ILE 70 CO 0.82 -0.10 1.74 -0.55 0.00 0.00 0.00 174.94 176.84 3cmb h ASN 71 N 8.81 0.10 0.96 3.58 -1.07 -1.65 0.84 115.58 127.15 3cmb h ASN 71 Ca -0.32 -0.02 0.00 0.00 0.07 0.00 0.00 56.30 56.03 3cmb h ASN 71 Cb 1.14 -0.03 0.00 0.00 -2.07 0.00 0.00 38.32 37.36 3cmb h ASN 71 CO 0.96 0.09 0.00 -2.67 0.07 0.00 0.00 177.43 175.89 3cmb n TRP 72 N -5.02 0.63 -1.00 4.14 4.27 -1.26 -1.00 117.44 118.19 3cmb n TRP 72 Ca -0.05 0.22 0.04 0.00 -3.89 0.00 0.00 57.50 53.82 3cmb n TRP 72 Cb 0.04 -0.85 0.32 0.00 -1.36 0.00 0.00 31.31 29.46 3cmb n TRP 72 CO 0.00 0.00 0.00 1.28 -2.29 0.00 0.00 177.69 176.68 3cmb n LEU 73 N -2.04 5.04 -4.20 5.67 4.77 -0.95 -4.94 117.00 120.35 3cmb n LEU 73 Ca 0.04 -3.07 -0.30 0.00 -0.03 0.00 0.00 56.01 52.64 3cmb n LEU 73 Cb 0.30 -0.64 -0.09 0.00 -2.33 0.00 0.00 43.42 40.65 3cmb n LEU 73 CO 0.23 0.72 -0.40 1.41 -1.33 0.00 0.00 177.39 178.02 3cmb n HIS 74 N -0.06 -1.15 0.00 -1.77 8.25 -0.17 -1.39 115.22 118.93 3cmb n HIS 74 Ca 0.28 0.57 0.00 0.00 -0.26 0.00 0.00 57.72 58.32 3cmb n HIS 74 Cb 1.12 -2.45 0.00 0.00 1.12 0.00 0.00 29.99 29.78 3cmb n HIS 74 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3cmb n GLY 75 N -2.24 0.85 2.67 -1.41 0.00 0.24 -4.98 105.19 100.31 3cmb n GLY 75 Ca -0.24 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.57 3cmb n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cmb n GLY 76 N -1.80 -1.65 3.19 -0.02 0.00 -0.48 -4.08 105.19 100.34 3cmb n GLY 76 Ca 0.00 -1.66 -0.11 0.00 0.00 0.00 0.00 46.02 44.26 3cmb n GLY 76 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3cmb s GLN 77 N -4.99 0.69 0.26 1.61 -2.07 -1.26 -1.59 119.66 112.31 3cmb s GLN 77 Ca 0.53 -0.55 -0.18 0.00 -1.82 0.00 0.00 55.36 53.33 3cmb s GLN 77 Cb -0.02 0.29 0.01 0.00 -1.09 0.00 0.00 33.01 32.20 3cmb s GLN 77 CO 0.37 -0.20 0.63 1.52 -1.32 0.00 0.00 175.29 176.30 3cmb s TYR 78 N -2.34 -0.03 0.15 9.60 1.13 -0.86 -5.01 117.35 119.99 3cmb s TYR 78 Ca -0.07 -0.39 0.08 0.00 -1.41 0.00 0.00 57.07 55.28 3cmb s TYR 78 Cb -0.02 0.53 -0.04 0.00 -1.10 0.00 0.00 41.96 41.33 3cmb s TYR 78 CO -0.03 -1.13 -0.09 -0.80 -2.51 0.00 0.00 175.55 170.99 3cmb s ASN 79 N -2.94 4.33 0.07 -0.18 0.01 -1.26 -1.25 114.94 113.71 3cmb s ASN 79 Ca 0.14 -0.49 -0.11 0.00 -0.71 0.00 0.00 52.86 51.70 3cmb s ASN 79 Cb -0.04 -0.78 0.01 0.00 0.41 0.00 0.00 41.25 40.85 3cmb s ASN 79 CO 0.06 0.14 0.24 -1.48 -1.51 0.00 0.00 177.10 174.55 3cmb s LEU 80 N -2.56 1.17 -0.24 0.60 0.05 0.72 -2.28 118.68 116.15 3cmb s LEU 80 Ca 0.23 -0.43 0.02 0.00 0.05 0.00 0.00 54.13 54.00 3cmb s LEU 80 Cb -0.10 1.17 0.04 0.00 -2.05 0.00 0.00 46.19 45.26 3cmb s LEU 80 CO 0.15 -0.67 -0.12 -0.63 -0.55 0.00 0.00 176.35 174.52 3cmb s ILE 81 N -3.20 2.27 -0.21 1.48 -1.09 0.16 -0.72 121.20 119.89 3cmb s ILE 81 Ca -0.00 -1.35 -0.11 0.00 -2.23 0.00 0.00 60.65 56.96 3cmb s ILE 81 Cb 0.02 -2.21 -0.05 0.00 -1.58 0.00 0.00 42.46 38.64 3cmb s ILE 81 CO -0.07 0.16 0.19 0.21 -1.23 0.00 0.00 174.94 174.19 3cmb s ASN 82 N 1.19 6.22 -0.16 3.58 2.47 0.15 -0.87 114.94 127.51 3cmb s ASN 82 Ca -0.04 0.24 0.01 0.00 0.42 0.00 0.00 52.86 53.50 3cmb s ASN 82 Cb -0.18 -2.12 0.02 0.00 -1.45 0.00 0.00 41.25 37.52 3cmb s ASN 82 CO -0.07 0.10 -0.19 -0.69 -3.72 0.00 0.00 177.10 172.53 3cmb s VAL 83 N 0.74 1.97 0.26 -5.21 1.01 -0.12 -1.20 120.40 117.85 3cmb s VAL 83 Ca 0.10 -0.89 -0.04 0.00 0.00 0.00 0.00 61.98 61.14 3cmb s VAL 83 Cb -0.13 -1.78 -0.02 0.00 0.00 0.00 0.00 36.38 34.45 3cmb s VAL 83 CO 0.02 0.53 0.32 0.00 0.00 0.00 0.00 175.10 175.97 3cmb s ALA 84 N 1.20 0.71 0.00 5.51 0.00 -0.33 -0.72 121.76 128.14 3cmb s ALA 84 Ca 0.02 -1.44 0.01 0.00 0.00 0.00 0.00 51.96 50.55 3cmb s ALA 84 Cb -0.14 1.25 -0.00 0.00 0.00 0.00 0.00 23.12 24.23 3cmb s ALA 84 CO -0.10 -0.72 -0.02 0.00 0.00 0.00 0.00 175.76 174.92 3cmb s ALA 85 N -3.83 0.15 -0.05 0.00 0.00 -0.19 -0.40 121.76 117.44 3cmb s ALA 85 Ca 0.32 -0.17 -0.30 0.00 0.00 0.00 0.00 51.96 51.81 3cmb s ALA 85 Cb 0.03 -0.01 -0.04 0.00 0.00 0.00 0.00 23.12 23.10 3cmb s ALA 85 CO 0.14 0.00 1.38 -1.25 0.00 0.00 0.00 175.76 176.04 3cmb s PRO 86 N -0.31 4.26 0.13 0.00 0.04 -1.26 -0.53 135.00 137.34 3cmb s PRO 86 Ca -0.02 1.89 0.04 0.00 0.04 0.00 0.00 61.00 62.95 3cmb s PRO 86 Cb -0.02 -3.68 -0.04 0.00 0.04 0.00 0.00 34.50 30.79 3cmb s PRO 86 CO -0.00 -0.63 -0.10 0.14 0.04 0.00 0.00 177.00 176.45 3cmb s VAL 87 N 2.88 1.05 -0.15 -0.36 -7.23 -0.06 -0.36 120.40 116.16 3cmb s VAL 87 Ca 0.62 -1.97 -0.01 0.00 -1.81 0.00 0.00 61.98 58.81 3cmb s VAL 87 Cb -0.29 -1.73 -0.01 0.00 0.56 0.00 0.00 36.38 34.91 3cmb s VAL 87 CO 0.24 -0.73 -0.11 -0.60 -0.31 0.00 0.00 175.10 173.59 3cmb s ARG 88 N -3.59 3.40 -0.24 4.82 3.52 -0.01 -0.60 118.95 126.25 3cmb s ARG 88 Ca 0.14 -0.66 -0.16 0.00 -0.13 0.00 0.00 55.73 54.92 3cmb s ARG 88 Cb 0.02 -2.73 -0.04 0.00 -1.56 0.00 0.00 34.95 30.64 3cmb s ARG 88 CO -0.00 0.12 0.42 0.12 -0.81 0.00 0.00 175.30 175.14 3cmb s PHE 89 N 0.60 3.31 -1.04 5.12 5.36 0.46 -0.93 117.98 130.86 3cmb s PHE 89 Ca -0.06 0.55 -0.06 0.00 -0.96 0.00 0.00 56.93 56.40 3cmb s PHE 89 Cb -0.15 -2.58 0.27 0.00 -0.34 0.00 0.00 43.02 40.21 3cmb s PHE 89 CO 0.03 -0.14 1.07 0.72 -1.46 0.00 0.00 175.22 175.43 3cmb n HIS 90 N 4.99 4.52 -2.28 10.12 8.25 -0.84 -2.86 115.22 137.13 3cmb n HIS 90 Ca -0.07 -3.80 -0.26 0.00 -0.26 0.00 0.00 57.72 53.32 3cmb n HIS 90 Cb 0.51 -1.45 0.05 0.00 1.12 0.00 0.00 29.99 30.22 3cmb n HIS 90 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 3cmb s GLY 91 N 0.34 1.66 0.34 -1.41 0.00 0.49 -4.93 107.32 103.81 3cmb s GLY 91 Ca 0.30 -0.83 0.17 0.00 0.00 0.00 0.00 44.72 44.37 3cmb s GLY 91 CO -0.07 -0.47 1.64 0.50 0.00 0.00 0.00 173.10 174.70 3cmb h LYS 92 N -0.41 0.00 0.00 2.90 1.57 -1.86 -3.40 116.57 115.37 3cmb h LYS 92 Ca -0.45 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 3cmb h LYS 92 Cb 1.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.60 3cmb h LYS 92 CO 0.60 0.43 -0.75 1.63 -0.57 0.00 0.00 179.45 180.80 3cmb n LYS 93 N -3.43 0.61 -4.18 3.15 5.02 0.11 -5.06 118.16 114.37 3cmb n LYS 93 Ca 0.00 0.00 -0.35 0.00 -2.02 0.00 0.00 58.31 55.95 3cmb n LYS 93 Cb 0.59 -0.87 -0.09 0.00 -0.02 0.00 0.00 35.03 34.63 3cmb n LYS 93 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3cmb s ASP 94 N -3.49 5.47 -0.16 4.39 1.01 0.15 -5.00 116.67 119.04 3cmb s ASP 94 Ca 0.00 0.12 -0.02 0.00 0.71 0.00 0.00 52.55 53.36 3cmb s ASP 94 Cb 0.00 -1.77 0.05 0.00 1.01 0.00 0.00 42.92 42.21 3cmb s ASP 94 CO 0.00 0.28 0.03 -1.61 0.21 0.00 0.00 175.17 174.08 3cmb s GLU 95 N -0.27 0.64 0.14 8.23 2.02 -1.26 -0.38 118.70 127.82 3cmb s GLU 95 Ca 0.07 -0.28 -0.22 0.00 0.02 0.00 0.00 54.97 54.57 3cmb s GLU 95 Cb -0.12 -1.81 0.06 0.00 0.10 0.00 0.00 34.13 32.36 3cmb s GLU 95 CO 0.02 -0.55 0.57 -0.48 0.02 0.00 0.00 175.26 174.83 3cmb s LEU 96 N 1.89 -0.39 0.01 1.80 0.05 -1.13 -5.02 118.68 115.89 3cmb s LEU 96 Ca 0.01 -0.03 -0.04 0.00 0.05 0.00 0.00 54.13 54.12 3cmb s LEU 96 Cb -0.16 2.45 -0.04 0.00 -2.05 0.00 0.00 46.19 46.39 3cmb s LEU 96 CO -0.07 -0.93 0.22 -1.81 -0.55 0.00 0.00 176.35 173.20 3cmb s ASP 97 N -2.69 6.41 0.10 1.48 1.11 -1.26 -0.40 116.67 121.41 3cmb s ASP 97 Ca 0.01 0.41 -0.06 0.00 0.18 0.00 0.00 52.55 53.09 3cmb s ASP 97 Cb -0.00 -2.03 0.02 0.00 1.07 0.00 0.00 42.92 41.98 3cmb s ASP 97 CO -0.12 0.24 0.30 0.61 1.18 0.00 0.00 175.17 177.39 3cmb n GLY 98 N 0.88 1.37 3.26 0.21 0.00 0.23 -4.73 105.19 106.42 3cmb n GLY 98 Ca -0.10 -1.05 -0.38 0.00 0.00 0.00 0.00 46.02 44.50 3cmb n GLY 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3cmb s ALA 99 N -1.35 3.05 -0.12 4.61 0.00 -0.00 -0.88 121.76 127.06 3cmb s ALA 99 Ca 0.06 -1.81 -0.30 0.00 0.00 0.00 0.00 51.96 49.92 3cmb s ALA 99 Cb -0.01 -2.28 -0.02 0.00 0.00 0.00 0.00 23.12 20.80 3cmb s ALA 99 CO 0.03 -1.37 1.18 -0.47 0.00 0.00 0.00 175.76 175.13 3cmb s TYR 100 N 1.39 3.12 -0.40 0.00 5.04 0.31 -0.48 117.35 126.33 3cmb s TYR 100 Ca -0.01 1.21 -0.27 0.00 -2.44 0.00 0.00 57.07 55.56 3cmb s TYR 100 Cb -0.20 -3.41 0.02 0.00 0.35 0.00 0.00 41.96 38.72 3cmb s TYR 100 CO 0.02 -1.25 0.97 0.99 -1.34 0.00 0.00 175.55 174.95 3cmb s THR 101 N 2.76 4.50 0.02 4.34 2.01 -0.68 -1.02 115.64 127.58 3cmb s THR 101 Ca 0.53 1.17 -0.18 0.00 0.31 0.00 0.00 61.69 63.53 3cmb s THR 101 Cb -0.22 -4.40 -0.26 0.00 0.01 0.00 0.00 72.50 67.63 3cmb s THR 101 CO 0.17 -0.65 1.09 -0.07 -0.69 0.00 0.00 174.62 174.47 3cmb h LEU 102 N 10.32 0.69 -7.00 4.42 3.38 -1.27 -3.45 115.31 122.42 3cmb h LEU 102 Ca -0.23 -0.80 0.14 0.00 0.09 0.00 0.00 57.88 57.08 3cmb h LEU 102 Cb 1.07 -0.22 -0.27 0.00 0.09 0.00 0.00 40.66 41.34 3cmb h LEU 102 CO 1.02 1.41 0.70 0.54 0.09 0.00 0.00 178.44 182.20 3cmb s VAL 103 N -3.07 0.00 -0.16 1.22 0.11 -1.10 -4.90 120.40 112.50 3cmb s VAL 103 Ca -0.12 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 58.93 3cmb s VAL 103 Cb 0.04 -1.00 0.04 0.00 -1.53 0.00 0.00 36.38 33.93 3cmb s VAL 103 CO 0.87 0.00 -0.08 -0.69 -3.33 0.00 0.00 175.10 171.87 3cmb s VAL 104 N -0.58 1.32 0.05 2.04 1.01 -0.61 -0.94 120.40 122.69 3cmb s VAL 104 Ca 0.04 -0.69 -0.23 0.00 0.00 0.00 0.00 61.98 61.10 3cmb s VAL 104 Cb -0.02 -1.40 -0.06 0.00 0.00 0.00 0.00 36.38 34.89 3cmb s VAL 104 CO -0.06 0.23 0.70 0.26 0.00 0.00 0.00 175.10 176.23 3cmb s TRP 105 N 1.55 3.75 0.09 5.22 0.51 -0.05 -0.58 118.94 129.43 3cmb s TRP 105 Ca 0.01 1.40 0.05 0.00 -2.12 0.00 0.00 56.10 55.44 3cmb s TRP 105 Cb -0.15 -2.72 -0.03 0.00 -0.81 0.00 0.00 33.47 29.75 3cmb s TRP 105 CO -0.08 0.35 -0.12 -1.21 -0.51 0.00 0.00 176.95 175.38 3cmb s GLU 106 N -0.33 0.87 -0.32 4.98 2.02 -0.59 0.36 118.70 125.69 3cmb s GLU 106 Ca 0.35 -1.10 0.10 0.00 0.02 0.00 0.00 54.97 54.33 3cmb s GLU 106 Cb -0.20 -0.69 0.64 0.00 0.10 0.00 0.00 34.13 33.98 3cmb s GLU 106 CO 0.21 0.13 1.69 0.27 0.02 0.00 0.00 175.26 177.59 3cmb n ASN 107 N 0.79 3.94 -3.69 -0.19 6.94 -0.97 -1.85 115.26 120.23 3cmb n ASN 107 Ca -0.18 -3.40 -0.13 0.00 -0.02 0.00 0.00 54.58 50.86 3cmb n ASN 107 Cb 0.56 -0.71 -0.09 0.00 -2.36 0.00 0.00 39.78 37.19 3cmb n ASN 107 CO 0.00 0.00 0.00 -0.75 -1.03 0.00 0.00 177.26 175.48 3cmb s LYS 108 N -3.09 0.60 0.15 -3.83 2.20 -1.26 -4.91 119.74 109.59 3cmb s LYS 108 Ca 0.51 0.77 -0.08 0.00 -0.36 0.00 0.00 55.97 56.82 3cmb s LYS 108 Cb 0.43 0.25 -0.03 0.00 -1.51 0.00 0.00 37.83 36.97 3cmb s LYS 108 CO 0.09 -0.09 1.40 1.15 -0.36 0.00 0.00 175.35 177.55 3cmb h THR 109 N 4.50 1.31 -0.27 3.43 2.02 -2.00 -3.28 112.91 118.63 3cmb h THR 109 Ca -0.29 -1.92 0.06 0.00 0.77 0.00 0.00 66.41 65.03 3cmb h THR 109 Cb 1.18 1.89 -0.07 0.00 -1.74 0.00 0.00 68.15 69.41 3cmb h THR 109 CO 0.19 0.60 -0.19 0.00 0.37 0.00 0.00 175.52 176.49 3cmb h ALA 110 N 0.77 -0.01 0.00 6.16 0.00 -2.00 -0.05 119.26 124.13 3cmb h ALA 110 Ca -0.02 0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 3cmb h ALA 110 Cb 1.26 0.41 -0.01 0.00 0.00 0.00 0.00 17.79 19.46 3cmb h ALA 110 CO 0.13 -0.59 -0.17 -1.00 0.00 0.00 0.00 179.25 177.62 3cmb h PRO 111 N -0.17 0.00 0.03 0.00 0.13 -2.00 -2.42 132.00 127.57 3cmb h PRO 111 Ca 0.15 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.27 3cmb h PRO 111 Cb 0.39 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.52 3cmb h PRO 111 CO -0.37 0.17 -0.01 0.82 -0.23 0.00 0.00 178.00 178.38 3cmb h ILE 112 N 0.00 1.25 -0.65 -3.56 2.04 -1.11 -0.77 117.51 114.71 3cmb h ILE 112 Ca -0.00 -0.86 -0.04 0.00 1.00 0.00 0.00 64.86 64.96 3cmb h ILE 112 Cb 0.39 1.82 -0.03 0.00 -0.74 0.00 0.00 36.82 38.27 3cmb h ILE 112 CO 0.02 0.22 0.26 -0.07 0.00 0.00 0.00 178.15 178.58 3cmb h LEU 113 N -0.41 0.89 -0.16 1.44 3.38 -1.18 -2.10 115.31 117.17 3cmb h LEU 113 Ca -0.00 -0.17 -0.00 0.00 0.09 0.00 0.00 57.88 57.79 3cmb h LEU 113 Cb 0.39 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 3cmb h LEU 113 CO 0.01 0.82 0.09 1.23 0.09 0.00 0.00 178.44 180.68 3cmb h GLY 114 N 0.91 0.24 0.96 0.83 0.00 -1.41 -0.95 103.07 103.65 3cmb h GLY 114 Ca 0.22 -0.10 -0.03 0.00 0.00 0.00 0.00 47.33 47.42 3cmb h GLY 114 CO -0.02 0.10 0.19 -1.33 0.00 0.00 0.00 176.54 175.48 3cmb h GLY 115 N 0.17 0.74 0.68 4.60 0.00 -0.99 0.13 103.07 108.41 3cmb h GLY 115 Ca 0.06 -0.40 -0.01 0.00 0.00 0.00 0.00 47.33 46.97 3cmb h GLY 115 CO -0.01 0.38 -0.13 3.21 0.00 0.00 0.00 176.54 179.98 3cmb h ARG 116 N 0.61 -0.36 0.00 4.80 3.08 -1.30 -1.23 114.38 119.98 3cmb h ARG 116 Ca 0.16 0.02 -0.18 0.00 0.07 0.00 0.00 59.98 60.04 3cmb h ARG 116 Cb 0.18 0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.29 3cmb h ARG 116 CO -0.01 -0.04 -0.88 0.93 -1.07 0.00 0.00 179.97 178.90 3cmb h GLU 117 N -0.69 0.00 0.00 0.04 5.08 -1.15 -1.21 114.58 116.65 3cmb h GLU 117 Ca -0.04 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.15 3cmb h GLU 117 Cb 0.48 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.70 3cmb h GLU 117 CO 0.06 0.88 -1.53 1.04 -1.00 0.00 0.00 179.01 178.46 3cmb n GLN 118 N -3.39 0.63 0.00 2.33 6.02 0.46 -4.69 117.38 118.73 3cmb n GLN 118 Ca 0.00 0.17 0.00 0.00 -0.01 0.00 0.00 57.00 57.16 3cmb n GLN 118 Cb 0.87 -1.76 0.00 0.00 1.02 0.00 0.00 30.24 30.36 3cmb n GLN 118 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 3cmb n THR 119 N -2.83 0.00 -2.24 5.09 -2.24 -1.01 -5.04 114.28 106.02 3cmb n THR 119 Ca -0.11 0.00 -0.18 0.00 -2.27 0.00 0.00 64.05 61.49 3cmb n THR 119 Cb 0.84 1.45 -0.02 0.00 -2.10 0.00 0.00 70.33 70.50 3cmb n THR 119 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3cmb n GLY 120 N 0.00 -0.11 3.68 3.38 0.00 -0.46 -4.53 105.19 107.15 3cmb n GLY 120 Ca 0.00 -0.13 -0.42 0.00 0.00 0.00 0.00 46.02 45.47 3cmb n GLY 120 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3cmb s ILE 121 N -2.87 4.79 -1.24 -0.61 -1.09 -0.59 -0.92 121.20 118.67 3cmb s ILE 121 Ca 0.00 1.93 -0.17 0.00 -2.23 0.00 0.00 60.65 60.18 3cmb s ILE 121 Cb 0.00 -4.27 -0.02 0.00 -1.58 0.00 0.00 42.46 36.60 3cmb s ILE 121 CO 0.00 -0.02 2.06 -0.81 -1.23 0.00 0.00 174.94 174.94 3cmb n PRO 122 N 5.26 2.46 -3.14 2.79 -0.04 -1.26 -3.20 135.00 137.87 3cmb n PRO 122 Ca 0.08 -2.49 -0.39 0.00 -0.04 0.00 0.00 63.50 60.66 3cmb n PRO 122 Cb 0.48 -3.25 -0.05 0.00 -0.04 0.00 0.00 33.50 30.64 3cmb n PRO 122 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 3cmb s LYS 123 N 4.03 4.37 0.22 0.54 1.02 -1.26 -1.57 119.74 127.09 3cmb s LYS 123 Ca 0.52 0.84 -0.01 0.00 0.02 0.00 0.00 55.97 57.34 3cmb s LYS 123 Cb 0.12 -3.34 -0.04 0.00 -0.52 0.00 0.00 37.83 34.05 3cmb s LYS 123 CO 0.00 0.37 0.18 0.96 -0.92 0.00 0.00 175.35 175.94 3cmb s ILE 124 N -0.24 0.00 -0.01 2.17 -4.36 0.25 -4.94 121.20 114.07 3cmb s ILE 124 Ca 0.33 -1.95 -0.09 0.00 -0.26 0.00 0.00 60.65 58.68 3cmb s ILE 124 Cb -0.19 -2.48 -0.05 0.00 1.25 0.00 0.00 42.46 40.99 3cmb s ILE 124 CO 0.19 0.00 0.30 -0.47 0.24 0.00 0.00 174.94 175.20 3cmb s TYR 125 N -4.06 3.63 0.14 1.37 6.14 -1.26 -1.55 117.35 121.76 3cmb s TYR 125 Ca 0.38 0.72 -0.19 0.00 0.64 0.00 0.00 57.07 58.61 3cmb s TYR 125 Cb 0.06 -2.09 0.05 0.00 0.42 0.00 0.00 41.96 40.40 3cmb s TYR 125 CO 0.14 0.63 0.49 0.00 0.64 0.00 0.00 175.55 177.45 3cmb s ALA 126 N -1.20 -1.23 -0.04 3.97 0.00 -0.77 -4.87 121.76 117.61 3cmb s ALA 126 Ca 0.25 0.20 -0.30 0.00 0.00 0.00 0.00 51.96 52.11 3cmb s ALA 126 Cb -0.14 0.77 -0.04 0.00 0.00 0.00 0.00 23.12 23.72 3cmb s ALA 126 CO 0.13 -0.70 1.27 -0.51 0.00 0.00 0.00 175.76 175.95 3cmb s ASP 127 N -2.77 6.98 -0.20 0.00 1.01 -0.43 -3.66 116.67 117.61 3cmb s ASP 127 Ca 0.02 1.91 -0.00 0.00 0.71 0.00 0.00 52.55 55.18 3cmb s ASP 127 Cb 0.01 -2.56 0.05 0.00 1.01 0.00 0.00 42.92 41.43 3cmb s ASP 127 CO -0.12 -0.63 -0.04 -0.63 0.21 0.00 0.00 175.17 173.96 3cmb s ILE 128 N 2.30 1.19 0.45 0.77 1.01 -1.26 -1.53 121.20 124.13 3cmb s ILE 128 Ca 0.58 -0.89 -0.24 0.00 0.00 0.00 0.00 60.65 60.10 3cmb s ILE 128 Cb -0.27 -1.47 -0.08 0.00 0.01 0.00 0.00 42.46 40.65 3cmb s ILE 128 CO 0.23 -0.04 1.28 -1.61 0.00 0.00 0.00 174.94 174.80 3cmb s GLU 129 N 1.57 3.76 0.85 2.79 0.41 -0.83 -4.92 118.70 122.33 3cmb s GLU 129 Ca -0.03 2.07 -0.11 0.00 -0.41 0.00 0.00 54.97 56.49 3cmb s GLU 129 Cb -0.17 -2.57 0.10 0.00 -1.78 0.00 0.00 34.13 29.71 3cmb s GLU 129 CO -0.07 -0.64 1.09 0.34 -0.49 0.00 0.00 175.26 175.49 3cmb s ASP 130 N -0.94 3.94 0.31 -0.19 2.15 -1.26 -4.70 116.67 115.98 3cmb s ASP 130 Ca 0.61 1.44 -0.29 0.00 0.43 0.00 0.00 52.55 54.74 3cmb s ASP 130 Cb -0.36 -2.14 -0.12 0.00 -0.30 0.00 0.00 42.92 40.00 3cmb s ASP 130 CO 0.45 -2.34 1.54 0.18 -0.17 0.00 0.00 175.17 174.83 3cmb n LEU 131 N -3.68 4.34 -4.72 -1.34 4.77 -1.26 -4.81 117.00 110.29 3cmb n LEU 131 Ca 0.07 1.17 -0.36 0.00 -0.03 0.00 0.00 56.01 56.87 3cmb n LEU 131 Cb 0.55 -1.58 -0.08 0.00 -2.33 0.00 0.00 43.42 39.98 3cmb n LEU 131 CO 0.56 0.08 -0.12 -1.00 -1.33 0.00 0.00 177.39 175.58 3cmb s HIS 132 N -0.35 3.42 -0.22 -1.77 3.76 0.67 -4.93 115.29 115.88 3cmb s HIS 132 Ca 0.61 0.42 -0.01 0.00 -0.15 0.00 0.00 55.06 55.93 3cmb s HIS 132 Cb -0.50 -2.24 0.06 0.00 1.11 0.00 0.00 32.58 31.01 3cmb s HIS 132 CO 0.53 0.25 -0.01 0.42 -0.85 0.00 0.00 174.74 175.08 3cmb s ILE 133 N 0.48 1.08 -0.45 0.60 1.01 -1.26 -1.13 121.20 121.53 3cmb s ILE 133 Ca 0.11 -0.95 0.03 0.00 0.00 0.00 0.00 60.65 59.84 3cmb s ILE 133 Cb -0.12 -1.47 0.13 0.00 0.01 0.00 0.00 42.46 41.01 3cmb s ILE 133 CO 0.01 -0.17 0.22 -0.69 0.00 0.00 0.00 174.94 174.31 3cmb s VAL 134 N 1.60 1.76 0.22 2.92 1.01 -0.29 -5.04 120.40 122.58 3cmb s VAL 134 Ca -0.03 -2.68 -0.32 0.00 0.00 0.00 0.00 61.98 58.94 3cmb s VAL 134 Cb -0.18 -2.24 -0.13 0.00 0.00 0.00 0.00 36.38 33.83 3cmb s VAL 134 CO -0.07 -0.84 1.51 0.54 0.00 0.00 0.00 175.10 176.24 3cmb n ARG 135 N 3.55 2.20 -0.60 2.72 1.74 -1.26 -0.00 116.66 125.01 3cmb n ARG 135 Ca 0.07 0.79 0.07 0.00 -0.77 0.00 0.00 57.85 58.01 3cmb n ARG 135 Cb 0.35 -2.51 0.32 0.00 -1.02 0.00 0.00 32.46 29.59 3cmb n ARG 135 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 3cmb n PRO 136 N 2.63 3.63 -3.48 5.56 -0.04 -1.26 -5.10 135.00 136.94 3cmb n PRO 136 Ca 0.13 -2.50 -0.37 0.00 -0.04 0.00 0.00 63.50 60.73 3cmb n PRO 136 Cb 0.31 -1.91 -0.07 0.00 -0.04 0.00 0.00 33.50 31.79 3cmb n PRO 136 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 3cmb s HIS 137 N -2.02 3.49 0.04 0.54 3.76 1.00 -1.09 115.29 121.01 3cmb s HIS 137 Ca 0.44 0.70 0.06 0.00 -0.15 0.00 0.00 55.06 56.11 3cmb s HIS 137 Cb 0.30 -2.39 -0.02 0.00 1.11 0.00 0.00 32.58 31.58 3cmb s HIS 137 CO 0.19 0.25 -0.18 -0.06 -0.85 0.00 0.00 174.74 174.08 3cmb s PHE 138 N 0.40 1.58 -0.07 1.40 0.40 -0.08 -1.13 117.98 120.48 3cmb s PHE 138 Ca 0.20 -0.36 -0.22 0.00 -0.60 0.00 0.00 56.93 55.94 3cmb s PHE 138 Cb -0.14 -0.94 0.05 0.00 0.51 0.00 0.00 43.02 42.50 3cmb s PHE 138 CO 0.06 0.07 0.50 0.00 0.70 0.00 0.00 175.22 176.55 3cmb s ALA 139 N -0.82 -1.28 0.07 5.36 0.00 -0.29 -1.08 121.76 123.72 3cmb s ALA 139 Ca 0.05 0.96 -0.02 0.00 0.00 0.00 0.00 51.96 52.96 3cmb s ALA 139 Cb -0.08 -0.16 -0.04 0.00 0.00 0.00 0.00 23.12 22.84 3cmb s ALA 139 CO 0.02 -0.30 0.01 -0.08 0.00 0.00 0.00 175.76 175.41 3cmb s THR 140 N -0.92 0.19 -0.04 0.00 -1.32 -1.26 -0.24 115.64 112.05 3cmb s THR 140 Ca -0.10 -1.75 0.02 0.00 -1.21 0.00 0.00 61.69 58.65 3cmb s THR 140 Cb -0.03 -1.59 0.01 0.00 -1.51 0.00 0.00 72.50 69.38 3cmb s THR 140 CO 0.06 -0.86 -0.07 -0.89 -2.21 0.00 0.00 174.62 170.64 3cmb s THR 141 N -3.94 0.68 -0.06 5.08 2.01 -1.26 -4.48 115.64 113.68 3cmb s THR 141 Ca 0.10 -0.26 0.05 0.00 0.31 0.00 0.00 61.69 61.89 3cmb s THR 141 Cb 0.07 -0.64 -0.01 0.00 0.01 0.00 0.00 72.50 71.94 3cmb s THR 141 CO -0.08 0.24 -0.22 -0.69 -0.69 0.00 0.00 174.62 173.18 3cmb s VAL 142 N 0.52 1.81 0.08 3.82 1.01 -0.17 -1.95 120.40 125.51 3cmb s VAL 142 Ca -0.08 -0.92 -0.09 0.00 0.00 0.00 0.00 61.98 60.89 3cmb s VAL 142 Cb -0.11 -1.54 0.00 0.00 0.00 0.00 0.00 36.38 34.72 3cmb s VAL 142 CO 0.01 0.51 0.20 -0.94 0.00 0.00 0.00 175.10 174.87 3cmb s SER 143 N 0.02 0.08 -0.15 3.32 1.04 -0.58 -0.63 113.70 116.79 3cmb s SER 143 Ca -0.06 -0.56 0.00 0.00 0.48 0.00 0.00 55.95 55.81 3cmb s SER 143 Cb -0.14 0.33 0.03 0.00 0.10 0.00 0.00 66.02 66.34 3cmb s SER 143 CO 0.04 -0.69 -0.12 -0.47 0.98 0.00 0.00 173.24 172.98 3cmb s TYR 144 N -3.50 2.06 -1.61 5.02 5.04 -0.31 -1.31 117.35 122.74 3cmb s TYR 144 Ca 0.02 -1.18 -0.07 0.00 -2.44 0.00 0.00 57.07 53.40 3cmb s TYR 144 Cb 0.03 -1.52 0.07 0.00 0.35 0.00 0.00 41.96 40.89 3cmb s TYR 144 CO -0.09 -0.65 0.31 0.39 -1.34 0.00 0.00 175.55 174.17 3cmb n GLU 145 N 4.80 -1.71 0.00 4.97 1.02 -1.26 -1.06 120.64 127.39 3cmb n GLU 145 Ca -0.16 0.21 0.00 0.00 -0.02 0.00 0.00 57.16 57.19 3cmb n GLU 145 Cb 0.49 -4.22 0.00 0.00 -0.02 0.00 0.00 31.44 27.70 3cmb n GLU 145 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3cmb n GLY 146 N -2.00 0.84 3.38 0.62 0.00 -1.26 -5.02 105.19 101.75 3cmb n GLY 146 Ca -0.18 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.39 3cmb n GLY 146 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3cmb s ASN 147 N -2.53 6.18 0.16 1.61 0.01 -0.22 -5.05 114.94 115.09 3cmb s ASN 147 Ca 0.00 -1.39 -0.34 0.00 -0.71 0.00 0.00 52.86 50.42 3cmb s ASN 147 Cb 0.00 -2.24 -0.15 0.00 0.41 0.00 0.00 41.25 39.28 3cmb s ASN 147 CO 0.00 -0.86 1.47 0.41 -1.51 0.00 0.00 177.10 176.61 3cmb n THR 148 N 5.38 0.19 0.00 1.60 -1.04 -1.26 -1.16 114.28 117.99 3cmb n THR 148 Ca -0.11 -0.05 0.00 0.00 -2.04 0.00 0.00 64.05 61.85 3cmb n THR 148 Cb 0.43 -1.31 0.00 0.00 -1.82 0.00 0.00 70.33 67.62 3cmb n THR 148 CO 0.00 0.00 0.00 2.22 -0.64 0.00 0.00 175.07 176.65 3cmb n PHE 149 N 2.86 0.00 -4.12 -1.42 1.16 0.19 -4.68 117.46 111.45 3cmb n PHE 149 Ca 0.16 0.00 -0.18 0.00 -1.87 0.00 0.00 57.45 55.56 3cmb n PHE 149 Cb 0.27 0.00 -0.16 0.00 -1.61 0.00 0.00 39.48 37.98 3cmb n PHE 149 CO 0.00 0.00 0.00 -1.17 -1.87 0.00 0.00 176.76 173.72 3cmb s LEU 150 N -1.57 1.43 0.00 5.98 2.96 -0.86 -1.55 118.68 125.07 3cmb s LEU 150 Ca 0.00 -0.10 0.01 0.00 -0.22 0.00 0.00 54.13 53.82 3cmb s LEU 150 Cb 0.00 -0.36 0.01 0.00 0.50 0.00 0.00 46.19 46.33 3cmb s LEU 150 CO 0.00 -0.04 0.05 0.59 -1.32 0.00 0.00 176.35 175.63 3cmb n ASN 151 N 3.84 1.92 0.00 3.68 4.13 -0.20 -1.00 115.26 127.63 3cmb n ASN 151 Ca -0.24 -1.54 0.00 0.00 1.68 0.00 0.00 54.58 54.49 3cmb n ASN 151 Cb 0.52 0.04 0.00 0.00 -1.54 0.00 0.00 39.78 38.80 3cmb n ASN 151 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 3cmb n ASP 153 N -1.51 0.00 -3.68 6.41 9.92 0.27 -1.39 116.55 126.57 3cmb n ASP 153 Ca -0.03 0.00 -0.11 0.00 -0.53 0.00 0.00 54.79 54.12 3cmb n ASP 153 Cb 0.17 0.00 -0.11 0.00 -0.64 0.00 0.00 41.12 40.53 3cmb n ASP 153 CO 0.00 0.00 0.00 0.12 0.13 0.00 0.00 177.20 177.45 3cmb s PHE 154 N -2.00 -0.60 -0.30 1.24 5.36 -0.24 -1.19 117.98 120.24 3cmb s PHE 154 Ca 0.00 1.24 -0.06 0.00 -0.96 0.00 0.00 56.93 57.15 3cmb s PHE 154 Cb 0.00 0.20 0.02 0.00 -0.34 0.00 0.00 43.02 42.89 3cmb s PHE 154 CO 0.00 -0.38 0.07 -2.00 -1.46 0.00 0.00 175.22 171.46 3cmb s GLU 155 N 1.96 2.99 0.08 10.12 2.12 0.64 -0.90 118.70 135.72 3cmb s GLU 155 Ca -0.05 -0.92 -0.31 0.00 0.36 0.00 0.00 54.97 54.05 3cmb s GLU 155 Cb -0.10 -3.36 -0.07 0.00 0.26 0.00 0.00 34.13 30.85 3cmb s GLU 155 CO -0.11 -0.48 1.40 0.00 -0.54 0.00 0.00 175.26 175.53 3cmb s ALA 156 N 1.47 3.59 -0.18 6.30 0.00 -0.25 -0.23 121.76 132.46 3cmb s ALA 156 Ca 0.02 1.06 0.08 0.00 0.00 0.00 0.00 51.96 53.11 3cmb s ALA 156 Cb -0.18 -3.56 -0.10 0.00 0.00 0.00 0.00 23.12 19.29 3cmb s ALA 156 CO 0.02 -0.71 0.24 0.25 0.00 0.00 0.00 175.76 175.56 3cmb n THR 157 N 4.17 0.00 0.00 0.00 -2.24 0.08 -4.84 114.28 111.44 3cmb n THR 157 Ca 0.12 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.65 3cmb n THR 157 Cb 0.43 0.65 0.00 0.00 -2.10 0.00 0.00 70.33 69.31 3cmb n THR 157 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3cmb n GLY 158 N 1.63 1.08 3.79 3.38 0.00 -1.12 -5.01 105.19 108.93 3cmb n GLY 158 Ca -0.00 -0.79 -0.36 0.00 0.00 0.00 0.00 46.02 44.87 3cmb n GLY 158 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3cmb s SER 159 N 0.00 6.98 -0.23 1.61 0.01 -1.26 -0.60 113.70 120.20 3cmb s SER 159 Ca 0.00 1.92 -0.09 0.00 1.31 0.00 0.00 55.95 59.09 3cmb s SER 159 Cb 0.00 -2.58 -0.04 0.00 0.21 0.00 0.00 66.02 63.61 3cmb s SER 159 CO 0.00 -0.33 0.12 -0.63 0.41 0.00 0.00 173.24 172.81 3cmb s ILE 160 N -1.72 4.96 0.24 1.44 1.01 -0.04 -4.80 121.20 122.28 3cmb s ILE 160 Ca 0.56 0.04 0.05 0.00 0.00 0.00 0.00 60.65 61.30 3cmb s ILE 160 Cb -0.19 -3.30 -0.02 0.00 0.01 0.00 0.00 42.46 38.96 3cmb s ILE 160 CO 0.24 0.36 0.18 0.35 0.00 0.00 0.00 174.94 176.07 3cmb n THR 161 N 4.36 0.00 0.00 2.92 -2.24 -1.26 -4.55 114.28 113.51 3cmb n THR 161 Ca -0.16 -1.67 0.00 0.00 -2.27 0.00 0.00 64.05 59.96 3cmb n THR 161 Cb 0.52 0.80 0.00 0.00 -2.10 0.00 0.00 70.33 69.55 3cmb n THR 161 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3cmb n GLY 162 N -0.35 2.12 0.21 3.38 0.00 -1.26 -1.07 105.19 108.22 3cmb n GLY 162 Ca 0.04 0.20 0.08 0.00 0.00 0.00 0.00 46.02 46.34 3cmb n GLY 162 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3cmb h ARG 163 N 0.00 0.00 -0.42 1.61 -0.00 -1.99 -0.83 114.38 112.75 3cmb h ARG 163 Ca 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 59.98 59.86 3cmb h ARG 163 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 29.96 3cmb h ARG 163 CO 0.00 0.29 -0.23 0.38 -0.00 0.00 0.00 179.97 180.41 3cmb h ASP 164 N 0.00 0.88 -0.23 0.08 3.04 -1.50 -2.09 116.42 116.60 3cmb h ASP 164 Ca -0.00 -0.33 -0.16 0.00 -3.24 0.00 0.00 57.03 53.30 3cmb h ASP 164 Cb 0.75 -0.24 0.00 0.00 -1.04 0.00 0.00 39.33 38.80 3cmb h ASP 164 CO 0.04 1.07 -0.48 0.25 -2.04 0.00 0.00 179.24 178.07 3cmb h LEU 165 N 0.74 0.82 -0.96 0.15 5.85 -0.36 -2.25 115.31 119.30 3cmb h LEU 165 Ca 0.10 -0.55 0.12 0.00 0.84 0.00 0.00 57.88 58.39 3cmb h LEU 165 Cb 0.77 -0.24 -0.08 0.00 0.37 0.00 0.00 40.66 41.48 3cmb h LEU 165 CO 0.06 1.22 0.59 0.44 -0.34 0.00 0.00 178.44 180.41 3cmb h ASP 166 N 0.45 0.85 -0.20 1.25 3.32 -0.98 0.73 116.42 121.84 3cmb h ASP 166 Ca 0.00 0.05 -0.13 0.00 0.02 0.00 0.00 57.03 56.97 3cmb h ASP 166 Cb 1.09 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 40.53 3cmb h ASP 166 CO 0.11 0.45 -0.40 0.00 -1.72 0.00 0.00 179.24 177.67 3cmb h ALA 167 N 1.53 0.31 -0.54 3.45 0.00 -1.16 -1.84 119.26 121.02 3cmb h ALA 167 Ca 0.48 -0.45 -0.11 0.00 0.00 0.00 0.00 54.91 54.83 3cmb h ALA 167 Cb 0.50 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 3cmb h ALA 167 CO -0.27 0.41 -0.08 1.25 0.00 0.00 0.00 179.25 180.56 3cmb h LEU 168 N 0.30 1.01 -1.11 0.00 5.85 -0.93 -0.87 115.31 119.55 3cmb h LEU 168 Ca 0.01 -0.34 0.07 0.00 0.84 0.00 0.00 57.88 58.45 3cmb h LEU 168 Cb 1.00 -0.27 -0.06 0.00 0.37 0.00 0.00 40.66 41.70 3cmb h LEU 168 CO 0.09 1.11 0.61 0.11 -0.34 0.00 0.00 178.44 180.02 3cmb h LYS 169 N 0.88 1.03 -0.44 1.25 1.57 -0.72 -1.92 116.57 118.22 3cmb h LYS 169 Ca 0.14 -0.06 -0.08 0.00 -1.87 0.00 0.00 60.65 58.78 3cmb h LYS 169 Cb 0.64 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 32.71 3cmb h LYS 169 CO 0.04 0.68 -0.02 0.77 -0.57 0.00 0.00 179.45 180.36 3cmb h SER 170 N 1.07 0.79 -0.99 0.86 0.02 -0.57 -0.90 113.55 113.83 3cmb h SER 170 Ca 0.41 -0.32 0.06 0.00 -0.84 0.00 0.00 61.79 61.10 3cmb h SER 170 Cb 0.20 -0.21 -0.06 0.00 0.14 0.00 0.00 62.40 62.47 3cmb h SER 170 CO -0.16 0.92 0.64 -0.61 -1.14 0.00 0.00 176.83 176.48 3cmb h GLN 171 N 0.64 1.14 0.00 3.45 4.15 -0.50 -3.20 115.11 120.79 3cmb h GLN 171 Ca 0.12 -0.07 -0.25 0.00 0.77 0.00 0.00 58.65 59.22 3cmb h GLN 171 Cb 0.52 -0.26 -0.04 0.00 0.21 0.00 0.00 27.48 27.91 3cmb h GLN 171 CO 0.03 0.75 -1.60 0.74 -1.93 0.00 0.00 178.83 176.82 3cmb h PHE 172 N 1.17 0.00 -0.67 3.99 -1.00 -1.17 -3.37 116.94 115.89 3cmb h PHE 172 Ca 0.42 0.00 -0.05 0.00 2.81 0.00 0.00 57.97 61.15 3cmb h PHE 172 Cb 0.14 0.00 -0.03 0.00 3.61 0.00 0.00 35.95 39.67 3cmb h PHE 172 CO -0.00 0.87 0.21 1.25 -1.61 0.00 0.00 178.31 179.03 3cmb h LEU 173 N 0.00 0.96 -8.64 1.54 5.85 -1.15 -3.40 115.31 110.47 3cmb h LEU 173 Ca -0.24 -0.17 -0.42 0.00 0.84 0.00 0.00 57.88 57.88 3cmb h LEU 173 Cb 1.88 -0.25 -0.18 0.00 0.37 0.00 0.00 40.66 42.48 3cmb h LEU 173 CO 0.07 0.89 -0.76 0.42 -0.34 0.00 0.00 178.44 178.72 3cmb s THR 174 N -5.36 1.39 -0.37 1.05 -4.23 -1.25 -4.36 115.64 102.50 3cmb s THR 174 Ca -0.11 -1.76 0.04 0.00 -1.18 0.00 0.00 61.69 58.67 3cmb s THR 174 Cb 0.15 -1.59 0.16 0.00 1.34 0.00 0.00 72.50 72.57 3cmb s THR 174 CO 0.82 -0.42 0.43 0.20 -0.54 0.00 0.00 174.62 175.12 3cmb s ASN 176 N -2.52 0.52 -0.11 3.99 0.01 -1.26 -4.92 114.94 110.64 3cmb s ASN 176 Ca 0.10 -1.32 -0.28 0.00 -0.71 0.00 0.00 52.86 50.65 3cmb s ASN 176 Cb -0.05 0.90 -0.02 0.00 0.41 0.00 0.00 41.25 42.50 3cmb s ASN 176 CO 0.03 -0.25 0.94 -0.89 -1.51 0.00 0.00 177.10 175.43 3cmb s THR 177 N 1.60 4.83 -0.13 1.60 2.01 -1.07 -0.82 115.64 123.65 3cmb s THR 177 Ca 0.16 1.90 -0.03 0.00 0.31 0.00 0.00 61.69 64.04 3cmb s THR 177 Cb -0.13 -4.25 -0.03 0.00 0.01 0.00 0.00 72.50 68.10 3cmb s THR 177 CO -0.06 0.03 -0.04 -0.76 -0.69 0.00 0.00 174.62 173.10 3cmb s LEU 178 N 1.91 3.25 0.47 4.42 1.43 0.37 -0.88 118.68 129.64 3cmb s LEU 178 Ca 0.45 -0.09 0.03 0.00 -1.03 0.00 0.00 54.13 53.49 3cmb s LEU 178 Cb -0.18 -1.77 -0.03 0.00 0.03 0.00 0.00 46.19 44.24 3cmb s LEU 178 CO 0.17 0.22 0.02 -0.83 0.23 0.00 0.00 176.35 176.16 3cmb s GLY 179 N 0.06 2.82 -0.26 -3.19 0.00 0.36 -1.68 107.32 105.43 3cmb s GLY 179 Ca -0.00 -1.02 -0.03 0.00 0.00 0.00 0.00 44.72 43.66 3cmb s GLY 179 CO 0.03 -2.13 0.10 0.86 0.00 0.00 0.00 173.10 171.95 3cmb s TRP 180 N -2.87 0.79 -0.42 1.90 -0.00 -0.10 -1.79 118.94 116.45 3cmb s TRP 180 Ca 0.16 -1.00 -0.25 0.00 -0.00 0.00 0.00 56.10 55.00 3cmb s TRP 180 Cb 0.04 -1.10 0.02 0.00 -0.00 0.00 0.00 33.47 32.44 3cmb s TRP 180 CO 0.08 -0.75 0.92 0.50 -0.00 0.00 0.00 176.95 177.71 3cmb s ARG 181 N 1.94 3.66 -0.09 5.86 3.52 -0.06 -4.69 118.95 129.09 3cmb s ARG 181 Ca 0.06 0.33 0.00 0.00 -0.13 0.00 0.00 55.73 55.99 3cmb s ARG 181 Cb -0.17 -3.87 0.02 0.00 -1.56 0.00 0.00 34.95 29.37 3cmb s ARG 181 CO -0.24 -1.10 -0.07 -0.47 -0.81 0.00 0.00 175.30 172.61 3cmb s TYR 182 N 3.63 1.33 -0.15 5.12 6.14 -1.26 -1.34 117.35 130.82 3cmb s TYR 182 Ca 0.37 -0.59 0.01 0.00 0.64 0.00 0.00 57.07 57.50 3cmb s TYR 182 Cb -0.11 -1.11 0.01 0.00 0.42 0.00 0.00 41.96 41.17 3cmb s TYR 182 CO 0.23 -0.42 -0.20 0.42 0.64 0.00 0.00 175.55 176.22 3cmb s ILE 183 N 1.46 2.23 0.60 3.14 -1.09 -0.04 -5.00 121.20 122.51 3cmb s ILE 183 Ca -0.00 -0.91 -0.15 0.00 -2.23 0.00 0.00 60.65 57.36 3cmb s ILE 183 Cb -0.13 -1.92 -0.04 0.00 -1.58 0.00 0.00 42.46 38.79 3cmb s ILE 183 CO -0.05 0.54 1.04 -2.16 -1.23 0.00 0.00 174.94 173.08 3cmb s PRO 184 N 0.94 3.38 0.73 2.79 0.04 -1.26 0.30 135.00 141.92 3cmb s PRO 184 Ca -0.04 1.08 -0.14 0.00 0.04 0.00 0.00 61.00 61.95 3cmb s PRO 184 Cb -0.15 -2.05 0.04 0.00 0.04 0.00 0.00 34.50 32.38 3cmb s PRO 184 CO -0.04 -0.75 1.14 0.15 0.04 0.00 0.00 177.00 177.54 3cmb s LYS 185 N -4.32 2.32 -0.31 4.56 1.02 0.65 -4.19 119.74 119.47 3cmb s LYS 185 Ca 0.61 1.46 -0.24 0.00 0.02 0.00 0.00 55.97 57.83 3cmb s LYS 185 Cb -0.14 -1.88 0.00 0.00 -0.52 0.00 0.00 37.83 35.29 3cmb s LYS 185 CO 0.40 -1.64 0.82 0.08 -0.92 0.00 0.00 175.35 174.09 3cmb s VAL 186 N -2.39 4.76 -1.02 3.17 1.01 -1.26 -4.18 120.40 120.49 3cmb s VAL 186 Ca 0.68 1.21 0.00 0.00 0.00 0.00 0.00 61.98 63.87 3cmb s VAL 186 Cb -0.22 -4.18 0.00 0.00 0.00 0.00 0.00 36.38 31.98 3cmb s VAL 186 CO 0.47 -0.29 0.00 0.61 0.00 0.00 0.00 175.10 175.89 3cmb n GLY 187 N 4.19 0.41 3.43 4.51 0.00 -1.26 -4.99 105.19 111.49 3cmb n GLY 187 Ca 0.04 -0.47 -0.14 0.00 0.00 0.00 0.00 46.02 45.46 3cmb n GLY 187 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3cmb s ALA 188 N -2.49 -1.53 0.66 4.61 0.00 -1.26 -5.16 121.76 116.59 3cmb s ALA 188 Ca 0.00 0.72 -0.15 0.00 0.00 0.00 0.00 51.96 52.53 3cmb s ALA 188 Cb 0.00 0.48 -0.00 0.00 0.00 0.00 0.00 23.12 23.60 3cmb s ALA 188 CO 0.00 -0.57 1.12 -1.25 0.00 0.00 0.00 175.76 175.05 3cmb s PRO 189 N -2.65 2.79 0.28 0.00 0.04 -1.26 -4.33 135.00 129.86 3cmb s PRO 189 Ca -0.04 1.43 0.00 0.00 0.04 0.00 0.00 61.00 62.43 3cmb s PRO 189 Cb -0.01 -1.95 0.00 0.00 0.04 0.00 0.00 34.50 32.59 3cmb s PRO 189 CO -0.03 -1.27 0.00 0.41 0.04 0.00 0.00 177.00 176.15 3cmb n GLY 190 N -0.42 -2.26 3.69 0.56 0.00 -1.26 -4.72 105.19 100.78 3cmb n GLY 190 Ca 0.11 -1.85 -0.34 0.00 0.00 0.00 0.00 46.02 43.94 3cmb n GLY 190 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3cmb s ALA 191 N -1.48 3.30 -0.09 4.61 0.00 -1.26 -0.25 121.76 126.59 3cmb s ALA 191 Ca 0.00 -0.85 0.06 0.00 0.00 0.00 0.00 51.96 51.17 3cmb s ALA 191 Cb 0.00 -1.44 -0.24 0.00 0.00 0.00 0.00 23.12 21.44 3cmb s ALA 191 CO 0.00 0.61 0.50 -1.91 0.00 0.00 0.00 175.76 174.96 3cmb n GLU 192 N 1.87 0.68 -3.76 0.00 4.07 0.15 -4.60 120.64 119.05 3cmb n GLU 192 Ca -0.17 0.26 -0.14 0.00 -0.06 0.00 0.00 57.16 57.06 3cmb n GLU 192 Cb 0.53 -1.74 -0.14 0.00 -0.06 0.00 0.00 31.44 30.03 3cmb n GLU 192 CO 0.00 0.00 0.00 -1.17 -0.06 0.00 0.00 177.13 175.90 3cmb s LEU 193 N -6.40 0.83 -0.25 4.31 2.96 -0.97 -4.99 118.68 114.18 3cmb s LEU 193 Ca -0.12 0.27 -0.03 0.00 -0.22 0.00 0.00 54.13 54.03 3cmb s LEU 193 Cb 0.07 0.33 0.14 0.00 0.50 0.00 0.00 46.19 47.23 3cmb s LEU 193 CO 0.80 -0.14 0.44 -0.55 -1.32 0.00 0.00 176.35 175.58 3cmb s SER 194 N 1.06 -0.21 -0.06 3.68 0.15 -1.25 -0.86 113.70 116.22 3cmb s SER 194 Ca -0.08 0.50 -0.19 0.00 0.70 0.00 0.00 55.95 56.87 3cmb s SER 194 Cb -0.11 1.40 0.04 0.00 -1.71 0.00 0.00 66.02 65.64 3cmb s SER 194 CO -0.05 -0.28 0.43 0.00 1.20 0.00 0.00 173.24 174.54 3cmb s GLN 195 N 2.63 0.74 0.17 5.44 -2.07 -0.45 -5.02 119.66 121.09 3cmb s GLN 195 Ca 0.12 0.10 -0.09 0.00 -1.82 0.00 0.00 55.36 53.67 3cmb s GLN 195 Cb -0.15 0.34 -0.06 0.00 -1.09 0.00 0.00 33.01 32.05 3cmb s GLN 195 CO -0.17 -0.19 0.48 -0.06 -1.32 0.00 0.00 175.29 174.03 3cmb s PHE 196 N -0.95 3.49 0.00 9.60 0.08 -1.26 -0.88 117.98 128.07 3cmb s PHE 196 Ca -0.10 0.80 0.04 0.00 0.12 0.00 0.00 56.93 57.79 3cmb s PHE 196 Cb -0.03 -2.19 -0.01 0.00 -0.57 0.00 0.00 43.02 40.21 3cmb s PHE 196 CO 0.05 0.38 -0.12 0.08 -0.10 0.00 0.00 175.22 175.51 3cmb s VAL 197 N -1.65 0.93 -0.12 -0.44 1.01 -0.74 -1.30 120.40 118.10 3cmb s VAL 197 Ca 0.42 -0.63 -0.01 0.00 0.00 0.00 0.00 61.98 61.76 3cmb s VAL 197 Cb -0.12 -0.80 -0.02 0.00 0.00 0.00 0.00 36.38 35.43 3cmb s VAL 197 CO 0.21 0.17 -0.09 -0.22 0.00 0.00 0.00 175.10 175.17 3cmb s LEU 198 N -0.53 2.98 -0.42 3.92 2.96 0.11 -0.49 118.68 127.22 3cmb s LEU 198 Ca 0.03 -0.19 0.03 0.00 -0.22 0.00 0.00 54.13 53.78 3cmb s LEU 198 Cb -0.05 -1.68 0.12 0.00 0.50 0.00 0.00 46.19 45.08 3cmb s LEU 198 CO 0.00 0.23 0.17 -0.47 -1.32 0.00 0.00 176.35 174.96 3cmb s TYR 199 N 0.01 2.88 0.07 5.38 6.14 -0.06 -1.25 117.35 130.51 3cmb s TYR 199 Ca -0.02 -2.76 -0.31 0.00 0.64 0.00 0.00 57.07 54.62 3cmb s TYR 199 Cb -0.14 -2.49 -0.08 0.00 0.42 0.00 0.00 41.96 39.67 3cmb s TYR 199 CO 0.03 -0.83 1.57 -2.14 0.64 0.00 0.00 175.55 174.82 3cmb s PRO 200 N 0.46 4.23 0.00 4.97 0.02 -1.26 -2.60 135.00 140.82 3cmb s PRO 200 Ca 0.14 2.24 0.00 0.00 0.02 0.00 0.00 61.00 63.40 3cmb s PRO 200 Cb -0.22 -3.50 0.00 0.00 0.02 0.00 0.00 34.50 30.79 3cmb s PRO 200 CO -0.06 -0.66 0.00 0.00 -0.33 0.00 0.00 177.00 175.96 3cmb n GLN 201 N 5.18 0.00 0.00 5.54 10.64 -1.26 -4.66 117.38 132.82 3cmb n GLN 201 Ca 0.15 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.32 3cmb n GLN 201 Cb 0.41 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.79 3cmb n GLN 201 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 3cmb n GLY 202 N 0.00 0.26 3.12 2.61 0.00 -1.26 -4.00 105.19 105.91 3cmb n GLY 202 Ca 0.00 -1.87 -0.34 0.00 0.00 0.00 0.00 46.02 43.81 3cmb n GLY 202 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3cmb s GLU 204 N 0.00 2.16 0.13 1.61 2.02 0.12 -4.49 118.70 120.25 3cmb s GLU 204 Ca 0.00 -1.48 -0.30 0.00 0.02 0.00 0.00 54.97 53.20 3cmb s GLU 204 Cb 0.00 -3.20 -0.06 0.00 0.10 0.00 0.00 34.13 30.96 3cmb s GLU 204 CO 0.00 -0.75 1.07 0.08 0.02 0.00 0.00 175.26 175.68 3cmb s VAL 205 N 1.15 4.15 -0.18 2.63 1.01 -1.26 -1.74 120.40 126.16 3cmb s VAL 205 Ca -0.01 1.75 -0.05 0.00 0.00 0.00 0.00 61.98 63.68 3cmb s VAL 205 Cb -0.20 -4.12 -0.09 0.00 0.00 0.00 0.00 36.38 31.96 3cmb s VAL 205 CO -0.04 0.25 -0.20 -1.84 0.00 0.00 0.00 175.10 173.28 3cmb n GLU 206 N 2.85 0.40 -4.00 2.72 0.00 0.75 -4.94 120.64 118.42 3cmb n GLU 206 Ca 0.04 0.14 -0.08 0.00 0.00 0.00 0.00 57.16 57.26 3cmb n GLU 206 Cb 0.47 -1.23 -0.09 0.00 0.00 0.00 0.00 31.44 30.59 3cmb n GLU 206 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.13 178.08 3cmb s THR 207 N -2.34 0.19 -0.13 3.84 -4.23 -1.03 -5.03 115.64 106.91 3cmb s THR 207 Ca -0.24 -1.55 -0.29 0.00 -1.18 0.00 0.00 61.69 58.42 3cmb s THR 207 Cb 0.08 -1.40 0.08 0.00 1.34 0.00 0.00 72.50 72.60 3cmb s THR 207 CO 0.35 -0.86 0.75 0.00 -0.54 0.00 0.00 174.62 174.33 3cmb s ALA 208 N -3.78 -1.81 0.04 3.99 0.00 -1.26 -1.36 121.76 117.58 3cmb s ALA 208 Ca 0.05 1.56 0.06 0.00 0.00 0.00 0.00 51.96 53.63 3cmb s ALA 208 Cb 0.06 -0.47 -0.02 0.00 0.00 0.00 0.00 23.12 22.69 3cmb s ALA 208 CO -0.10 -0.35 -0.16 -1.21 0.00 0.00 0.00 175.76 173.94 3cmb s GLU 209 N -0.72 1.08 0.19 0.00 2.02 0.79 -0.86 118.70 121.21 3cmb s GLU 209 Ca -0.06 -0.80 0.05 0.00 0.02 0.00 0.00 54.97 54.18 3cmb s GLU 209 Cb -0.02 -1.12 -0.04 0.00 0.10 0.00 0.00 34.13 33.05 3cmb s GLU 209 CO 0.06 0.28 0.22 0.54 0.02 0.00 0.00 175.26 176.38 3cmb s VAL 210 N -0.80 4.81 0.00 2.63 0.11 0.23 -1.05 120.40 126.32 3cmb s VAL 210 Ca 0.04 -1.05 0.00 0.00 -2.93 0.00 0.00 61.98 58.04 3cmb s VAL 210 Cb -0.08 -3.52 0.00 0.00 -1.53 0.00 0.00 36.38 31.25 3cmb s VAL 210 CO 0.01 -0.20 0.00 0.61 -3.33 0.00 0.00 175.10 172.19 3cmb n GLY 211 N -0.77 0.52 3.50 6.54 0.00 -1.06 -0.74 105.19 113.18 3cmb n GLY 211 Ca -0.08 -0.72 -0.41 0.00 0.00 0.00 0.00 46.02 44.81 3cmb n GLY 211 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3cmb s LYS 212 N -0.88 3.38 0.05 1.61 1.02 0.68 -4.59 119.74 121.00 3cmb s LYS 212 Ca 0.00 -0.72 0.02 0.00 0.02 0.00 0.00 55.97 55.29 3cmb s LYS 212 Cb 0.00 -3.81 -0.04 0.00 -0.52 0.00 0.00 37.83 33.47 3cmb s LYS 212 CO 0.00 -0.50 0.08 0.20 -0.92 0.00 0.00 175.35 174.21 3cmb s GLY 213 N 1.70 2.02 -0.04 -3.33 0.00 -1.26 -0.26 107.32 106.14 3cmb s GLY 213 Ca 0.06 -0.97 -0.18 0.00 0.00 0.00 0.00 44.72 43.62 3cmb s GLY 213 CO 0.10 -0.92 0.41 -1.35 0.00 0.00 0.00 173.10 171.33 3cmb s SER 214 N -2.19 -0.33 0.02 1.64 1.04 -0.34 -4.90 113.70 108.65 3cmb s SER 214 Ca 0.27 0.33 -0.05 0.00 0.48 0.00 0.00 55.95 56.99 3cmb s SER 214 Cb -0.12 0.44 -0.01 0.00 0.10 0.00 0.00 66.02 66.43 3cmb s SER 214 CO 0.20 -0.44 0.07 -1.48 0.98 0.00 0.00 173.24 172.57 3cmb s LEU 215 N -1.08 1.84 -0.08 2.42 2.34 -1.26 -0.56 118.68 122.30 3cmb s LEU 215 Ca -0.11 -0.40 -0.04 0.00 0.06 0.00 0.00 54.13 53.64 3cmb s LEU 215 Cb -0.04 0.48 0.04 0.00 -0.56 0.00 0.00 46.19 46.11 3cmb s LEU 215 CO 0.05 -0.39 0.18 -0.75 -1.06 0.00 0.00 176.35 174.38 3cmb s LYS 216 N -1.79 0.15 0.02 1.48 2.20 -0.48 -5.00 119.74 116.31 3cmb s LYS 216 Ca -0.12 0.40 -0.01 0.00 -0.36 0.00 0.00 55.97 55.88 3cmb s LYS 216 Cb -0.06 -0.11 -0.04 0.00 -1.51 0.00 0.00 37.83 36.11 3cmb s LYS 216 CO -0.01 -0.14 0.14 -1.58 -0.36 0.00 0.00 175.35 173.41 3cmb s TRP 217 N 1.00 3.42 -0.20 4.03 0.52 -1.26 -1.04 118.94 125.41 3cmb s TRP 217 Ca -0.07 0.25 0.01 0.00 0.02 0.00 0.00 56.10 56.31 3cmb s TRP 217 Cb -0.09 -1.76 0.05 0.00 -1.15 0.00 0.00 33.47 30.51 3cmb s TRP 217 CO -0.06 0.59 -0.09 0.99 0.02 0.00 0.00 176.95 178.40 3cmb s THR 218 N -1.34 1.62 0.40 2.01 2.01 -0.60 -4.99 115.64 114.76 3cmb s THR 218 Ca 0.28 -1.04 -0.27 0.00 0.31 0.00 0.00 61.69 60.97 3cmb s THR 218 Cb -0.12 -1.73 -0.09 0.00 0.01 0.00 0.00 72.50 70.57 3cmb s THR 218 CO 0.20 0.12 1.38 -1.61 -0.69 0.00 0.00 174.62 174.03 3cmb s GLU 219 N 1.40 3.97 0.19 4.92 2.02 -1.26 -4.56 118.70 125.37 3cmb s GLU 219 Ca -0.02 2.34 0.09 0.00 0.02 0.00 0.00 54.97 57.41 3cmb s GLU 219 Cb -0.17 -2.82 -0.04 0.00 0.10 0.00 0.00 34.13 31.20 3cmb s GLU 219 CO -0.08 -0.56 -0.12 -0.51 0.02 0.00 0.00 175.26 174.01 3cmb s LEU 220 N -2.35 2.86 0.38 1.80 1.43 -1.26 -5.06 118.68 116.47 3cmb s LEU 220 Ca 0.56 -0.65 0.04 0.00 -1.03 0.00 0.00 54.13 53.05 3cmb s LEU 220 Cb -0.42 -1.55 -0.01 0.00 0.03 0.00 0.00 46.19 44.25 3cmb s LEU 220 CO 0.55 0.10 0.54 0.42 0.23 0.00 0.00 176.35 178.19 3cmb s THR 221 N -1.74 4.08 0.00 5.49 -4.23 -1.26 -4.87 115.64 113.11 3cmb s THR 221 Ca 0.24 -0.81 0.00 0.00 -1.18 0.00 0.00 61.69 59.94 3cmb s THR 221 Cb -0.08 -3.45 0.00 0.00 1.34 0.00 0.00 72.50 70.31 3cmb s THR 221 CO 0.14 -0.22 0.00 -2.65 -0.54 0.00 0.00 174.62 171.35 3cmb n PRO 222 N -1.80 0.00 0.00 3.99 -0.02 -1.26 -1.58 135.00 134.33 3cmb n PRO 222 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 3cmb n PRO 222 Cb 0.58 -1.44 0.00 0.00 -0.02 0.00 0.00 33.50 32.62 3cmb n PRO 222 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 3cmb n GLN 224 N 1.48 0.00 -3.09 -0.52 6.02 -1.26 -1.91 117.38 118.10 3cmb n GLN 224 Ca 0.00 0.00 -0.17 0.00 -0.01 0.00 0.00 57.00 56.82 3cmb n GLN 224 Cb 0.00 0.00 -0.05 0.00 1.02 0.00 0.00 30.24 31.21 3cmb n GLN 224 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 3cmb n SER 225 N 0.00 -1.75 0.26 1.08 2.88 -0.62 -4.73 113.62 110.74 3cmb n SER 225 Ca 0.00 -2.67 0.11 0.00 -1.33 0.00 0.00 58.87 54.99 3cmb n SER 225 Cb 0.00 0.49 0.71 0.00 -0.75 0.00 0.00 64.21 64.66 3cmb n SER 225 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 3cmb h PRO 226 N 5.16 0.00 -0.01 -1.46 0.13 -1.61 0.12 132.00 134.34 3cmb h PRO 226 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 3cmb h PRO 226 Cb 0.99 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.12 3cmb h PRO 226 CO 0.23 0.11 -0.54 0.00 -0.23 0.00 0.00 178.00 177.58 3cmb n ALA 227 N -2.34 3.66 -0.49 -0.56 0.00 -1.26 -4.62 120.51 114.91 3cmb n ALA 227 Ca -0.02 -0.56 0.00 0.00 0.00 0.00 0.00 53.44 52.86 3cmb n ALA 227 Cb 0.21 -0.66 0.00 0.00 0.00 0.00 0.00 19.45 19.00 3cmb n ALA 227 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3cmb n GLN 228 N -0.50 0.41 -0.20 0.00 6.02 -1.00 -4.87 117.38 117.23 3cmb n GLN 228 Ca 0.06 -0.11 0.13 0.00 -0.01 0.00 0.00 57.00 57.07 3cmb n GLN 228 Cb 0.36 -0.51 0.44 0.00 1.02 0.00 0.00 30.24 31.55 3cmb n GLN 228 CO 0.00 0.00 0.00 0.10 -1.01 0.00 0.00 177.06 176.15 3cmb h TYR 229 N 0.00 0.64 0.00 1.08 -0.00 -1.02 -0.05 116.97 117.62 3cmb h TYR 229 Ca 0.00 0.02 0.00 0.00 -0.00 0.00 0.00 58.73 58.75 3cmb h TYR 229 Cb 0.24 -0.20 0.00 0.00 -0.00 0.00 0.00 36.73 36.77 3cmb h TYR 229 CO 0.00 0.25 0.00 0.10 -0.00 0.00 0.00 178.16 178.51 3cmb h TYR 230 N 0.55 0.00 0.04 0.10 -0.00 -1.89 0.01 116.97 115.78 3cmb h TYR 230 Ca 0.39 0.00 -0.00 0.00 -0.00 0.00 0.00 58.73 59.12 3cmb h TYR 230 Cb 0.74 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.47 3cmb h TYR 230 CO -0.00 0.00 -0.02 0.82 -0.00 0.00 0.00 178.16 178.96 3cmb h ILE 231 N 0.00 1.14 -0.66 -0.90 2.04 -1.38 -1.76 117.51 115.98 3cmb h ILE 231 Ca 0.00 -1.66 0.12 0.00 1.00 0.00 0.00 64.86 64.31 3cmb h ILE 231 Cb 0.85 2.07 -0.08 0.00 -0.74 0.00 0.00 36.82 38.92 3cmb h ILE 231 CO 0.00 0.36 0.23 0.58 0.00 0.00 0.00 178.15 179.31 3cmb h VAL 232 N -0.93 0.69 -0.03 1.67 2.07 -1.26 -1.10 116.25 117.35 3cmb h VAL 232 Ca -0.01 -0.13 -0.17 0.00 0.82 0.00 0.00 66.70 67.21 3cmb h VAL 232 Cb 0.63 0.28 -0.01 0.00 -1.52 0.00 0.00 31.29 30.66 3cmb h VAL 232 CO 0.01 0.07 -0.73 0.78 0.02 0.00 0.00 177.57 177.72 3cmb h ASN 233 N 0.38 0.26 0.07 0.57 2.35 -1.04 -0.32 115.58 117.85 3cmb h ASN 233 Ca 0.35 -0.18 -0.00 0.00 -0.55 0.00 0.00 56.30 55.92 3cmb h ASN 233 Cb 0.49 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 38.79 3cmb h ASN 233 CO -0.37 0.90 -0.03 0.28 -1.65 0.00 0.00 177.43 176.56 3cmb h SER 234 N 0.14 -0.08 -0.53 5.81 0.02 -1.00 -2.29 113.55 115.62 3cmb h SER 234 Ca -0.02 -0.04 -0.04 0.00 -0.84 0.00 0.00 61.79 60.84 3cmb h SER 234 Cb 1.30 0.02 -0.03 0.00 0.14 0.00 0.00 62.40 63.83 3cmb h SER 234 CO 0.11 -0.01 0.19 -0.07 -1.14 0.00 0.00 176.83 175.91 3cmb h LEU 235 N -0.14 0.80 -1.75 5.07 3.38 -0.87 -2.11 115.31 119.67 3cmb h LEU 235 Ca -0.01 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 57.82 3cmb h LEU 235 Cb 0.12 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.66 3cmb h LEU 235 CO 0.02 0.75 -0.09 0.00 0.09 0.00 0.00 178.44 179.20 3cmb h ALA 236 N 1.36 1.10 0.00 1.53 0.00 -0.95 -2.32 119.26 119.99 3cmb h ALA 236 Ca 0.19 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3cmb h ALA 236 Cb 0.23 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.01 3cmb h ALA 236 CO -0.01 0.11 -0.03 -1.13 0.00 0.00 0.00 179.25 178.19 3cmb n SER 237 N -3.34 0.49 -4.55 0.00 3.41 -0.80 -4.66 113.62 104.17 3cmb n SER 237 Ca -0.01 0.52 -0.42 0.00 -0.26 0.00 0.00 58.87 58.69 3cmb n SER 237 Cb 0.28 -0.63 -0.03 0.00 -0.26 0.00 0.00 64.21 63.56 3cmb n SER 237 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3cmb s LEU 238 N -3.90 3.78 0.34 1.04 1.43 -0.88 -4.99 118.68 115.50 3cmb s LEU 238 Ca 0.12 -0.16 -0.29 0.00 -1.03 0.00 0.00 54.13 52.77 3cmb s LEU 238 Cb 0.15 -2.96 -0.11 0.00 0.03 0.00 0.00 46.19 43.30 3cmb s LEU 238 CO 0.58 -1.37 1.51 -2.84 0.23 0.00 0.00 176.35 174.46 3cmb s PRO 239 N 4.47 4.13 -0.85 1.29 0.02 -1.26 -4.89 135.00 137.91 3cmb s PRO 239 Ca 0.36 2.54 -0.19 0.00 0.02 0.00 0.00 61.00 63.74 3cmb s PRO 239 Cb -0.10 -3.00 0.13 0.00 0.02 0.00 0.00 34.50 31.55 3cmb s PRO 239 CO 0.22 -0.55 1.02 0.42 -0.33 0.00 0.00 177.00 177.78 3cmb s ILE 240 N -0.65 4.81 0.07 2.83 1.01 -1.26 -4.11 121.20 123.90 3cmb s ILE 240 Ca 0.57 -1.51 -0.09 0.00 0.00 0.00 0.00 60.65 59.61 3cmb s ILE 240 Cb -0.46 -4.70 -0.28 0.00 0.01 0.00 0.00 42.46 37.02 3cmb s ILE 240 CO 0.56 -1.40 1.13 0.11 0.00 0.00 0.00 174.94 175.34 3cmb h LYS 241 N 8.81 0.45 -2.09 2.79 1.57 -0.96 -3.46 116.57 123.67 3cmb h LYS 241 Ca 0.06 -0.66 -0.03 0.00 -1.87 0.00 0.00 60.65 58.15 3cmb h LYS 241 Cb 1.04 0.23 -0.22 0.00 0.08 0.00 0.00 32.23 33.36 3cmb h LYS 241 CO 1.07 1.29 0.04 0.50 -0.57 0.00 0.00 179.45 181.78 3cmb s ARG 242 N -2.85 0.74 -0.41 3.15 3.52 -1.22 -4.99 118.95 116.90 3cmb s ARG 242 Ca -0.07 1.04 -0.24 0.00 -0.13 0.00 0.00 55.73 56.32 3cmb s ARG 242 Cb 0.06 0.28 0.02 0.00 -1.56 0.00 0.00 34.95 33.75 3cmb s ARG 242 CO 0.91 -0.12 0.86 0.08 -0.81 0.00 0.00 175.30 176.22 3cmb s VAL 243 N 0.86 4.60 -0.31 7.11 1.01 -1.26 -0.75 120.40 131.65 3cmb s VAL 243 Ca -0.04 0.83 0.22 0.00 0.00 0.00 0.00 61.98 62.99 3cmb s VAL 243 Cb -0.05 -4.33 -0.21 0.00 0.00 0.00 0.00 36.38 31.79 3cmb s VAL 243 CO -0.07 -0.63 0.76 0.35 0.00 0.00 0.00 175.10 175.51 3cmb n THR 244 N 6.09 0.16 -3.71 3.92 -2.24 0.60 -4.91 114.28 114.19 3cmb n THR 244 Ca 0.05 -0.39 -0.14 0.00 -2.27 0.00 0.00 64.05 61.30 3cmb n THR 244 Cb 0.48 0.09 -0.09 0.00 -2.10 0.00 0.00 70.33 68.71 3cmb n THR 244 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 3cmb s GLN 245 N -3.36 0.58 -0.25 -0.78 0.74 -1.16 -4.95 119.66 110.48 3cmb s GLN 245 Ca -0.02 0.52 -0.02 0.00 0.05 0.00 0.00 55.36 55.89 3cmb s GLN 245 Cb 0.13 0.28 0.13 0.00 1.10 0.00 0.00 33.01 34.65 3cmb s GLN 245 CO 0.86 -0.09 0.35 0.00 -0.55 0.00 0.00 175.29 175.86 3cmb s ALA 246 N -0.01 -0.93 0.02 1.58 0.00 -1.25 -1.48 121.76 119.69 3cmb s ALA 246 Ca -0.02 0.56 0.01 0.00 0.00 0.00 0.00 51.96 52.51 3cmb s ALA 246 Cb -0.03 -1.72 -0.02 0.00 0.00 0.00 0.00 23.12 21.35 3cmb s ALA 246 CO 0.02 -1.40 -0.05 0.14 0.00 0.00 0.00 175.76 174.47 3cmb s VAL 247 N 2.49 0.31 -0.20 0.00 -7.23 -0.53 -2.55 120.40 112.70 3cmb s VAL 247 Ca 0.11 -0.78 0.01 0.00 -1.81 0.00 0.00 61.98 59.51 3cmb s VAL 247 Cb -0.15 -0.38 0.04 0.00 0.56 0.00 0.00 36.38 36.45 3cmb s VAL 247 CO -0.20 -0.31 -0.10 -0.22 -0.31 0.00 0.00 175.10 173.96 3cmb s LEU 248 N -1.16 2.34 0.08 1.32 2.96 -0.22 -0.66 118.68 123.35 3cmb s LEU 248 Ca -0.09 -0.92 0.08 0.00 -0.22 0.00 0.00 54.13 52.98 3cmb s LEU 248 Cb -0.08 -1.25 -0.03 0.00 0.50 0.00 0.00 46.19 45.33 3cmb s LEU 248 CO -0.00 -0.15 -0.22 0.68 -1.32 0.00 0.00 176.35 175.34 3cmb s VAL 249 N 1.38 1.76 0.08 1.68 -7.23 0.15 -0.15 120.40 118.07 3cmb s VAL 249 Ca -0.02 -1.42 0.04 0.00 -1.81 0.00 0.00 61.98 58.77 3cmb s VAL 249 Cb -0.16 -1.56 -0.03 0.00 0.56 0.00 0.00 36.38 35.18 3cmb s VAL 249 CO -0.08 0.08 -0.10 -0.70 -0.31 0.00 0.00 175.10 173.98 3cmb s GLU 250 N -1.60 0.79 0.00 4.82 2.56 -0.47 -0.82 118.70 123.98 3cmb s GLU 250 Ca 0.08 -1.05 0.00 0.00 0.00 0.00 0.00 54.97 53.99 3cmb s GLU 250 Cb -0.10 -0.54 0.00 0.00 2.00 0.00 0.00 34.13 35.50 3cmb s GLU 250 CO 0.03 0.09 0.00 0.41 -0.56 0.00 0.00 175.26 175.24 3cmb n GLY 251 N 0.83 -0.63 3.45 -1.50 0.00 -0.36 -0.18 105.19 106.81 3cmb n GLY 251 Ca -0.18 0.01 -0.10 0.00 0.00 0.00 0.00 46.02 45.74 3cmb n GLY 251 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3cmb s ARG 252 N -0.34 1.40 -0.01 1.61 1.70 -0.71 -1.37 118.95 121.23 3cmb s ARG 252 Ca 0.00 -1.35 0.03 0.00 -0.47 0.00 0.00 55.73 53.94 3cmb s ARG 252 Cb 0.00 0.40 -0.01 0.00 -0.57 0.00 0.00 34.95 34.78 3cmb s ARG 252 CO 0.00 -0.54 -0.10 0.00 -1.08 0.00 0.00 175.30 173.57 3cmb s ALA 253 N -4.05 0.87 -0.31 7.88 0.00 -0.04 0.13 121.76 126.23 3cmb s ALA 253 Ca 0.27 -0.43 -0.01 0.00 0.00 0.00 0.00 51.96 51.79 3cmb s ALA 253 Cb 0.02 -0.24 0.10 0.00 0.00 0.00 0.00 23.12 23.00 3cmb s ALA 253 CO 0.09 0.20 0.10 0.42 0.00 0.00 0.00 175.76 176.57 3cmb s ILE 254 N -0.15 0.83 -0.12 0.00 1.01 -1.25 -2.41 121.20 119.10 3cmb s ILE 254 Ca 0.02 -1.38 -0.01 0.00 0.00 0.00 0.00 60.65 59.28 3cmb s ILE 254 Cb -0.05 -1.63 -0.02 0.00 0.01 0.00 0.00 42.46 40.76 3cmb s ILE 254 CO -0.00 -0.69 -0.08 -0.76 0.00 0.00 0.00 174.94 173.41 3cmb s LEU 255 N 1.62 3.03 -0.73 2.97 1.43 0.81 -4.96 118.68 122.85 3cmb s LEU 255 Ca 0.10 -0.17 -0.21 0.00 -1.03 0.00 0.00 54.13 52.81 3cmb s LEU 255 Cb -0.17 -1.69 0.09 0.00 0.03 0.00 0.00 46.19 44.44 3cmb s LEU 255 CO -0.25 0.22 1.00 -0.13 0.23 0.00 0.00 176.35 177.42 3cmb s ARG 256 N 0.02 3.24 0.00 1.70 0.52 -1.26 -0.77 118.95 122.40 3cmb s ARG 256 Ca -0.02 -1.11 0.00 0.00 -0.52 0.00 0.00 55.73 54.09 3cmb s ARG 256 Cb -0.14 -4.44 0.00 0.00 0.52 0.00 0.00 34.95 30.89 3cmb s ARG 256 CO 0.03 -1.80 0.40 0.00 0.02 0.00 0.00 175.30 173.95 3cmb n ALA 257 N 7.37 1.98 0.00 2.13 0.00 -0.38 -4.21 120.51 127.40 3cmb n ALA 257 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.48 3cmb n ALA 257 Cb 0.46 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.46 3cmb n ALA 257 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3cmb n GLY 259 N 1.48 0.00 3.77 0.00 0.00 -1.26 -4.99 105.19 104.18 3cmb n GLY 259 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 3cmb n GLY 259 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3cmb s ALA 260 N -0.74 3.36 0.02 4.61 0.00 -1.26 -4.59 121.76 123.16 3cmb s ALA 260 Ca 0.00 1.39 -0.10 0.00 0.00 0.00 0.00 51.96 53.24 3cmb s ALA 260 Cb 0.00 -3.55 0.01 0.00 0.00 0.00 0.00 23.12 19.58 3cmb s ALA 260 CO 0.00 -0.96 0.21 -0.98 0.00 0.00 0.00 175.76 174.02 3cmb s ARG 261 N -2.21 0.65 0.18 0.00 1.70 -0.38 -5.00 118.95 113.88 3cmb s ARG 261 Ca 0.56 -0.50 -0.30 0.00 -0.47 0.00 0.00 55.73 55.02 3cmb s ARG 261 Cb -0.42 0.27 -0.08 0.00 -0.57 0.00 0.00 34.95 34.15 3cmb s ARG 261 CO 0.55 -0.18 1.28 0.08 -1.08 0.00 0.00 175.30 175.95 3cmb s VAL 262 N -2.09 3.37 0.05 4.99 1.01 -1.26 -0.71 120.40 125.77 3cmb s VAL 262 Ca -0.09 1.11 0.06 0.00 0.00 0.00 0.00 61.98 63.06 3cmb s VAL 262 Cb -0.03 -3.71 -0.04 0.00 0.00 0.00 0.00 36.38 32.60 3cmb s VAL 262 CO -0.01 0.15 -0.11 0.27 0.00 0.00 0.00 175.10 175.40 3cmb s ILE 263 N 0.24 3.31 0.00 2.22 -4.36 -0.42 -4.90 121.20 117.29 3cmb s ILE 263 Ca 0.57 -1.07 0.00 0.00 -0.26 0.00 0.00 60.65 59.88 3cmb s ILE 263 Cb -0.35 -2.47 0.00 0.00 1.25 0.00 0.00 42.46 40.89 3cmb s ILE 263 CO 0.36 0.27 0.00 -0.62 0.24 0.00 0.00 174.94 175.19