#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3m1a s ALA 5 N 0.00 3.48 0.06 -1.46 0.00 -1.26 -5.04 121.76 117.55 3m1a s ALA 5 Ca 0.00 1.03 0.01 0.00 0.00 0.00 0.00 51.96 53.00 3m1a s ALA 5 Cb 0.00 -3.45 -0.04 0.00 0.00 0.00 0.00 23.12 19.63 3m1a s ALA 5 CO 0.00 -0.46 0.16 0.15 0.00 0.00 0.00 175.76 175.61 3m1a s LYS 6 N -0.11 3.25 -0.29 0.00 1.02 -1.26 -4.93 119.74 117.42 3m1a s LYS 6 Ca 0.55 -0.52 -0.14 0.00 0.02 0.00 0.00 55.97 55.89 3m1a s LYS 6 Cb -0.35 -2.94 -0.04 0.00 -0.52 0.00 0.00 37.83 33.99 3m1a s LYS 6 CO 0.37 0.60 0.31 0.08 -0.92 0.00 0.00 175.35 175.79 3m1a s VAL 7 N -1.46 5.22 -0.20 3.17 1.01 -1.26 -1.34 120.40 125.54 3m1a s VAL 7 Ca 0.33 0.35 -0.07 0.00 0.00 0.00 0.00 61.98 62.58 3m1a s VAL 7 Cb -0.13 -3.66 -0.04 0.00 0.00 0.00 0.00 36.38 32.55 3m1a s VAL 7 CO 0.25 0.15 0.07 0.26 0.00 0.00 0.00 175.10 175.83 3m1a s TRP 8 N 1.96 3.22 -0.26 5.22 0.52 0.29 -0.56 118.94 129.32 3m1a s TRP 8 Ca 0.12 -0.01 -0.06 0.00 0.02 0.00 0.00 56.10 56.17 3m1a s TRP 8 Cb -0.16 -2.11 -0.01 0.00 -1.15 0.00 0.00 33.47 30.04 3m1a s TRP 8 CO 0.11 0.06 0.04 -1.17 0.02 0.00 0.00 176.95 176.00 3m1a s LEU 9 N 0.62 3.43 -0.24 2.99 2.96 -0.14 -0.27 118.68 128.03 3m1a s LEU 9 Ca 0.03 -0.49 0.01 0.00 -0.22 0.00 0.00 54.13 53.47 3m1a s LEU 9 Cb -0.13 -1.84 0.04 0.00 0.50 0.00 0.00 46.19 44.76 3m1a s LEU 9 CO 0.01 -0.10 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.15 3m1a s VAL 10 N 1.52 2.37 0.46 1.68 1.01 0.04 -0.81 120.40 126.67 3m1a s VAL 10 Ca 0.04 -1.34 -0.20 0.00 0.00 0.00 0.00 61.98 60.48 3m1a s VAL 10 Cb -0.16 -2.27 -0.10 0.00 0.00 0.00 0.00 36.38 33.86 3m1a s VAL 10 CO 0.01 0.13 0.98 0.42 0.00 0.00 0.00 175.10 176.64 3m1a s THR 11 N 1.20 4.25 -1.17 3.92 -4.23 -0.06 -1.12 115.64 118.44 3m1a s THR 11 Ca -0.04 1.34 -0.05 0.00 -1.18 0.00 0.00 61.69 61.75 3m1a s THR 11 Cb -0.18 -3.57 0.01 0.00 1.34 0.00 0.00 72.50 70.10 3m1a s THR 11 CO -0.06 -0.36 1.01 0.61 -0.54 0.00 0.00 174.62 175.27 3m1a n GLY 12 N -0.70 -0.35 0.13 3.99 0.00 -0.84 -2.64 105.19 104.77 3m1a n GLY 12 Ca 0.08 0.12 0.13 0.00 0.00 0.00 0.00 46.02 46.34 3m1a n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m1a h ALA 13 N 0.87 1.00 -0.00 4.61 0.00 -1.19 -3.30 119.26 121.25 3m1a h ALA 13 Ca -0.51 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.40 3m1a h ALA 13 Cb 1.32 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.11 3m1a h ALA 13 CO 0.48 0.00 -0.05 -1.13 0.00 0.00 0.00 179.25 178.56 3m1a n SER 14 N -2.32 0.06 -3.83 0.00 3.41 -1.26 -2.58 113.62 107.09 3m1a n SER 14 Ca 0.04 0.32 -0.09 0.00 -0.26 0.00 0.00 58.87 58.88 3m1a n SER 14 Cb 0.33 -0.40 -0.07 0.00 -0.26 0.00 0.00 64.21 63.82 3m1a n SER 14 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3m1a s SER 15 N -2.93 0.02 0.98 4.04 1.04 -1.24 -4.80 113.70 110.80 3m1a s SER 15 Ca 0.16 -0.63 0.00 0.00 0.48 0.00 0.00 55.95 55.96 3m1a s SER 15 Cb 0.19 0.40 0.00 0.00 0.10 0.00 0.00 66.02 66.71 3m1a s SER 15 CO 0.53 -0.80 0.00 0.61 0.98 0.00 0.00 173.24 174.56 3m1a n GLY 16 N -0.14 2.50 0.36 7.32 0.00 -0.56 -2.33 105.19 112.35 3m1a n GLY 16 Ca -0.13 -0.42 0.06 0.00 0.00 0.00 0.00 46.02 45.53 3m1a n GLY 16 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 3m1a h PHE 17 N 0.00 0.89 -0.13 1.61 0.05 -1.90 -2.23 116.94 115.23 3m1a h PHE 17 Ca 0.00 0.02 0.01 0.00 3.82 0.00 0.00 57.97 61.82 3m1a h PHE 17 Cb 0.00 -0.29 -0.01 0.00 2.00 0.00 0.00 35.95 37.65 3m1a h PHE 17 CO 0.00 0.45 0.05 0.78 -0.18 0.00 0.00 178.31 179.41 3m1a h GLY 18 N 0.86 0.15 0.92 -1.45 0.00 -1.65 0.26 103.07 102.17 3m1a h GLY 18 Ca 0.36 -0.03 0.00 0.00 0.00 0.00 0.00 47.33 47.66 3m1a h GLY 18 CO -0.13 0.03 -0.04 -0.09 0.00 0.00 0.00 176.54 176.30 3m1a h ARG 19 N 0.11 -0.07 -0.87 4.80 2.43 -1.19 0.41 114.38 120.01 3m1a h ARG 19 Ca 0.05 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.22 3m1a h ARG 19 Cb 0.02 0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 29.55 3m1a h ARG 19 CO -0.05 -0.05 0.52 0.00 -1.51 0.00 0.00 179.97 178.88 3m1a h ALA 20 N 0.91 1.11 -0.30 2.80 0.00 -1.25 -1.26 119.26 121.26 3m1a h ALA 20 Ca 0.01 -0.10 -0.12 0.00 0.00 0.00 0.00 54.91 54.70 3m1a h ALA 20 Cb 0.08 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 3m1a h ALA 20 CO -0.03 0.58 -0.28 0.82 0.00 0.00 0.00 179.25 180.34 3m1a h ILE 21 N 1.20 1.30 -0.84 0.00 2.04 -0.37 -1.73 117.51 119.11 3m1a h ILE 21 Ca 0.31 -1.45 0.02 0.00 1.00 0.00 0.00 64.86 64.74 3m1a h ILE 21 Cb -0.04 1.54 -0.04 0.00 -0.74 0.00 0.00 36.82 37.54 3m1a h ILE 21 CO -0.06 0.47 0.55 0.00 0.00 0.00 0.00 178.15 179.11 3m1a h ALA 22 N 0.72 1.08 -0.42 1.87 0.00 -0.65 -1.64 119.26 120.22 3m1a h ALA 22 Ca 0.05 -0.05 -0.14 0.00 0.00 0.00 0.00 54.91 54.77 3m1a h ALA 22 Cb 0.85 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 3m1a h ALA 22 CO 0.07 0.44 -0.30 0.93 0.00 0.00 0.00 179.25 180.39 3m1a h GLU 23 N 1.11 0.92 -0.53 0.00 5.08 -1.18 -2.67 114.58 117.32 3m1a h GLU 23 Ca 0.32 -0.43 -0.10 0.00 -1.00 0.00 0.00 59.36 58.14 3m1a h GLU 23 Cb -0.08 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.14 3m1a h GLU 23 CO -0.08 1.09 -0.08 0.00 -1.00 0.00 0.00 179.01 178.94 3m1a h ALA 24 N 0.88 0.86 0.08 3.43 0.00 -1.12 -1.59 119.26 121.79 3m1a h ALA 24 Ca 0.09 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.67 3m1a h ALA 24 Cb 0.87 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 3m1a h ALA 24 CO 0.08 0.65 -0.07 0.00 0.00 0.00 0.00 179.25 179.91 3m1a h ALA 25 N 1.03 -0.13 -0.46 0.00 0.00 -1.25 -1.72 119.26 116.72 3m1a h ALA 25 Ca 0.14 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.92 3m1a h ALA 25 Cb 0.62 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 3m1a h ALA 25 CO 0.04 -0.58 -0.16 -0.39 0.00 0.00 0.00 179.25 178.16 3m1a h VAL 26 N -0.15 1.27 -0.01 0.00 -1.51 -1.45 -1.18 116.25 113.22 3m1a h VAL 26 Ca 0.00 -1.28 -0.03 0.00 -1.23 0.00 0.00 66.70 64.16 3m1a h VAL 26 Cb 0.14 1.09 -0.00 0.00 -2.13 0.00 0.00 31.29 30.39 3m1a h VAL 26 CO -0.01 0.44 -0.12 0.00 -1.23 0.00 0.00 177.57 176.65 3m1a h ALA 27 N 1.04 1.78 -0.05 5.19 0.00 -1.23 -1.53 119.26 124.47 3m1a h ALA 27 Ca 0.12 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3m1a h ALA 27 Cb 0.69 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.46 3m1a h ALA 27 CO 0.05 0.16 0.00 0.00 0.00 0.00 0.00 179.25 179.47 3m1a n ALA 28 N -2.51 2.59 -0.08 0.00 0.00 -0.65 -4.91 120.51 114.95 3m1a n ALA 28 Ca -0.02 -0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.07 3m1a n ALA 28 Cb 0.20 -1.26 0.00 0.00 0.00 0.00 0.00 19.45 18.39 3m1a n ALA 28 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3m1a n GLY 29 N 1.05 0.50 3.78 0.00 0.00 -0.57 -5.07 105.19 104.87 3m1a n GLY 29 Ca 0.18 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 3m1a n GLY 29 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3m1a s ASP 30 N -2.85 3.76 -0.14 1.61 -0.00 -0.49 -4.83 116.67 113.73 3m1a s ASP 30 Ca 0.00 1.10 -0.06 0.00 -0.00 0.00 0.00 52.55 53.59 3m1a s ASP 30 Cb 0.00 -1.73 -0.04 0.00 -0.00 0.00 0.00 42.92 41.15 3m1a s ASP 30 CO 0.00 -2.41 0.08 -0.89 -0.00 0.00 0.00 175.17 171.95 3m1a s THR 31 N -3.21 4.93 -0.05 -1.27 2.01 -0.45 -4.24 115.64 113.36 3m1a s THR 31 Ca 0.63 0.00 0.03 0.00 0.31 0.00 0.00 61.69 62.66 3m1a s THR 31 Cb -0.15 -3.17 0.01 0.00 0.01 0.00 0.00 72.50 69.20 3m1a s THR 31 CO 0.54 0.54 -0.13 -0.69 -0.69 0.00 0.00 174.62 174.19 3m1a s VAL 32 N -0.37 1.14 -0.28 3.82 1.01 0.15 -0.55 120.40 125.32 3m1a s VAL 32 Ca 0.10 -0.52 -0.06 0.00 0.00 0.00 0.00 61.98 61.50 3m1a s VAL 32 Cb -0.12 -1.01 0.01 0.00 0.00 0.00 0.00 36.38 35.25 3m1a s VAL 32 CO 0.02 0.35 0.05 -0.63 0.00 0.00 0.00 175.10 174.88 3m1a s ILE 33 N 0.39 3.80 -0.05 2.22 1.09 0.63 -1.30 121.20 127.97 3m1a s ILE 33 Ca -0.09 -0.68 -0.00 0.00 -1.10 0.00 0.00 60.65 58.78 3m1a s ILE 33 Cb -0.13 -2.92 -0.03 0.00 -1.06 0.00 0.00 42.46 38.31 3m1a s ILE 33 CO 0.03 0.14 -0.00 -0.83 -0.10 0.00 0.00 174.94 174.18 3m1a s GLY 34 N 1.48 1.85 0.13 6.18 0.00 -0.01 -0.78 107.32 116.18 3m1a s GLY 34 Ca 0.03 -0.87 0.10 0.00 0.00 0.00 0.00 44.72 43.98 3m1a s GLY 34 CO 0.01 -0.67 -0.20 -0.51 0.00 0.00 0.00 173.10 171.72 3m1a s THR 35 N -0.96 2.67 0.14 0.90 -4.23 -0.27 -1.04 115.64 112.84 3m1a s THR 35 Ca 0.16 -1.63 -0.24 0.00 -1.18 0.00 0.00 61.69 58.79 3m1a s THR 35 Cb -0.11 -2.23 0.07 0.00 1.34 0.00 0.00 72.50 71.57 3m1a s THR 35 CO 0.05 0.06 0.69 0.00 -0.54 0.00 0.00 174.62 174.89 3m1a s ALA 36 N -1.21 -1.60 0.22 3.99 0.00 -1.06 -1.00 121.76 121.10 3m1a s ALA 36 Ca 0.18 0.49 -0.02 0.00 0.00 0.00 0.00 51.96 52.61 3m1a s ALA 36 Cb -0.10 0.77 0.22 0.00 0.00 0.00 0.00 23.12 24.02 3m1a s ALA 36 CO 0.09 -0.80 1.60 0.00 0.00 0.00 0.00 175.76 176.66 3m1a h ARG 37 N 2.00 0.59 -4.80 0.00 3.08 -1.89 -0.73 114.38 112.63 3m1a h ARG 37 Ca -0.29 -0.28 -0.68 0.00 0.07 0.00 0.00 59.98 58.79 3m1a h ARG 37 Cb 1.28 -0.00 -0.33 0.00 0.08 0.00 0.00 29.97 31.00 3m1a h ARG 37 CO 0.34 0.87 -0.72 0.50 -1.07 0.00 0.00 179.97 179.89 3m1a s ARG 38 N -4.31 2.47 0.50 0.04 3.52 -1.26 -4.57 118.95 115.34 3m1a s ARG 38 Ca -0.08 -1.23 0.20 0.00 -0.13 0.00 0.00 55.73 54.49 3m1a s ARG 38 Cb 0.12 -3.13 1.27 0.00 -1.56 0.00 0.00 34.95 31.66 3m1a s ARG 38 CO 0.82 -0.59 2.03 1.79 -0.81 0.00 0.00 175.30 178.55 3m1a h THR 39 N 6.45 0.85 -0.39 4.11 1.35 -1.89 -1.81 112.91 121.58 3m1a h THR 39 Ca -0.22 -0.04 0.11 0.00 -0.55 0.00 0.00 66.41 65.71 3m1a h THR 39 Cb 1.07 0.73 -0.02 0.00 -1.73 0.00 0.00 68.15 68.20 3m1a h THR 39 CO 0.53 0.02 0.29 -0.33 -0.25 0.00 0.00 175.52 175.78 3m1a h GLU 40 N 0.10 0.00 -0.07 4.72 3.07 -1.96 -0.53 114.58 119.91 3m1a h GLU 40 Ca 0.19 0.00 0.02 0.00 -0.50 0.00 0.00 59.36 59.07 3m1a h GLU 40 Cb 0.62 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.53 3m1a h GLU 40 CO -0.02 0.00 0.17 0.00 -1.40 0.00 0.00 179.01 177.76 3m1a h ALA 41 N 1.79 1.42 -0.55 3.43 0.00 -1.76 -1.13 119.26 122.45 3m1a h ALA 41 Ca 0.18 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.09 3m1a h ALA 41 Cb 0.76 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.55 3m1a h ALA 41 CO -0.00 -0.21 0.00 1.28 0.00 0.00 0.00 179.25 180.32 3m1a n LEU 42 N -3.32 3.63 -0.30 0.00 4.77 -0.21 -4.65 117.00 116.91 3m1a n LEU 42 Ca -0.01 -1.80 0.15 0.00 -0.03 0.00 0.00 56.01 54.32 3m1a n LEU 42 Cb 0.26 -0.36 0.32 0.00 -2.33 0.00 0.00 43.42 41.30 3m1a n LEU 42 CO 0.21 0.86 0.96 0.44 -1.33 0.00 0.00 177.39 178.53 3m1a h ASP 43 N 4.06 0.04 -0.17 -1.43 3.32 -1.30 -2.27 116.42 118.67 3m1a h ASP 43 Ca 0.00 0.20 -0.01 0.00 0.02 0.00 0.00 57.03 57.24 3m1a h ASP 43 Cb 0.95 0.26 -0.01 0.00 0.22 0.00 0.00 39.33 40.75 3m1a h ASP 43 CO 0.00 -0.17 0.07 0.44 -1.72 0.00 0.00 179.24 177.86 3m1a h ASP 44 N 0.21 0.24 -0.13 6.45 3.32 -1.83 -0.32 116.42 124.35 3m1a h ASP 44 Ca 0.58 -0.16 0.04 0.00 0.02 0.00 0.00 57.03 57.51 3m1a h ASP 44 Cb 1.21 -0.06 -0.04 0.00 0.22 0.00 0.00 39.33 40.66 3m1a h ASP 44 CO -0.67 0.33 -0.10 0.25 -1.72 0.00 0.00 179.24 177.33 3m1a h LEU 45 N 0.13 -0.33 -1.03 1.55 5.85 -1.79 -0.67 115.31 119.02 3m1a h LEU 45 Ca 0.06 0.07 -0.07 0.00 0.84 0.00 0.00 57.88 58.78 3m1a h LEU 45 Cb 0.17 0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.35 3m1a h LEU 45 CO -0.00 -0.14 -0.05 0.58 -0.34 0.00 0.00 178.44 178.49 3m1a h VAL 46 N -0.12 1.23 -0.26 1.05 2.07 -1.30 -1.26 116.25 117.66 3m1a h VAL 46 Ca 0.08 -0.98 -0.13 0.00 0.82 0.00 0.00 66.70 66.50 3m1a h VAL 46 Cb 0.24 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 30.99 3m1a h VAL 46 CO -0.20 0.33 -0.38 0.00 0.02 0.00 0.00 177.57 177.34 3m1a h ALA 47 N 1.35 0.85 -0.05 1.67 0.00 -0.83 -2.55 119.26 119.70 3m1a h ALA 47 Ca 0.12 -0.43 -0.15 0.00 0.00 0.00 0.00 54.91 54.44 3m1a h ALA 47 Cb 0.45 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 3m1a h ALA 47 CO 0.02 0.64 -0.65 0.00 0.00 0.00 0.00 179.25 179.26 3m1a h ALA 48 N 1.08 0.80 -2.09 0.00 0.00 -0.76 -3.38 119.26 114.91 3m1a h ALA 48 Ca 0.05 -0.58 -0.57 0.00 0.00 0.00 0.00 54.91 53.80 3m1a h ALA 48 Cb 0.88 -0.08 -0.40 0.00 0.00 0.00 0.00 17.79 18.19 3m1a h ALA 48 CO 0.08 0.77 -0.93 0.66 0.00 0.00 0.00 179.25 179.82 3m1a n TYR 49 N -3.83 0.95 0.28 0.00 4.01 -0.51 -4.97 117.16 113.10 3m1a n TYR 49 Ca -0.02 -3.75 0.13 0.00 -0.16 0.00 0.00 57.90 54.09 3m1a n TYR 49 Cb 0.65 -0.40 0.82 0.00 -0.31 0.00 0.00 39.34 40.10 3m1a n TYR 49 CO 0.00 0.00 0.00 -1.35 -0.46 0.00 0.00 176.86 175.05 3m1a h PRO 50 N 4.13 0.00 0.00 -0.72 0.11 -1.65 -2.28 132.00 131.60 3m1a h PRO 50 Ca 0.12 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.23 3m1a h PRO 50 Cb 0.81 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.92 3m1a h PRO 50 CO 0.58 0.02 -1.33 -0.25 -0.21 0.00 0.00 178.00 176.82 3m1a n ASP 51 N -4.00 0.50 0.00 -2.05 10.43 -1.26 -4.50 116.55 115.67 3m1a n ASP 51 Ca -0.03 -0.07 0.00 0.00 2.57 0.00 0.00 54.79 57.26 3m1a n ASP 51 Cb 0.11 1.11 0.00 0.00 1.84 0.00 0.00 41.12 44.18 3m1a n ASP 51 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 3m1a n ARG 52 N -2.19 0.21 -4.72 -1.24 1.74 -1.00 -5.02 116.66 104.44 3m1a n ARG 52 Ca -0.00 -0.70 -0.24 0.00 -0.77 0.00 0.00 57.85 56.15 3m1a n ARG 52 Cb 0.50 -0.91 -0.15 0.00 -1.02 0.00 0.00 32.46 30.88 3m1a n ARG 52 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3m1a s ALA 53 N -0.26 1.35 0.00 7.54 0.00 -0.89 0.34 121.76 129.84 3m1a s ALA 53 Ca 0.00 -0.73 0.00 0.00 0.00 0.00 0.00 51.96 51.23 3m1a s ALA 53 Cb 0.00 -0.33 -0.00 0.00 0.00 0.00 0.00 23.12 22.79 3m1a s ALA 53 CO 0.00 0.32 -0.01 -2.00 0.00 0.00 0.00 175.76 174.08 3m1a s GLU 54 N -0.49 0.06 -0.19 0.00 2.12 -0.42 -4.80 118.70 114.97 3m1a s GLU 54 Ca 0.06 -0.06 -0.09 0.00 0.36 0.00 0.00 54.97 55.24 3m1a s GLU 54 Cb -0.06 -0.02 -0.05 0.00 0.26 0.00 0.00 34.13 34.26 3m1a s GLU 54 CO -0.00 0.01 0.10 0.00 -0.54 0.00 0.00 175.26 174.82 3m1a s ALA 55 N -0.12 3.58 -0.05 6.30 0.00 -1.26 -0.83 121.76 129.39 3m1a s ALA 55 Ca -0.01 -0.71 0.03 0.00 0.00 0.00 0.00 51.96 51.27 3m1a s ALA 55 Cb -0.01 -2.06 0.00 0.00 0.00 0.00 0.00 23.12 21.06 3m1a s ALA 55 CO -0.00 0.19 -0.14 0.42 0.00 0.00 0.00 175.76 176.24 3m1a s ILE 56 N 0.29 1.18 -0.01 0.00 1.01 -0.21 -4.97 121.20 118.49 3m1a s ILE 56 Ca 0.06 -0.55 -0.30 0.00 0.00 0.00 0.00 60.65 59.86 3m1a s ILE 56 Cb -0.12 -1.04 -0.05 0.00 0.01 0.00 0.00 42.46 41.27 3m1a s ILE 56 CO -0.01 0.35 1.32 -0.55 0.00 0.00 0.00 174.94 176.05 3m1a s SER 57 N 0.29 6.94 -0.21 3.58 0.15 -1.26 -2.56 113.70 120.63 3m1a s SER 57 Ca -0.07 2.01 -0.08 0.00 0.70 0.00 0.00 55.95 58.50 3m1a s SER 57 Cb -0.12 -2.56 0.09 0.00 -1.71 0.00 0.00 66.02 61.71 3m1a s SER 57 CO 0.02 -0.65 0.46 -0.22 1.20 0.00 0.00 173.24 174.05 3m1a s LEU 58 N 2.20 -0.60 -0.37 3.45 2.96 -0.28 -4.90 118.68 121.14 3m1a s LEU 58 Ca 0.61 1.06 -0.17 0.00 -0.22 0.00 0.00 54.13 55.41 3m1a s LEU 58 Cb -0.29 1.51 -0.00 0.00 0.50 0.00 0.00 46.19 47.91 3m1a s LEU 58 CO 0.25 -0.22 0.44 -0.62 -1.32 0.00 0.00 176.35 174.87 3m1a s ASP 59 N 2.35 6.23 0.10 3.68 -1.08 -1.26 -3.65 116.67 123.03 3m1a s ASP 59 Ca -0.04 -0.27 0.16 0.00 -0.52 0.00 0.00 52.55 51.88 3m1a s ASP 59 Cb -0.11 -2.23 0.69 0.00 -1.46 0.00 0.00 42.92 39.81 3m1a s ASP 59 CO -0.14 -0.45 1.50 0.52 0.52 0.00 0.00 175.17 177.12 3m1a n VAL 60 N 5.36 1.07 1.67 1.11 0.31 -1.26 -1.54 118.33 125.05 3m1a n VAL 60 Ca -0.07 0.30 0.15 0.00 -0.01 0.00 0.00 64.34 64.71 3m1a n VAL 60 Cb 0.49 -1.15 0.70 0.00 -0.91 0.00 0.00 33.84 32.96 3m1a n VAL 60 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 3m1a n THR 61 N -1.77 0.00 -3.65 2.52 -2.24 -1.26 -4.10 114.28 103.78 3m1a n THR 61 Ca 0.02 -0.12 -0.39 0.00 -2.27 0.00 0.00 64.05 61.29 3m1a n THR 61 Cb 0.16 0.03 -0.09 0.00 -2.10 0.00 0.00 70.33 68.33 3m1a n THR 61 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3m1a s ASP 62 N -2.08 5.51 0.33 3.42 -1.08 -0.59 -4.96 116.67 117.22 3m1a s ASP 62 Ca 0.40 -2.37 0.03 0.00 -0.52 0.00 0.00 52.55 50.10 3m1a s ASP 62 Cb 0.21 -1.92 0.63 0.00 -1.46 0.00 0.00 42.92 40.38 3m1a s ASP 62 CO 0.37 -0.52 1.93 1.23 0.52 0.00 0.00 175.17 178.70 3m1a h GLY 63 N 7.76 1.16 0.42 2.66 0.00 -1.84 -0.09 103.07 113.14 3m1a h GLY 63 Ca -0.09 -0.36 0.04 0.00 0.00 0.00 0.00 47.33 46.92 3m1a h GLY 63 CO 0.75 0.26 -0.19 0.83 0.00 0.00 0.00 176.54 178.19 3m1a h GLU 64 N 0.90 -0.25 -0.70 4.80 3.07 -1.96 -1.68 114.58 118.76 3m1a h GLU 64 Ca 0.36 0.02 -0.05 0.00 -0.50 0.00 0.00 59.36 59.19 3m1a h GLU 64 Cb 0.24 0.06 -0.03 0.00 -0.84 0.00 0.00 28.75 28.18 3m1a h GLU 64 CO -0.13 -0.17 0.25 -0.09 -1.40 0.00 0.00 179.01 177.47 3m1a h ARG 65 N -0.26 1.06 -0.68 2.33 9.65 -1.72 -2.02 114.38 122.73 3m1a h ARG 65 Ca 0.09 -0.20 0.09 0.00 -1.10 0.00 0.00 59.98 58.87 3m1a h ARG 65 Cb 0.39 -0.17 -0.07 0.00 -1.39 0.00 0.00 29.97 28.73 3m1a h ARG 65 CO -0.25 0.88 0.31 0.82 2.80 0.00 0.00 179.97 184.53 3m1a h ILE 66 N 1.03 0.82 -0.10 1.20 2.04 -0.78 -1.09 117.51 120.62 3m1a h ILE 66 Ca 0.23 -0.18 -0.01 0.00 1.00 0.00 0.00 64.86 65.90 3m1a h ILE 66 Cb 0.24 0.24 -0.00 0.00 -0.74 0.00 0.00 36.82 36.55 3m1a h ILE 66 CO -0.02 0.10 0.02 0.44 0.00 0.00 0.00 178.15 178.69 3m1a h ASP 67 N 0.54 0.16 -0.22 1.72 3.32 -0.77 -1.50 116.42 119.67 3m1a h ASP 67 Ca 0.34 -0.25 0.04 0.00 0.02 0.00 0.00 57.03 57.18 3m1a h ASP 67 Cb 0.38 -0.04 -0.04 0.00 0.22 0.00 0.00 39.33 39.85 3m1a h ASP 67 CO -0.28 0.37 -0.02 0.58 -1.72 0.00 0.00 179.24 178.17 3m1a h VAL 68 N -0.05 0.82 -0.27 -1.35 2.07 -1.22 -2.12 116.25 114.12 3m1a h VAL 68 Ca 0.03 -0.01 -0.03 0.00 0.82 0.00 0.00 66.70 67.51 3m1a h VAL 68 Cb 0.28 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 30.81 3m1a h VAL 68 CO 0.00 0.01 0.05 0.58 0.02 0.00 0.00 177.57 178.23 3m1a h VAL 69 N 0.04 1.23 -0.44 2.57 2.07 -1.15 -0.48 116.25 120.09 3m1a h VAL 69 Ca 0.10 -0.77 0.05 0.00 0.82 0.00 0.00 66.70 66.91 3m1a h VAL 69 Cb 0.14 1.22 -0.05 0.00 -1.52 0.00 0.00 31.29 31.08 3m1a h VAL 69 CO -0.20 0.25 0.16 0.00 0.02 0.00 0.00 177.57 177.80 3m1a h ALA 70 N 0.87 0.53 -0.45 1.67 0.00 -1.24 -0.51 119.26 120.13 3m1a h ALA 70 Ca 0.08 0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 3m1a h ALA 70 Cb 0.32 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 3m1a h ALA 70 CO 0.00 -0.23 -0.03 0.00 0.00 0.00 0.00 179.25 179.00 3m1a h ALA 71 N 1.29 0.61 -0.58 0.00 0.00 -1.19 -1.60 119.26 117.78 3m1a h ALA 71 Ca 0.21 -0.29 0.01 0.00 0.00 0.00 0.00 54.91 54.83 3m1a h ALA 71 Cb 0.19 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 3m1a h ALA 71 CO -0.21 0.43 0.39 0.22 0.00 0.00 0.00 179.25 180.08 3m1a h ASP 72 N 0.66 0.67 -0.13 0.00 3.58 -0.83 0.28 116.42 120.65 3m1a h ASP 72 Ca 0.12 -0.02 -0.02 0.00 0.42 0.00 0.00 57.03 57.53 3m1a h ASP 72 Cb 0.54 -0.17 -0.00 0.00 1.72 0.00 0.00 39.33 41.42 3m1a h ASP 72 CO 0.03 0.49 0.00 0.58 -2.88 0.00 0.00 179.24 177.46 3m1a h VAL 73 N 0.79 1.25 -0.77 2.25 2.07 -0.95 -1.21 116.25 119.69 3m1a h VAL 73 Ca 0.21 -0.82 0.01 0.00 0.82 0.00 0.00 66.70 66.93 3m1a h VAL 73 Cb -0.09 1.55 -0.04 0.00 -1.52 0.00 0.00 31.29 31.19 3m1a h VAL 73 CO -0.05 0.24 0.51 -0.07 0.02 0.00 0.00 177.57 178.22 3m1a h LEU 74 N -0.04 0.87 -0.42 2.57 3.38 -1.15 0.12 115.31 120.63 3m1a h LEU 74 Ca 0.04 -0.02 -0.11 0.00 0.09 0.00 0.00 57.88 57.87 3m1a h LEU 74 Cb 0.36 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 3m1a h LEU 74 CO 0.01 0.62 -0.18 0.00 0.09 0.00 0.00 178.44 178.98 3m1a h ALA 75 N 1.53 0.58 0.00 1.53 0.00 -0.17 -0.28 119.26 122.46 3m1a h ALA 75 Ca 0.28 -0.36 -0.30 0.00 0.00 0.00 0.00 54.91 54.53 3m1a h ALA 75 Cb -0.10 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 17.50 3m1a h ALA 75 CO -0.06 0.53 -1.75 0.54 0.00 0.00 0.00 179.25 178.50 3m1a n ARG 76 N -4.23 0.64 0.00 0.00 1.74 -0.48 -4.18 116.66 110.15 3m1a n ARG 76 Ca -0.01 0.28 0.10 0.00 -0.77 0.00 0.00 57.85 57.45 3m1a n ARG 76 Cb 0.42 -1.78 -0.14 0.00 -1.02 0.00 0.00 32.46 29.94 3m1a n ARG 76 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 3m1a n TYR 77 N -3.04 0.15 0.00 -1.55 4.01 0.39 -4.98 117.16 112.13 3m1a n TYR 77 Ca -0.18 0.04 0.00 0.00 -0.16 0.00 0.00 57.90 57.60 3m1a n TYR 77 Cb 1.06 -0.59 0.00 0.00 -0.31 0.00 0.00 39.34 39.50 3m1a n TYR 77 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3m1a n GLY 78 N 1.26 1.76 3.60 2.72 0.00 -0.12 -4.94 105.19 109.48 3m1a n GLY 78 Ca -0.04 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.94 3m1a n GLY 78 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3m1a s ARG 79 N -0.50 0.29 -0.10 1.61 1.70 -1.25 -4.95 118.95 115.75 3m1a s ARG 79 Ca 0.00 -0.12 0.01 0.00 -0.47 0.00 0.00 55.73 55.15 3m1a s ARG 79 Cb 0.00 0.13 0.02 0.00 -0.57 0.00 0.00 34.95 34.53 3m1a s ARG 79 CO 0.00 -0.13 -0.11 0.08 -1.08 0.00 0.00 175.30 174.06 3m1a s VAL 80 N -2.39 1.15 -0.08 4.99 1.01 -1.26 -4.73 120.40 119.09 3m1a s VAL 80 Ca 0.10 -0.42 -0.12 0.00 0.00 0.00 0.00 61.98 61.54 3m1a s VAL 80 Cb -0.00 -1.10 -0.29 0.00 0.00 0.00 0.00 36.38 34.99 3m1a s VAL 80 CO -0.04 0.38 0.56 0.44 0.00 0.00 0.00 175.10 176.44 3m1a h ASP 81 N 7.63 0.49 -3.31 3.32 3.32 -1.20 -3.47 116.42 123.20 3m1a h ASP 81 Ca -0.31 -0.91 -0.46 0.00 0.02 0.00 0.00 57.03 55.37 3m1a h ASP 81 Cb 1.16 -0.16 -0.36 0.00 0.22 0.00 0.00 39.33 40.19 3m1a h ASP 81 CO 0.45 1.74 -0.78 -0.69 -1.72 0.00 0.00 179.24 178.24 3m1a s VAL 82 N -2.54 0.68 -0.22 -1.35 1.01 -0.57 -0.54 120.40 116.87 3m1a s VAL 82 Ca -0.19 -0.13 -0.09 0.00 0.00 0.00 0.00 61.98 61.58 3m1a s VAL 82 Cb 0.05 -0.74 -0.04 0.00 0.00 0.00 0.00 36.38 35.65 3m1a s VAL 82 CO 0.80 0.29 0.11 -0.22 0.00 0.00 0.00 175.10 176.08 3m1a s LEU 83 N 1.44 3.85 -0.21 3.92 2.96 -0.31 -0.97 118.68 129.36 3m1a s LEU 83 Ca -0.02 0.02 -0.00 0.00 -0.22 0.00 0.00 54.13 53.91 3m1a s LEU 83 Cb -0.13 -2.01 0.02 0.00 0.50 0.00 0.00 46.19 44.56 3m1a s LEU 83 CO -0.03 0.07 -0.13 -0.69 -1.32 0.00 0.00 176.35 174.25 3m1a s VAL 84 N 0.99 2.48 -0.60 1.68 1.01 0.01 -0.12 120.40 125.86 3m1a s VAL 84 Ca 0.05 -0.96 -0.20 0.00 0.00 0.00 0.00 61.98 60.88 3m1a s VAL 84 Cb -0.14 -2.16 0.09 0.00 0.00 0.00 0.00 36.38 34.18 3m1a s VAL 84 CO 0.03 0.38 0.74 0.20 0.00 0.00 0.00 175.10 176.45 3m1a s ASN 85 N 1.31 6.19 -0.00 3.32 -0.87 0.02 -0.88 114.94 124.02 3m1a s ASN 85 Ca 0.02 -1.32 0.02 0.00 -1.57 0.00 0.00 52.86 50.02 3m1a s ASN 85 Cb -0.15 -2.32 -0.03 0.00 -0.02 0.00 0.00 41.25 38.74 3m1a s ASN 85 CO -0.08 -1.15 0.10 -3.20 -2.57 0.00 0.00 177.10 170.20 3m1a n ASN 86 N 6.54 0.28 -4.62 -1.22 5.15 -1.08 -2.10 115.26 118.21 3m1a n ASN 86 Ca -0.08 -0.53 -0.44 0.00 -0.60 0.00 0.00 54.58 52.92 3m1a n ASN 86 Cb 0.43 1.00 -0.01 0.00 -0.53 0.00 0.00 39.78 40.67 3m1a n ASN 86 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3m1a n ALA 87 N -1.08 0.25 0.00 5.20 0.00 -1.17 -4.68 120.51 119.04 3m1a n ALA 87 Ca 0.00 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.83 3m1a n ALA 87 Cb 0.04 -2.10 0.00 0.00 0.00 0.00 0.00 19.45 17.39 3m1a n ALA 87 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3m1a n GLY 88 N 1.17 -0.44 3.51 0.00 0.00 -1.26 -4.71 105.19 103.46 3m1a n GLY 88 Ca 0.08 -1.22 -0.10 0.00 0.00 0.00 0.00 46.02 44.78 3m1a n GLY 88 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3m1a s ARG 89 N -2.00 1.52 0.09 1.61 1.70 -1.26 -4.59 118.95 116.01 3m1a s ARG 89 Ca 0.00 -1.36 0.09 0.00 -0.47 0.00 0.00 55.73 53.99 3m1a s ARG 89 Cb 0.00 0.43 -0.04 0.00 -0.57 0.00 0.00 34.95 34.78 3m1a s ARG 89 CO 0.00 -0.61 -0.22 0.95 -1.08 0.00 0.00 175.30 174.33 3m1a s THR 90 N -3.95 2.51 -0.04 4.99 -4.23 -0.30 -5.01 115.64 109.61 3m1a s THR 90 Ca 0.26 -1.47 -0.03 0.00 -1.18 0.00 0.00 61.69 59.27 3m1a s THR 90 Cb 0.01 -2.08 0.02 0.00 1.34 0.00 0.00 72.50 71.79 3m1a s THR 90 CO 0.11 0.22 0.10 -1.58 -0.54 0.00 0.00 174.62 172.92 3m1a s GLN 91 N -1.74 0.09 -0.06 3.99 0.74 -1.26 -1.37 119.66 120.06 3m1a s GLN 91 Ca 0.15 0.18 0.03 0.00 0.05 0.00 0.00 55.36 55.76 3m1a s GLN 91 Cb -0.10 -0.02 0.01 0.00 1.10 0.00 0.00 33.01 34.00 3m1a s GLN 91 CO 0.06 -0.05 -0.12 0.08 -0.55 0.00 0.00 175.29 174.70 3m1a s VAL 92 N 0.34 1.13 0.00 1.34 1.01 -0.58 -4.57 120.40 119.08 3m1a s VAL 92 Ca -0.02 -0.49 0.00 0.00 0.00 0.00 0.00 61.98 61.46 3m1a s VAL 92 Cb -0.04 -1.03 0.00 0.00 0.00 0.00 0.00 36.38 35.32 3m1a s VAL 92 CO -0.01 0.35 0.00 0.61 0.00 0.00 0.00 175.10 176.05 3m1a n GLY 93 N 3.68 1.59 3.65 4.51 0.00 0.20 -0.71 105.19 118.11 3m1a n GLY 93 Ca -0.22 -0.48 -0.41 0.00 0.00 0.00 0.00 46.02 44.91 3m1a n GLY 93 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m1a n ALA 94 N -0.29 0.69 -0.27 4.61 0.00 -1.26 -4.17 120.51 119.82 3m1a n ALA 94 Ca 0.00 0.21 0.02 0.00 0.00 0.00 0.00 53.44 53.67 3m1a n ALA 94 Cb 0.00 -2.17 0.10 0.00 0.00 0.00 0.00 19.45 17.38 3m1a n ALA 94 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 3m1a h PHE 95 N 1.62 -0.37 0.00 0.00 3.04 -1.96 0.08 116.94 119.35 3m1a h PHE 95 Ca -0.47 0.07 -0.04 0.00 3.98 0.00 0.00 57.97 61.51 3m1a h PHE 95 Cb 1.32 0.28 -0.01 0.00 2.56 0.00 0.00 35.95 40.11 3m1a h PHE 95 CO 0.45 -0.32 -0.19 0.93 -2.02 0.00 0.00 178.31 177.16 3m1a h GLU 96 N 0.01 0.00 0.00 1.11 5.08 -2.04 -2.77 114.58 115.98 3m1a h GLU 96 Ca 0.37 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.66 3m1a h GLU 96 Cb 0.58 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.82 3m1a h GLU 96 CO -0.78 0.19 -0.34 0.93 -1.00 0.00 0.00 179.01 178.01 3m1a h GLU 97 N 0.00 0.00 -6.21 2.33 4.39 -1.34 -3.45 114.58 110.30 3m1a h GLU 97 Ca -0.00 0.00 -0.57 0.00 0.34 0.00 0.00 59.36 59.13 3m1a h GLU 97 Cb 0.50 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.11 3m1a h GLU 97 CO 0.02 0.34 0.96 0.99 -1.16 0.00 0.00 179.01 180.16 3m1a s THR 98 N -3.26 4.12 0.72 1.13 2.01 -0.92 -4.98 115.64 114.46 3m1a s THR 98 Ca 0.03 1.34 -0.11 0.00 0.31 0.00 0.00 61.69 63.25 3m1a s THR 98 Cb 0.08 -3.93 0.02 0.00 0.01 0.00 0.00 72.50 68.69 3m1a s THR 98 CO 0.70 -0.20 1.08 0.42 -0.69 0.00 0.00 174.62 175.93 3m1a s THR 99 N 3.85 3.66 0.31 -0.82 -4.23 -1.26 -4.88 115.64 112.27 3m1a s THR 99 Ca 0.59 0.57 0.01 0.00 -1.18 0.00 0.00 61.69 61.68 3m1a s THR 99 Cb -0.23 -3.17 0.18 0.00 1.34 0.00 0.00 72.50 70.62 3m1a s THR 99 CO 0.19 -0.67 1.88 -0.08 -0.54 0.00 0.00 174.62 175.40 3m1a h GLU 100 N -0.74 0.77 -0.25 3.99 4.81 -1.99 -1.49 114.58 119.69 3m1a h GLU 100 Ca -0.44 -0.13 0.01 0.00 -0.13 0.00 0.00 59.36 58.66 3m1a h GLU 100 Cb 1.22 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 30.46 3m1a h GLU 100 CO 0.54 0.67 0.15 -0.09 -0.73 0.00 0.00 179.01 179.55 3m1a h ARG 101 N 0.76 0.29 -0.80 1.92 2.43 -1.99 0.12 114.38 117.11 3m1a h ARG 101 Ca 0.18 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.31 3m1a h ARG 101 Cb 0.21 -0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 29.66 3m1a h ARG 101 CO -0.01 0.19 0.42 0.93 -1.51 0.00 0.00 179.97 179.99 3m1a h GLU 102 N 0.30 1.12 0.33 0.20 5.08 -1.88 -1.38 114.58 118.36 3m1a h GLU 102 Ca 0.09 -0.14 -0.02 0.00 -1.00 0.00 0.00 59.36 58.30 3m1a h GLU 102 Cb -0.01 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.03 3m1a h GLU 102 CO -0.04 0.84 -0.16 1.25 -1.00 0.00 0.00 179.01 179.90 3m1a h LEU 103 N 1.11 -0.38 -0.85 1.33 5.85 -0.89 -0.95 115.31 120.52 3m1a h LEU 103 Ca 0.28 -0.08 0.05 0.00 0.84 0.00 0.00 57.88 58.97 3m1a h LEU 103 Cb 0.06 0.10 -0.06 0.00 0.37 0.00 0.00 40.66 41.13 3m1a h LEU 103 CO -0.04 -0.16 0.53 0.03 -0.34 0.00 0.00 178.44 178.47 3m1a h ARG 104 N -0.59 0.97 -0.36 1.25 3.08 -0.65 -2.05 114.38 116.03 3m1a h ARG 104 Ca -0.05 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 59.93 3m1a h ARG 104 Cb 0.43 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 30.25 3m1a h ARG 104 CO 0.08 0.64 0.15 0.22 -1.07 0.00 0.00 179.97 179.98 3m1a h ASP 105 N 1.00 0.49 -0.86 7.04 3.58 -1.06 0.12 116.42 126.74 3m1a h ASP 105 Ca 0.36 -0.16 0.07 0.00 0.42 0.00 0.00 57.03 57.72 3m1a h ASP 105 Cb 0.11 -0.13 -0.06 0.00 1.72 0.00 0.00 39.33 40.97 3m1a h ASP 105 CO -0.15 0.52 0.52 -0.07 -2.88 0.00 0.00 179.24 177.18 3m1a h LEU 106 N 0.44 0.81 -0.95 2.28 3.38 -0.88 -1.84 115.31 118.55 3m1a h LEU 106 Ca 0.12 0.02 -0.08 0.00 0.09 0.00 0.00 57.88 58.03 3m1a h LEU 106 Cb 0.18 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 3m1a h LEU 106 CO -0.01 0.51 -0.09 -0.26 0.09 0.00 0.00 178.44 178.67 3m1a h PHE 107 N 0.94 0.71 -0.54 1.13 0.04 -0.78 -1.11 116.94 117.34 3m1a h PHE 107 Ca 0.38 -0.12 -0.02 0.00 2.80 0.00 0.00 57.97 61.02 3m1a h PHE 107 Cb 0.21 -0.19 -0.02 0.00 2.20 0.00 0.00 35.95 38.15 3m1a h PHE 107 CO -0.04 0.73 0.28 1.49 -0.60 0.00 0.00 178.31 180.17 3m1a h GLU 108 N 0.61 0.76 -0.14 1.51 4.57 -0.54 0.14 114.58 121.49 3m1a h GLU 108 Ca 0.11 -0.10 -0.21 0.00 -1.18 0.00 0.00 59.36 57.98 3m1a h GLU 108 Cb 0.52 -0.14 0.01 0.00 -0.16 0.00 0.00 28.75 28.98 3m1a h GLU 108 CO 0.03 0.61 -0.76 -0.07 -1.18 0.00 0.00 179.01 177.64 3m1a h LEU 109 N 0.72 0.82 0.00 1.64 3.38 -1.08 -0.01 115.31 120.78 3m1a h LEU 109 Ca 0.19 -0.54 0.00 0.00 0.09 0.00 0.00 57.88 57.62 3m1a h LEU 109 Cb 0.08 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.59 3m1a h LEU 109 CO -0.03 1.32 -1.83 1.41 0.09 0.00 0.00 178.44 179.40 3m1a n HIS 110 N -3.91 0.00 0.02 1.13 8.25 -0.44 -4.42 115.22 115.84 3m1a n HIS 110 Ca -0.06 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.40 3m1a n HIS 110 Cb 0.73 -0.42 0.00 0.00 1.12 0.00 0.00 29.99 31.42 3m1a n HIS 110 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 3m1a n VAL 111 N -2.13 0.22 -0.12 1.59 0.31 -0.27 -4.62 118.33 113.32 3m1a n VAL 111 Ca -0.03 0.07 -0.11 0.00 -0.01 0.00 0.00 64.34 64.26 3m1a n VAL 111 Cb 0.51 -0.88 -0.03 0.00 -0.91 0.00 0.00 33.84 32.53 3m1a n VAL 111 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 3m1a h PHE 112 N 0.00 0.71 0.51 3.52 0.04 -1.08 -0.92 116.94 119.71 3m1a h PHE 112 Ca 0.00 -0.14 -0.02 0.00 2.80 0.00 0.00 57.97 60.61 3m1a h PHE 112 Cb 0.00 -0.18 -0.01 0.00 2.20 0.00 0.00 35.95 37.97 3m1a h PHE 112 CO 0.00 0.79 -0.33 0.78 -0.60 0.00 0.00 178.31 178.95 3m1a h GLY 113 N 0.42 -0.86 0.82 -1.45 0.00 -1.14 -0.99 103.07 99.88 3m1a h GLY 113 Ca 0.09 0.36 0.06 0.00 0.00 0.00 0.00 47.33 47.84 3m1a h GLY 113 CO 0.03 -0.31 0.62 -2.55 0.00 0.00 0.00 176.54 174.33 3m1a h PRO 114 N -0.80 1.09 -0.47 4.80 0.11 -1.76 -1.54 132.00 133.42 3m1a h PRO 114 Ca -0.06 -0.07 -0.01 0.00 0.11 0.00 0.00 66.00 65.98 3m1a h PRO 114 Cb 0.66 -0.24 -0.02 0.00 0.11 0.00 0.00 31.00 31.50 3m1a h PRO 114 CO 0.05 0.72 0.25 0.00 -0.21 0.00 0.00 178.00 178.81 3m1a h ALA 115 N 1.48 0.60 -0.52 -0.75 0.00 -1.04 0.04 119.26 119.08 3m1a h ALA 115 Ca 0.41 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 55.14 3m1a h ALA 115 Cb 0.16 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 3m1a h ALA 115 CO -0.15 0.13 0.01 -0.09 0.00 0.00 0.00 179.25 179.15 3m1a h ARG 116 N 0.62 0.90 -0.28 0.00 2.43 -0.69 -0.78 114.38 116.58 3m1a h ARG 116 Ca 0.17 -0.28 -0.04 0.00 -0.81 0.00 0.00 59.98 59.01 3m1a h ARG 116 Cb 0.06 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.52 3m1a h ARG 116 CO -0.03 0.92 0.01 1.25 -1.51 0.00 0.00 179.97 180.62 3m1a h LEU 117 N 0.77 0.48 -0.15 3.80 6.46 -1.19 -1.56 115.31 123.93 3m1a h LEU 117 Ca 0.15 -0.30 0.03 0.00 -0.12 0.00 0.00 57.88 57.64 3m1a h LEU 117 Cb 0.51 -0.13 -0.03 0.00 -0.73 0.00 0.00 40.66 40.27 3m1a h LEU 117 CO 0.02 0.66 -0.07 0.74 -0.62 0.00 0.00 178.44 179.18 3m1a h THR 118 N 0.29 0.78 -0.71 1.05 2.02 -0.87 -2.17 112.91 113.30 3m1a h THR 118 Ca 0.08 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.31 3m1a h THR 118 Cb 0.41 0.78 -0.04 0.00 -1.74 0.00 0.00 68.15 67.55 3m1a h THR 118 CO 0.01 0.00 0.47 0.03 0.37 0.00 0.00 175.52 176.40 3m1a h ARG 119 N -0.05 0.78 -0.03 6.66 3.08 -1.05 -0.25 114.38 123.51 3m1a h ARG 119 Ca 0.08 -0.05 -0.08 0.00 0.07 0.00 0.00 59.98 60.01 3m1a h ARG 119 Cb 0.17 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.04 3m1a h ARG 119 CO -0.18 0.51 -0.34 0.00 -1.07 0.00 0.00 179.97 178.89 3m1a h ALA 120 N 1.60 1.37 -0.00 0.04 0.00 -0.68 -3.22 119.26 118.37 3m1a h ALA 120 Ca 0.30 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3m1a h ALA 120 Cb 0.16 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.88 3m1a h ALA 120 CO -0.09 0.46 -0.82 1.28 0.00 0.00 0.00 179.25 180.08 3m1a n LEU 121 N -4.11 0.85 -0.17 0.00 4.77 -0.79 -4.53 117.00 113.03 3m1a n LEU 121 Ca -0.02 -0.51 -0.10 0.00 -0.03 0.00 0.00 56.01 55.36 3m1a n LEU 121 Cb 0.40 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.49 3m1a n LEU 121 CO 0.39 0.21 0.78 0.25 -1.33 0.00 0.00 177.39 177.70 3m1a h LEU 122 N 0.05 0.86 -0.63 2.23 5.85 -1.08 -3.27 115.31 119.32 3m1a h LEU 122 Ca 0.00 -0.32 0.03 0.00 0.84 0.00 0.00 57.88 58.43 3m1a h LEU 122 Cb 0.42 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.18 3m1a h LEU 122 CO 0.00 0.97 0.39 -0.65 -0.34 0.00 0.00 178.44 178.81 3m1a h PRO 123 N 0.72 0.74 -1.84 5.25 0.11 -1.80 0.23 132.00 135.42 3m1a h PRO 123 Ca 0.13 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.20 3m1a h PRO 123 Cb 0.54 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 31.49 3m1a h PRO 123 CO 0.03 0.49 0.00 0.00 -0.21 0.00 0.00 178.00 178.31 3m1a n GLN 124 N -4.72 0.27 0.00 1.05 -0.00 -1.23 -0.67 117.38 112.09 3m1a n GLN 124 Ca 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 57.06 3m1a n GLN 124 Cb 0.08 -1.36 0.00 0.00 -0.00 0.00 0.00 30.24 28.96 3m1a n GLN 124 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.06 174.93 3m1a n ARG 126 N 1.26 0.00 -0.14 2.61 0.63 0.07 -2.02 116.66 119.07 3m1a n ARG 126 Ca 0.00 0.00 -0.10 0.00 -0.92 0.00 0.00 57.85 56.83 3m1a n ARG 126 Cb 0.14 0.00 -0.01 0.00 0.45 0.00 0.00 32.46 33.03 3m1a n ARG 126 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 3m1a h GLU 127 N 0.00 0.69 -0.14 -0.14 5.08 -1.14 -3.01 114.58 115.93 3m1a h GLU 127 Ca 0.00 -0.22 -0.11 0.00 -1.00 0.00 0.00 59.36 58.03 3m1a h GLU 127 Cb 0.00 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 3m1a h GLU 127 CO 0.00 0.78 -0.40 -0.09 -1.00 0.00 0.00 179.01 178.30 3m1a h ARG 128 N 0.52 0.32 0.00 2.33 2.43 -1.66 -3.47 114.38 114.85 3m1a h ARG 128 Ca 0.11 -0.15 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 3m1a h ARG 128 Cb 0.46 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.01 3m1a h ARG 128 CO 0.02 0.67 0.00 0.41 -1.51 0.00 0.00 179.97 179.56 3m1a n GLY 129 N -0.15 0.54 3.28 2.80 0.00 -1.14 -5.06 105.19 105.45 3m1a n GLY 129 Ca -0.01 -0.70 -0.11 0.00 0.00 0.00 0.00 46.02 45.20 3m1a n GLY 129 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3m1a s SER 130 N -2.64 -0.14 0.00 1.61 1.04 -1.25 -4.41 113.70 107.91 3m1a s SER 130 Ca 0.00 -0.31 0.00 0.00 0.48 0.00 0.00 55.95 56.12 3m1a s SER 130 Cb 0.00 0.41 0.00 0.00 0.10 0.00 0.00 66.02 66.53 3m1a s SER 130 CO 0.00 -0.73 0.00 0.61 0.98 0.00 0.00 173.24 174.10 3m1a n GLY 131 N 0.14 3.73 3.05 7.32 0.00 -1.26 -4.64 105.19 113.52 3m1a n GLY 131 Ca -0.17 -1.15 -0.19 0.00 0.00 0.00 0.00 46.02 44.52 3m1a n GLY 131 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3m1a s SER 132 N 0.00 1.18 -0.18 1.61 0.01 0.30 -0.15 113.70 116.47 3m1a s SER 132 Ca 0.00 -0.23 0.01 0.00 1.31 0.00 0.00 55.95 57.04 3m1a s SER 132 Cb 0.00 -0.11 0.02 0.00 0.21 0.00 0.00 66.02 66.13 3m1a s SER 132 CO 0.00 0.09 -0.19 -0.69 0.41 0.00 0.00 173.24 172.86 3m1a s VAL 133 N -0.37 2.14 -0.26 3.43 1.01 0.51 -1.16 120.40 125.69 3m1a s VAL 133 Ca 0.03 -0.91 0.01 0.00 0.00 0.00 0.00 61.98 61.10 3m1a s VAL 133 Cb -0.05 -1.90 0.05 0.00 0.00 0.00 0.00 36.38 34.48 3m1a s VAL 133 CO -0.00 0.53 -0.08 -0.69 0.00 0.00 0.00 175.10 174.87 3m1a s VAL 134 N 1.29 2.52 -0.24 2.92 1.01 0.83 -0.67 120.40 128.05 3m1a s VAL 134 Ca 0.05 -1.42 -0.06 0.00 0.00 0.00 0.00 61.98 60.55 3m1a s VAL 134 Cb -0.13 -2.41 -0.02 0.00 0.00 0.00 0.00 36.38 33.82 3m1a s VAL 134 CO -0.12 0.02 0.03 0.20 0.00 0.00 0.00 175.10 175.24 3m1a s ASN 135 N 1.19 4.86 -0.62 3.32 0.02 0.01 -0.80 114.94 122.94 3m1a s ASN 135 Ca -0.05 -0.28 -0.27 0.00 -1.02 0.00 0.00 52.86 51.23 3m1a s ASN 135 Cb -0.19 -1.86 0.03 0.00 0.02 0.00 0.00 41.25 39.25 3m1a s ASN 135 CO -0.04 -0.04 1.16 -0.63 0.02 0.00 0.00 177.10 177.57 3m1a s ILE 136 N 1.57 4.03 0.00 0.60 -1.09 -0.89 -1.19 121.20 124.22 3m1a s ILE 136 Ca 0.06 0.62 0.00 0.00 -2.23 0.00 0.00 60.65 59.10 3m1a s ILE 136 Cb -0.15 -4.74 0.00 0.00 -1.58 0.00 0.00 42.46 35.99 3m1a s ILE 136 CO 0.01 -1.43 0.00 -0.24 -1.23 0.00 0.00 174.94 172.05 3m1a n SER 137 N 8.46 0.00 -3.61 3.58 2.88 0.54 -4.91 113.62 120.56 3m1a n SER 137 Ca 0.05 0.00 -0.02 0.00 -1.33 0.00 0.00 58.87 57.57 3m1a n SER 137 Cb 0.49 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.93 3m1a n SER 137 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 3m1a s SER 138 N -1.00 -0.10 0.44 -3.46 0.15 -1.21 -4.45 113.70 104.08 3m1a s SER 138 Ca 0.00 -0.05 0.13 0.00 0.70 0.00 0.00 55.95 56.73 3m1a s SER 138 Cb 0.00 0.14 1.04 0.00 -1.71 0.00 0.00 66.02 65.49 3m1a s SER 138 CO 0.00 -0.25 2.02 2.19 1.20 0.00 0.00 173.24 178.41 3m1a h PHE 139 N 2.00 0.38 0.00 3.44 -5.15 -1.74 -1.11 116.94 114.76 3m1a h PHE 139 Ca -0.16 0.01 0.00 0.00 -0.20 0.00 0.00 57.97 57.62 3m1a h PHE 139 Cb 1.18 -0.12 0.00 0.00 0.22 0.00 0.00 35.95 37.22 3m1a h PHE 139 CO 0.30 0.20 0.18 0.41 -2.00 0.00 0.00 178.31 177.39 3m1a n GLY 140 N -1.52 -0.53 0.00 6.09 0.00 -1.26 -1.23 105.19 106.75 3m1a n GLY 140 Ca 0.06 0.07 0.13 0.00 0.00 0.00 0.00 46.02 46.29 3m1a n GLY 140 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3m1a n GLY 141 N -1.32 -1.24 0.00 -0.02 0.00 -0.42 -3.30 105.19 98.89 3m1a n GLY 141 Ca -0.01 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.90 3m1a n GLY 141 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3m1a n GLN 142 N -1.35 1.37 -3.51 1.61 6.02 -0.36 -3.88 117.38 117.28 3m1a n GLN 142 Ca 0.11 -0.32 -0.09 0.00 -0.01 0.00 0.00 57.00 56.68 3m1a n GLN 142 Cb 0.24 -0.81 -0.02 0.00 1.02 0.00 0.00 30.24 30.67 3m1a n GLN 142 CO 0.00 0.00 0.00 -0.48 -1.01 0.00 0.00 177.06 175.57 3m1a s LEU 143 N -0.57 -0.42 0.29 1.08 0.05 -1.21 -5.03 118.68 112.87 3m1a s LEU 143 Ca 0.00 -0.05 -0.05 0.00 0.05 0.00 0.00 54.13 54.08 3m1a s LEU 143 Cb 0.00 2.25 -0.01 0.00 -2.05 0.00 0.00 46.19 46.38 3m1a s LEU 143 CO 0.00 -0.78 0.40 -0.55 -0.55 0.00 0.00 176.35 174.87 3m1a s SER 144 N -2.62 0.50 0.19 1.48 0.15 -1.26 -4.35 113.70 107.79 3m1a s SER 144 Ca 0.04 -1.31 -0.22 0.00 0.70 0.00 0.00 55.95 55.16 3m1a s SER 144 Cb -0.01 0.58 0.08 0.00 -1.71 0.00 0.00 66.02 64.95 3m1a s SER 144 CO -0.09 -1.15 1.03 0.72 1.20 0.00 0.00 173.24 174.95 3m1a s PHE 145 N -3.58 0.07 0.21 3.44 -0.71 -1.26 -5.08 117.98 111.07 3m1a s PHE 145 Ca 0.30 -0.48 -0.32 0.00 -1.04 0.00 0.00 56.93 55.40 3m1a s PHE 145 Cb 0.01 0.70 -0.14 0.00 -1.21 0.00 0.00 43.02 42.38 3m1a s PHE 145 CO 0.16 -0.94 1.30 0.00 -1.34 0.00 0.00 175.22 174.40 3m1a n ALA 146 N -0.70 0.27 -0.13 1.99 0.00 -1.26 -1.69 120.51 118.98 3m1a n ALA 146 Ca -0.03 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.85 3m1a n ALA 146 Cb 0.59 -2.16 0.00 0.00 0.00 0.00 0.00 19.45 17.88 3m1a n ALA 146 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3m1a n GLY 147 N 2.11 1.46 0.02 0.00 0.00 -1.26 -4.67 105.19 102.85 3m1a n GLY 147 Ca 0.13 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.16 3m1a n GLY 147 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3m1a n PHE 148 N -2.00 0.00 -0.04 1.61 -0.00 -0.68 -0.63 117.46 115.72 3m1a n PHE 148 Ca 0.00 -0.45 -0.08 0.00 -0.00 0.00 0.00 57.45 56.92 3m1a n PHE 148 Cb 0.00 -0.05 -0.03 0.00 -0.00 0.00 0.00 39.48 39.40 3m1a n PHE 148 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.76 177.42 3m1a h SER 149 N 0.00 -0.17 0.08 -2.13 4.64 -1.82 -0.89 113.55 113.26 3m1a h SER 149 Ca 0.00 0.06 -0.00 0.00 -0.47 0.00 0.00 61.79 61.37 3m1a h SER 149 Cb 0.67 0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.88 3m1a h SER 149 CO 0.00 -0.06 -0.04 0.00 -0.87 0.00 0.00 176.83 175.87 3m1a h ALA 150 N 1.20 -0.10 -0.20 5.18 0.00 -1.87 -0.62 119.26 122.84 3m1a h ALA 150 Ca 0.10 -0.15 0.05 0.00 0.00 0.00 0.00 54.91 54.91 3m1a h ALA 150 Cb 0.14 0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.92 3m1a h ALA 150 CO -0.20 -0.42 -0.10 -0.92 0.00 0.00 0.00 179.25 177.61 3m1a h TYR 151 N -0.38 -0.25 -0.45 0.00 3.20 -1.79 -1.68 116.97 115.63 3m1a h TYR 151 Ca -0.01 0.02 -0.09 0.00 3.14 0.00 0.00 58.73 61.80 3m1a h TYR 151 Cb 0.32 0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.72 3m1a h TYR 151 CO 0.02 -0.16 -0.07 0.77 -1.64 0.00 0.00 178.16 177.08 3m1a h SER 152 N -0.08 0.76 -0.57 -2.11 0.02 -1.13 -1.23 113.55 109.20 3m1a h SER 152 Ca 0.11 -0.21 -0.06 0.00 -0.84 0.00 0.00 61.79 60.79 3m1a h SER 152 Cb 0.25 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.56 3m1a h SER 152 CO -0.25 0.87 0.14 0.00 -1.14 0.00 0.00 176.83 176.44 3m1a h ALA 153 N 1.21 1.11 -0.22 3.77 0.00 -0.54 -0.59 119.26 123.99 3m1a h ALA 153 Ca 0.13 -0.23 -0.19 0.00 0.00 0.00 0.00 54.91 54.62 3m1a h ALA 153 Cb 0.54 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.09 3m1a h ALA 153 CO 0.03 0.60 -0.61 1.79 0.00 0.00 0.00 179.25 181.06 3m1a h THR 154 N 0.91 1.29 -0.28 0.00 1.35 -0.92 -2.51 112.91 112.75 3m1a h THR 154 Ca 0.19 -1.82 -0.14 0.00 -0.55 0.00 0.00 66.41 64.09 3m1a h THR 154 Cb 0.33 1.76 -0.01 0.00 -1.73 0.00 0.00 68.15 68.50 3m1a h THR 154 CO 0.00 0.58 -0.40 0.11 -0.25 0.00 0.00 175.52 175.56 3m1a h LYS 155 N 0.56 0.66 -0.35 4.72 1.79 -1.00 -2.20 116.57 120.76 3m1a h LYS 155 Ca -0.00 -0.34 -0.06 0.00 -2.18 0.00 0.00 60.65 58.07 3m1a h LYS 155 Cb 1.20 0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 31.85 3m1a h LYS 155 CO 0.13 0.95 -0.01 0.00 -1.08 0.00 0.00 179.45 179.43 3m1a h ALA 156 N 1.01 0.47 -0.28 3.86 0.00 -1.14 0.67 119.26 123.85 3m1a h ALA 156 Ca 0.04 -0.25 0.07 0.00 0.00 0.00 0.00 54.91 54.77 3m1a h ALA 156 Cb 0.93 -0.13 -0.07 0.00 0.00 0.00 0.00 17.79 18.52 3m1a h ALA 156 CO 0.08 0.25 -0.23 0.00 0.00 0.00 0.00 179.25 179.35 3m1a h ALA 157 N 0.85 -0.07 -0.64 0.00 0.00 -1.39 -0.69 119.26 117.32 3m1a h ALA 157 Ca 0.10 0.09 0.08 0.00 0.00 0.00 0.00 54.91 55.18 3m1a h ALA 157 Cb 0.48 0.49 -0.06 0.00 0.00 0.00 0.00 17.79 18.69 3m1a h ALA 157 CO 0.02 -0.64 0.30 1.25 0.00 0.00 0.00 179.25 180.19 3m1a h LEU 158 N -0.21 0.40 -0.52 0.00 5.85 -1.12 -1.57 115.31 118.14 3m1a h LEU 158 Ca 0.15 0.05 0.03 0.00 0.84 0.00 0.00 57.88 58.95 3m1a h LEU 158 Cb 0.44 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.43 3m1a h LEU 158 CO -0.40 0.24 0.31 -0.33 -0.34 0.00 0.00 178.44 177.92 3m1a h GLU 159 N 0.54 0.59 -0.21 1.25 5.08 -0.30 -0.90 114.58 120.63 3m1a h GLU 159 Ca 0.31 -0.04 -0.17 0.00 -1.00 0.00 0.00 59.36 58.46 3m1a h GLU 159 Cb 0.30 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.41 3m1a h GLU 159 CO -0.24 0.39 -0.56 1.96 -1.00 0.00 0.00 179.01 179.56 3m1a h GLN 160 N 0.61 0.65 -0.74 2.33 1.08 -0.95 0.66 115.11 118.76 3m1a h GLN 160 Ca 0.21 -0.42 0.07 0.00 -1.45 0.00 0.00 58.65 57.06 3m1a h GLN 160 Cb 0.03 0.05 -0.06 0.00 -0.05 0.00 0.00 27.48 27.45 3m1a h GLN 160 CO -0.10 1.04 0.42 -0.07 -0.95 0.00 0.00 178.83 179.17 3m1a h LEU 161 N 0.49 0.63 -0.38 1.46 4.07 -1.18 -2.12 115.31 118.29 3m1a h LEU 161 Ca 0.01 0.03 -0.02 0.00 0.08 0.00 0.00 57.88 57.98 3m1a h LEU 161 Cb 1.13 -0.10 -0.02 0.00 1.08 0.00 0.00 40.66 42.76 3m1a h LEU 161 CO 0.11 0.40 0.16 0.28 -1.08 0.00 0.00 178.44 178.31 3m1a h SER 162 N 0.76 0.51 0.26 -0.43 0.02 -0.69 -1.59 113.55 112.40 3m1a h SER 162 Ca 0.33 -0.15 0.00 0.00 -0.84 0.00 0.00 61.79 61.13 3m1a h SER 162 Cb 0.21 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 62.60 3m1a h SER 162 CO -0.19 0.53 -0.29 -0.33 -1.14 0.00 0.00 176.83 175.41 3m1a h GLU 163 N 0.47 -0.57 -0.39 3.45 5.08 -0.55 0.75 114.58 122.83 3m1a h GLU 163 Ca 0.13 0.04 0.03 0.00 -1.00 0.00 0.00 59.36 58.56 3m1a h GLU 163 Cb 0.16 0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.51 3m1a h GLU 163 CO -0.01 -0.38 0.18 0.78 -1.00 0.00 0.00 179.01 178.58 3m1a h GLY 164 N -0.59 0.52 0.50 -3.84 0.00 -1.44 -2.60 103.07 95.62 3m1a h GLY 164 Ca -0.00 -0.13 0.05 0.00 0.00 0.00 0.00 47.33 47.25 3m1a h GLY 164 CO -0.07 0.09 -0.05 -2.00 0.00 0.00 0.00 176.54 174.50 3m1a h LEU 165 N 0.38 -0.21 -0.96 3.11 5.85 -1.15 -2.52 115.31 119.80 3m1a h LEU 165 Ca 0.17 0.07 0.10 0.00 0.84 0.00 0.00 57.88 59.06 3m1a h LEU 165 Cb 0.08 0.15 -0.08 0.00 0.37 0.00 0.00 40.66 41.18 3m1a h LEU 165 CO -0.12 -0.07 0.60 0.00 -0.34 0.00 0.00 178.44 178.51 3m1a h ALA 166 N 1.25 1.40 -0.48 1.25 0.00 -0.60 0.56 119.26 122.64 3m1a h ALA 166 Ca 0.13 0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.96 3m1a h ALA 166 Cb 0.19 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 3m1a h ALA 166 CO -0.26 0.26 -0.06 0.22 0.00 0.00 0.00 179.25 179.41 3m1a h ASP 167 N 1.00 0.82 0.18 0.00 3.58 -1.25 -1.93 116.42 118.82 3m1a h ASP 167 Ca 0.46 -0.23 -0.17 0.00 0.42 0.00 0.00 57.03 57.50 3m1a h ASP 167 Cb 0.37 -0.22 -0.01 0.00 1.72 0.00 0.00 39.33 41.19 3m1a h ASP 167 CO -0.23 0.92 -0.65 -0.33 -2.88 0.00 0.00 179.24 176.06 3m1a h GLU 168 N 0.76 0.44 -0.01 0.28 5.08 -0.52 -3.35 114.58 117.26 3m1a h GLU 168 Ca 0.14 -0.32 0.00 0.00 -1.00 0.00 0.00 59.36 58.17 3m1a h GLU 168 Cb 0.55 0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.85 3m1a h GLU 168 CO 0.03 0.94 -0.13 1.33 -1.00 0.00 0.00 179.01 180.19 3m1a n VAL 169 N -3.89 0.00 -0.25 3.13 0.24 -0.39 -4.41 118.33 112.76 3m1a n VAL 169 Ca -0.04 -0.44 0.06 0.00 -2.04 0.00 0.00 64.34 61.89 3m1a n VAL 169 Cb 0.66 1.23 0.19 0.00 -1.47 0.00 0.00 33.84 34.45 3m1a n VAL 169 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3m1a h ALA 170 N 2.55 0.99 -0.11 2.33 0.00 -1.48 -0.20 119.26 123.33 3m1a h ALA 170 Ca 0.00 0.16 0.03 0.00 0.00 0.00 0.00 54.91 55.10 3m1a h ALA 170 Cb 0.52 0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 3m1a h ALA 170 CO 0.00 -0.32 0.23 -1.35 0.00 0.00 0.00 179.25 177.81 3m1a h PRO 171 N 0.30 0.00 -0.47 0.00 0.11 -1.83 -1.14 132.00 128.98 3m1a h PRO 171 Ca 0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.53 3m1a h PRO 171 Cb 0.71 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.82 3m1a h PRO 171 CO -0.49 0.00 0.00 1.19 -0.21 0.00 0.00 178.00 178.49 3m1a n PHE 172 N -3.35 0.62 -1.39 0.65 3.01 -0.11 -4.94 117.46 111.96 3m1a n PHE 172 Ca 0.00 -0.31 -0.09 0.00 1.01 0.00 0.00 57.45 58.06 3m1a n PHE 172 Cb 0.32 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.76 3m1a n PHE 172 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3m1a n GLY 173 N 1.45 0.90 3.75 1.37 0.00 -0.43 -3.87 105.19 108.35 3m1a n GLY 173 Ca 0.20 -0.63 -0.39 0.00 0.00 0.00 0.00 46.02 45.20 3m1a n GLY 173 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3m1a s ILE 174 N -2.34 4.96 -0.15 -0.61 1.01 -1.10 -4.14 121.20 118.84 3m1a s ILE 174 Ca 0.00 1.23 -0.11 0.00 0.00 0.00 0.00 60.65 61.77 3m1a s ILE 174 Cb 0.00 -3.93 -0.05 0.00 0.01 0.00 0.00 42.46 38.49 3m1a s ILE 174 CO 0.00 0.39 0.22 -0.54 0.00 0.00 0.00 174.94 175.01 3m1a s LYS 175 N 0.00 4.01 -0.18 2.79 1.02 0.79 -4.30 119.74 123.88 3m1a s LYS 175 Ca 0.31 -0.01 -0.00 0.00 0.02 0.00 0.00 55.97 56.29 3m1a s LYS 175 Cb -0.18 -3.35 0.01 0.00 -0.52 0.00 0.00 37.83 33.79 3m1a s LYS 175 CO 0.16 0.43 -0.16 0.08 -0.92 0.00 0.00 175.35 174.94 3m1a s VAL 176 N -0.07 2.46 -0.19 3.17 1.01 -1.26 -0.36 120.40 125.16 3m1a s VAL 176 Ca 0.14 -0.81 0.00 0.00 0.00 0.00 0.00 61.98 61.31 3m1a s VAL 176 Cb -0.13 -2.05 0.04 0.00 0.00 0.00 0.00 36.38 34.24 3m1a s VAL 176 CO 0.03 0.51 -0.09 -0.22 0.00 0.00 0.00 175.10 175.33 3m1a s LEU 177 N 1.18 2.08 -0.37 3.92 2.96 0.15 -4.45 118.68 124.15 3m1a s LEU 177 Ca 0.02 -0.81 -0.18 0.00 -0.22 0.00 0.00 54.13 52.94 3m1a s LEU 177 Cb -0.14 -1.15 0.00 0.00 0.50 0.00 0.00 46.19 45.40 3m1a s LEU 177 CO -0.07 -0.15 0.48 -0.63 -1.32 0.00 0.00 176.35 174.66 3m1a s ILE 178 N 1.46 5.04 -0.21 6.68 1.01 0.10 -0.81 121.20 134.48 3m1a s ILE 178 Ca -0.00 0.12 -0.12 0.00 0.00 0.00 0.00 60.65 60.65 3m1a s ILE 178 Cb -0.16 -3.97 -0.05 0.00 0.01 0.00 0.00 42.46 38.29 3m1a s ILE 178 CO -0.08 -0.27 0.23 -0.69 0.00 0.00 0.00 174.94 174.14 3m1a s VAL 179 N 2.30 5.32 -0.70 2.92 1.01 -0.33 -0.40 120.40 130.53 3m1a s VAL 179 Ca 0.16 0.37 0.05 0.00 0.00 0.00 0.00 61.98 62.57 3m1a s VAL 179 Cb -0.16 -3.57 0.18 0.00 0.00 0.00 0.00 36.38 32.83 3m1a s VAL 179 CO 0.14 0.35 0.52 -0.62 0.00 0.00 0.00 175.10 175.48 3m1a n GLU 180 N 4.07 1.88 -2.66 2.72 1.02 0.36 -0.34 120.64 127.68 3m1a n GLU 180 Ca -0.13 -4.49 -0.32 0.00 -0.02 0.00 0.00 57.16 52.20 3m1a n GLU 180 Cb 0.52 -2.27 -0.05 0.00 -0.02 0.00 0.00 31.44 29.62 3m1a n GLU 180 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 3m1a s PRO 181 N -1.56 4.03 0.00 3.49 0.04 -1.26 -1.34 135.00 138.40 3m1a s PRO 181 Ca 0.27 0.93 0.00 0.00 0.04 0.00 0.00 61.00 62.24 3m1a s PRO 181 Cb -0.02 -2.21 0.00 0.00 0.04 0.00 0.00 34.50 32.31 3m1a s PRO 181 CO -0.15 -0.12 0.00 0.41 0.04 0.00 0.00 177.00 177.17 3m1a n GLY 182 N -1.11 1.32 3.68 0.56 0.00 -0.00 -3.49 105.19 106.15 3m1a n GLY 182 Ca 0.06 -1.09 -0.39 0.00 0.00 0.00 0.00 46.02 44.59 3m1a n GLY 182 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m1a s ALA 183 N -3.21 3.49 0.04 4.61 0.00 -1.26 -5.00 121.76 120.43 3m1a s ALA 183 Ca 0.00 -0.18 0.08 0.00 0.00 0.00 0.00 51.96 51.86 3m1a s ALA 183 Cb 0.00 -2.89 -0.03 0.00 0.00 0.00 0.00 23.12 20.20 3m1a s ALA 183 CO 0.00 -0.34 -0.23 -0.06 0.00 0.00 0.00 175.76 175.13 3m1a s PHE 184 N 1.40 2.03 0.53 0.00 0.40 -1.26 -1.30 117.98 119.78 3m1a s PHE 184 Ca 0.30 -0.39 -0.22 0.00 -0.60 0.00 0.00 56.93 56.01 3m1a s PHE 184 Cb -0.16 -1.22 -0.05 0.00 0.51 0.00 0.00 43.02 42.10 3m1a s PHE 184 CO 0.12 0.09 1.36 1.03 0.70 0.00 0.00 175.22 178.53 3m1a s ARG 185 N -1.15 3.24 0.00 0.44 1.81 0.21 -3.55 118.95 119.96 3m1a s ARG 185 Ca 0.09 2.25 0.00 0.00 -1.72 0.00 0.00 55.73 56.36 3m1a s ARG 185 Cb -0.09 -2.33 0.00 0.00 -0.45 0.00 0.00 34.95 32.08 3m1a s ARG 185 CO 0.02 -1.11 0.31 0.25 -0.68 0.00 0.00 175.30 174.09 3m1a n THR 186 N -0.88 0.00 0.21 0.02 -2.24 -1.26 -4.68 114.28 105.45 3m1a n THR 186 Ca 0.09 -0.46 0.08 0.00 -2.27 0.00 0.00 64.05 61.49 3m1a n THR 186 Cb 0.45 1.05 0.43 0.00 -2.10 0.00 0.00 70.33 70.15 3m1a n THR 186 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3m1a h ASN 187 N 0.00 0.00 0.00 3.42 -1.07 -1.92 0.38 115.58 116.38 3m1a h ASN 187 Ca 0.00 0.00 -0.25 0.00 0.07 0.00 0.00 56.30 56.12 3m1a h ASN 187 Cb 0.02 0.00 -0.05 0.00 -2.07 0.00 0.00 38.32 36.23 3m1a h ASN 187 CO 0.00 0.30 -2.14 0.18 0.07 0.00 0.00 177.43 175.84 3m1a n LEU 188 N -3.54 0.00 -0.00 6.14 4.77 -1.26 -4.63 117.00 118.47 3m1a n LEU 188 Ca -0.00 0.00 0.04 0.00 -0.03 0.00 0.00 56.01 56.02 3m1a n LEU 188 Cb 0.44 0.33 -0.06 0.00 -2.33 0.00 0.00 43.42 41.81 3m1a n LEU 188 CO 0.35 0.33 -0.21 0.49 -1.33 0.00 0.00 177.39 177.03 3m1a n PHE 189 N -2.54 0.00 -4.46 -1.77 3.72 -1.24 -5.06 117.46 106.11 3m1a n PHE 189 Ca -0.23 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.17 3m1a n PHE 189 Cb 0.94 -0.07 0.00 0.00 -0.94 0.00 0.00 39.48 39.42 3m1a n PHE 189 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3m1a n GLY 190 N 1.45 -0.96 3.76 1.37 0.00 0.13 -1.50 105.19 109.45 3m1a n GLY 190 Ca 0.01 -1.16 -0.03 0.00 0.00 0.00 0.00 46.02 44.84 3m1a n GLY 190 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3m1a s LYS 191 N 0.00 1.12 0.94 1.61 -2.85 -1.26 -2.73 119.74 116.56 3m1a s LYS 191 Ca 0.00 -0.64 -0.12 0.00 -1.00 0.00 0.00 55.97 54.22 3m1a s LYS 191 Cb 0.00 0.37 0.15 0.00 -2.06 0.00 0.00 37.83 36.29 3m1a s LYS 191 CO 0.00 -0.51 1.09 0.20 0.10 0.00 0.00 175.35 176.23 3m1a s GLY 192 N -3.02 1.61 0.75 0.59 0.00 -1.26 -4.85 107.32 101.13 3m1a s GLY 192 Ca 0.14 -0.06 -0.15 0.00 0.00 0.00 0.00 44.72 44.65 3m1a s GLY 192 CO 0.02 0.46 1.24 0.00 0.00 0.00 0.00 173.10 174.83 3m1a s ALA 193 N -2.87 2.04 -0.02 3.20 0.00 -1.26 -4.83 121.76 118.03 3m1a s ALA 193 Ca 0.64 1.00 0.00 0.00 0.00 0.00 0.00 51.96 53.61 3m1a s ALA 193 Cb -0.19 -3.52 0.03 0.00 0.00 0.00 0.00 23.12 19.43 3m1a s ALA 193 CO 0.58 -2.04 0.03 0.00 0.00 0.00 0.00 175.76 174.33 3m1a s ALA 194 N -1.84 0.09 -0.03 0.00 0.00 -1.26 -1.15 121.76 117.57 3m1a s ALA 194 Ca 0.77 0.27 0.07 0.00 0.00 0.00 0.00 51.96 53.07 3m1a s ALA 194 Cb -0.32 -0.23 -0.02 0.00 0.00 0.00 0.00 23.12 22.55 3m1a s ALA 194 CO 0.46 -0.10 -0.24 -0.47 0.00 0.00 0.00 175.76 175.42 3m1a s TYR 195 N 0.97 2.21 -0.15 0.00 5.04 -0.47 -5.00 117.35 119.95 3m1a s TYR 195 Ca -0.08 -0.50 0.01 0.00 -2.44 0.00 0.00 57.07 54.05 3m1a s TYR 195 Cb -0.12 -1.43 0.02 0.00 0.35 0.00 0.00 41.96 40.78 3m1a s TYR 195 CO -0.03 -0.10 -0.15 -0.06 -1.34 0.00 0.00 175.55 173.87 3m1a s PHE 196 N -0.41 2.24 0.73 4.97 0.08 -1.26 -1.53 117.98 122.80 3m1a s PHE 196 Ca 0.05 -1.24 -0.14 0.00 0.12 0.00 0.00 56.93 55.72 3m1a s PHE 196 Cb -0.11 -1.62 0.04 0.00 -0.57 0.00 0.00 43.02 40.76 3m1a s PHE 196 CO 0.01 -0.66 1.15 -1.12 -0.10 0.00 0.00 175.22 174.49 3m1a s SER 197 N 1.37 4.45 0.17 1.36 0.01 0.11 -4.96 113.70 116.22 3m1a s SER 197 Ca 0.03 2.13 -0.31 0.00 1.31 0.00 0.00 55.95 59.11 3m1a s SER 197 Cb -0.13 -2.56 -0.17 0.00 0.21 0.00 0.00 66.02 63.37 3m1a s SER 197 CO -0.09 -2.08 0.80 1.21 0.41 0.00 0.00 173.24 173.49 3m1a n GLU 198 N -2.87 0.40 -3.84 12.44 2.13 -1.26 -4.88 120.64 122.76 3m1a n GLU 198 Ca 0.11 0.14 -0.29 0.00 0.66 0.00 0.00 57.16 57.78 3m1a n GLU 198 Cb 0.51 -1.37 -0.13 0.00 0.27 0.00 0.00 31.44 30.72 3m1a n GLU 198 CO 0.00 0.00 0.00 -2.00 -0.41 0.00 0.00 177.13 174.72 3m1a s GLU 199 N -0.79 1.76 0.55 5.31 2.12 -1.26 -4.77 118.70 121.63 3m1a s GLU 199 Ca 0.70 -2.50 -0.17 0.00 0.36 0.00 0.00 54.97 53.36 3m1a s GLU 199 Cb -0.95 -2.91 -0.06 0.00 0.26 0.00 0.00 34.13 30.48 3m1a s GLU 199 CO 0.56 -1.17 1.04 -0.80 -0.54 0.00 0.00 175.26 174.35 3m1a s ASN 200 N -0.23 6.08 0.56 -1.70 0.01 -1.26 -4.70 114.94 113.70 3m1a s ASN 200 Ca 0.19 1.80 0.36 0.00 -0.71 0.00 0.00 52.86 54.50 3m1a s ASN 200 Cb -0.21 -2.54 1.48 0.00 0.41 0.00 0.00 41.25 40.40 3m1a s ASN 200 CO -0.03 -0.96 1.72 -0.65 -1.51 0.00 0.00 177.10 175.67 3m1a h PRO 201 N 0.82 0.00 0.00 -0.60 0.11 -1.99 0.24 132.00 130.58 3m1a h PRO 201 Ca -0.48 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.62 3m1a h PRO 201 Cb 1.21 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 3m1a h PRO 201 CO 0.59 0.00 -0.08 0.00 -0.21 0.00 0.00 178.00 178.29 3m1a h ALA 202 N 1.25 1.02 -0.00 -0.75 0.00 -2.04 -3.16 119.26 115.57 3m1a h ALA 202 Ca 0.54 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.37 3m1a h ALA 202 Cb 2.36 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 20.14 3m1a h ALA 202 CO -0.01 0.11 -0.04 0.66 0.00 0.00 0.00 179.25 179.97 3m1a n TYR 203 N -3.21 0.00 -0.20 0.00 4.01 0.72 -4.82 117.16 113.65 3m1a n TYR 203 Ca 0.00 0.00 -0.08 0.00 -0.16 0.00 0.00 57.90 57.66 3m1a n TYR 203 Cb 0.36 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.41 3m1a n TYR 203 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3m1a h ALA 204 N 0.29 0.74 -0.81 -0.72 0.00 -1.17 0.18 119.26 117.77 3m1a h ALA 204 Ca 0.00 -0.20 0.06 0.00 0.00 0.00 0.00 54.91 54.77 3m1a h ALA 204 Cb 0.06 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 17.58 3m1a h ALA 204 CO 0.00 0.41 0.53 1.05 0.00 0.00 0.00 179.25 181.24 3m1a h GLU 205 N 0.79 0.89 0.09 0.00 -0.00 -1.88 0.20 114.58 114.67 3m1a h GLU 205 Ca 0.18 -0.05 -0.28 0.00 -0.00 0.00 0.00 59.36 59.21 3m1a h GLU 205 Cb 0.29 -0.20 -0.01 0.00 -0.00 0.00 0.00 28.75 28.83 3m1a h GLU 205 CO -0.01 0.59 -1.48 0.87 -0.00 0.00 0.00 179.01 178.98 3m1a h LYS 206 N 0.91 0.20 0.13 1.06 1.79 -1.85 -3.41 116.57 115.40 3m1a h LYS 206 Ca 0.34 -0.33 -0.29 0.00 -2.18 0.00 0.00 60.65 58.18 3m1a h LYS 206 Cb 0.18 0.12 0.00 0.00 -1.58 0.00 0.00 32.23 30.95 3m1a h LYS 206 CO -0.11 1.16 -1.40 0.28 -1.08 0.00 0.00 179.45 178.30 3m1a h VAL 207 N -0.38 1.32 -0.73 0.50 2.07 -0.61 -3.37 116.25 115.05 3m1a h VAL 207 Ca -0.33 -2.91 0.12 0.00 0.82 0.00 0.00 66.70 64.40 3m1a h VAL 207 Cb 1.71 2.87 -0.13 0.00 -1.52 0.00 0.00 31.29 34.22 3m1a h VAL 207 CO 0.01 0.85 -0.35 1.23 0.02 0.00 0.00 177.57 179.33 3m1a h GLY 208 N 1.51 -0.05 0.99 2.17 0.00 -0.76 0.23 103.07 107.16 3m1a h GLY 208 Ca -0.19 0.46 0.12 0.00 0.00 0.00 0.00 47.33 47.72 3m1a h GLY 208 CO 0.19 -0.21 0.40 -2.55 0.00 0.00 0.00 176.54 174.37 3m1a h PRO 209 N -0.11 0.29 -0.23 4.80 0.11 -1.78 -2.08 132.00 133.01 3m1a h PRO 209 Ca 0.27 -0.02 -0.17 0.00 0.11 0.00 0.00 66.00 66.19 3m1a h PRO 209 Cb 0.57 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.61 3m1a h PRO 209 CO -0.78 0.19 -0.53 1.15 -0.21 0.00 0.00 178.00 177.82 3m1a h THR 210 N 0.30 1.30 -0.66 -1.15 2.02 -1.15 -1.81 112.91 111.76 3m1a h THR 210 Ca 0.28 -1.74 0.03 0.00 0.77 0.00 0.00 66.41 65.75 3m1a h THR 210 Cb 0.68 1.80 -0.04 0.00 -1.74 0.00 0.00 68.15 68.85 3m1a h THR 210 CO -0.06 0.55 0.41 -0.09 0.37 0.00 0.00 175.52 176.69 3m1a h ARG 211 N 0.49 0.77 -0.68 6.66 2.43 -1.02 -2.26 114.38 120.77 3m1a h ARG 211 Ca -0.00 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.09 3m1a h ARG 211 Cb 1.14 -0.17 -0.03 0.00 -0.42 0.00 0.00 29.97 30.49 3m1a h ARG 211 CO 0.12 0.51 0.29 0.37 -1.51 0.00 0.00 179.97 179.75 3m1a h GLN 212 N 0.79 1.00 -0.50 0.20 5.75 -1.32 -1.90 115.11 119.13 3m1a h GLN 212 Ca 0.27 -0.17 -0.04 0.00 -0.15 0.00 0.00 58.65 58.56 3m1a h GLN 212 Cb 0.04 -0.17 -0.02 0.00 1.07 0.00 0.00 27.48 28.40 3m1a h GLN 212 CO -0.11 0.82 0.15 1.25 -2.65 0.00 0.00 178.83 178.29 3m1a h LEU 213 N 0.95 0.73 0.00 -2.39 5.85 -1.15 -1.96 115.31 117.35 3m1a h LEU 213 Ca 0.23 -0.21 -0.05 0.00 0.84 0.00 0.00 57.88 58.69 3m1a h LEU 213 Cb 0.17 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.00 3m1a h LEU 213 CO -0.02 0.74 -0.55 -0.37 -0.34 0.00 0.00 178.44 177.90 3m1a h VAL 214 N 0.68 0.31 0.00 1.05 -1.51 -1.31 -3.27 116.25 112.20 3m1a h VAL 214 Ca 0.16 -1.47 -0.07 0.00 -1.23 0.00 0.00 66.70 64.09 3m1a h VAL 214 Cb 0.28 2.01 -0.01 0.00 -2.13 0.00 0.00 31.29 31.44 3m1a h VAL 214 CO -0.00 0.17 -0.53 1.56 -1.23 0.00 0.00 177.57 177.54 3m1a h GLN 215 N 0.00 0.00 0.00 5.19 4.20 -1.32 -3.51 115.11 119.67 3m1a h GLN 215 Ca -0.02 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.69 3m1a h GLN 215 Cb 1.19 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.97 3m1a h GLN 215 CO 0.02 0.27 0.00 0.41 -0.67 0.00 0.00 178.83 178.87 3m1a n GLY 216 N 1.21 -1.75 0.00 3.46 0.00 -0.74 -5.09 105.19 102.28 3m1a n GLY 216 Ca 0.01 -1.35 0.00 0.00 0.00 0.00 0.00 46.02 44.68 3m1a n GLY 216 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3m1a n GLN 221 N -0.07 0.00 0.13 1.61 7.27 -1.23 -5.02 117.38 120.07 3m1a n GLN 221 Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 57.00 57.06 3m1a n GLN 221 Cb 0.00 0.00 0.22 0.00 2.41 0.00 0.00 30.24 32.87 3m1a n GLN 221 CO 0.00 0.00 0.00 -1.00 0.07 0.00 0.00 177.06 176.13 3m1a h PRO 222 N 0.00 0.09 -6.31 3.69 0.13 -1.91 -3.39 132.00 124.30 3m1a h PRO 222 Ca 0.00 -0.05 -0.56 0.00 -0.87 0.00 0.00 66.00 64.52 3m1a h PRO 222 Cb 0.00 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.09 3m1a h PRO 222 CO 0.00 0.58 0.01 0.20 -0.23 0.00 0.00 178.00 178.56 3m1a s GLY 223 N -4.35 2.70 -0.37 1.56 0.00 -0.42 -4.87 107.32 101.57 3m1a s GLY 223 Ca -0.03 0.08 -0.15 0.00 0.00 0.00 0.00 44.72 44.63 3m1a s GLY 223 CO 0.76 0.51 0.35 -0.35 0.00 0.00 0.00 173.10 174.37 3m1a s ASP 224 N -1.20 6.15 0.51 1.64 3.68 -1.26 -0.62 116.67 125.58 3m1a s ASP 224 Ca 0.32 -0.45 0.23 0.00 2.13 0.00 0.00 52.55 54.77 3m1a s ASP 224 Cb -0.20 -2.19 1.38 0.00 -1.45 0.00 0.00 42.92 40.47 3m1a s ASP 224 CO 0.20 -0.39 2.10 -0.65 0.13 0.00 0.00 175.17 176.57 3m1a h PRO 225 N 8.55 0.00 -0.50 4.34 0.11 -1.96 -1.66 132.00 140.87 3m1a h PRO 225 Ca -0.29 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.73 3m1a h PRO 225 Cb 1.14 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.23 3m1a h PRO 225 CO 0.71 0.10 -0.05 0.00 -0.21 0.00 0.00 178.00 178.55 3m1a h ALA 226 N 1.90 0.68 -0.12 -0.75 0.00 -1.93 -0.97 119.26 118.07 3m1a h ALA 226 Ca -0.00 -0.31 -0.09 0.00 0.00 0.00 0.00 54.91 54.50 3m1a h ALA 226 Cb 0.21 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 3m1a h ALA 226 CO 0.01 0.54 -0.35 0.87 0.00 0.00 0.00 179.25 180.32 3m1a h LYS 227 N 0.78 0.25 -0.45 0.00 1.57 -1.84 -2.28 116.57 114.60 3m1a h LYS 227 Ca 0.14 -0.10 -0.07 0.00 -1.87 0.00 0.00 60.65 58.74 3m1a h LYS 227 Cb 0.59 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.87 3m1a h LYS 227 CO 0.04 0.57 0.00 0.00 -0.57 0.00 0.00 179.45 179.49 3m1a h ALA 228 N 1.43 0.61 -0.97 3.86 0.00 -1.07 -1.73 119.26 121.39 3m1a h ALA 228 Ca 0.03 -0.27 0.04 0.00 0.00 0.00 0.00 54.91 54.70 3m1a h ALA 228 Cb 0.72 -0.17 -0.06 0.00 0.00 0.00 0.00 17.79 18.29 3m1a h ALA 228 CO 0.05 0.40 0.64 0.00 0.00 0.00 0.00 179.25 180.34 3m1a h ALA 229 N 0.91 1.37 -0.39 0.00 0.00 -0.94 -1.02 119.26 119.20 3m1a h ALA 229 Ca 0.13 -0.05 -0.14 0.00 0.00 0.00 0.00 54.91 54.85 3m1a h ALA 229 Cb 0.49 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 3m1a h ALA 229 CO 0.02 0.53 -0.31 0.00 0.00 0.00 0.00 179.25 179.49 3m1a h ALA 230 N 1.43 0.72 -0.67 0.00 0.00 -1.25 -2.20 119.26 117.29 3m1a h ALA 230 Ca 0.38 -0.42 -0.08 0.00 0.00 0.00 0.00 54.91 54.79 3m1a h ALA 230 Cb 0.00 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 3m1a h ALA 230 CO -0.12 0.66 0.10 0.00 0.00 0.00 0.00 179.25 179.89 3m1a h ALA 231 N 0.92 0.90 -0.23 0.00 0.00 -0.85 -0.01 119.26 119.99 3m1a h ALA 231 Ca 0.08 -0.28 0.01 0.00 0.00 0.00 0.00 54.91 54.72 3m1a h ALA 231 Cb 0.87 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 3m1a h ALA 231 CO 0.08 0.67 0.11 0.82 0.00 0.00 0.00 179.25 180.93 3m1a h ILE 232 N 1.04 0.99 -0.46 0.00 2.04 -1.08 -0.14 117.51 119.90 3m1a h ILE 232 Ca 0.20 -0.08 -0.08 0.00 1.00 0.00 0.00 64.86 65.91 3m1a h ILE 232 Cb 0.46 0.73 -0.02 0.00 -0.74 0.00 0.00 36.82 37.25 3m1a h ILE 232 CO 0.02 0.04 -0.02 0.03 0.00 0.00 0.00 178.15 178.22 3m1a h ARG 233 N 0.24 0.78 0.17 2.37 3.08 -1.12 -0.82 114.38 119.06 3m1a h ARG 233 Ca 0.09 -0.22 -0.01 0.00 0.07 0.00 0.00 59.98 59.92 3m1a h ARG 233 Cb 0.03 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 29.99 3m1a h ARG 233 CO -0.07 0.80 -0.09 1.25 -1.07 0.00 0.00 179.97 180.79 3m1a h LEU 234 N 0.72 -0.22 -0.58 3.04 7.12 -0.82 0.08 115.31 124.65 3m1a h LEU 234 Ca 0.14 0.01 0.08 0.00 0.13 0.00 0.00 57.88 58.24 3m1a h LEU 234 Cb 0.47 0.06 -0.07 0.00 -0.53 0.00 0.00 40.66 40.60 3m1a h LEU 234 CO 0.02 -0.15 0.22 0.00 -0.13 0.00 0.00 178.44 178.40 3m1a h ALA 235 N 0.59 0.74 -0.13 1.25 0.00 -0.70 -2.05 119.26 118.96 3m1a h ALA 235 Ca -0.02 0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 3m1a h ALA 235 Cb 0.20 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 3m1a h ALA 235 CO 0.03 -0.19 -0.15 -0.07 0.00 0.00 0.00 179.25 178.87 3m1a h LEU 236 N 0.41 0.20 -0.08 0.00 3.38 -0.95 -3.03 115.31 115.24 3m1a h LEU 236 Ca 0.29 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.21 3m1a h LEU 236 Cb 0.33 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.03 3m1a h LEU 236 CO -0.28 0.37 -0.23 0.47 0.09 0.00 0.00 178.44 178.86 3m1a n ASP 237 N -4.26 0.35 -4.80 -0.43 8.00 -0.00 -4.89 116.55 110.51 3m1a n ASP 237 Ca -0.01 -0.11 -0.37 0.00 0.71 0.00 0.00 54.79 55.01 3m1a n ASP 237 Cb 0.28 -0.08 -0.06 0.00 -0.02 0.00 0.00 41.12 41.23 3m1a n ASP 237 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3m1a s THR 238 N -2.85 4.49 0.13 -3.53 2.01 -0.82 -5.01 115.64 110.07 3m1a s THR 238 Ca 0.17 1.44 -0.29 0.00 0.31 0.00 0.00 61.69 63.32 3m1a s THR 238 Cb 0.19 -3.95 -0.09 0.00 0.01 0.00 0.00 72.50 68.66 3m1a s THR 238 CO 0.58 0.31 1.49 1.05 -0.69 0.00 0.00 174.62 177.37 3m1a h GLU 239 N 3.73 -0.21 -4.89 4.92 9.09 -1.90 -3.21 114.58 122.10 3m1a h GLU 239 Ca -0.48 0.01 -0.69 0.00 0.05 0.00 0.00 59.36 58.26 3m1a h GLU 239 Cb 1.20 0.05 -0.18 0.00 -1.65 0.00 0.00 28.75 28.16 3m1a h GLU 239 CO 0.65 -0.14 -0.22 -1.59 0.05 0.00 0.00 179.01 177.76 3m1a s LYS 240 N -5.33 3.21 -0.07 1.06 0.00 -1.26 -5.06 119.74 112.30 3m1a s LYS 240 Ca -0.12 -0.67 -0.28 0.00 0.00 0.00 0.00 55.97 54.90 3m1a s LYS 240 Cb 0.08 -3.93 -0.02 0.00 0.00 0.00 0.00 37.83 33.96 3m1a s LYS 240 CO 0.56 -0.77 0.92 0.99 0.00 0.00 0.00 175.35 177.04 3m1a s THR 241 N 2.11 4.88 0.61 3.79 2.01 -1.22 -5.04 115.64 122.79 3m1a s THR 241 Ca 0.12 1.89 -0.19 0.00 0.31 0.00 0.00 61.69 63.82 3m1a s THR 241 Cb -0.17 -4.25 -0.03 0.00 0.01 0.00 0.00 72.50 68.07 3m1a s THR 241 CO 0.13 0.11 1.22 -0.81 -0.69 0.00 0.00 174.62 174.58 3m1a n PRO 242 N 4.39 1.18 -0.04 4.92 -0.04 -1.26 -4.94 135.00 139.20 3m1a n PRO 242 Ca 0.05 0.45 -0.07 0.00 -0.04 0.00 0.00 63.50 63.90 3m1a n PRO 242 Cb 0.50 -2.44 0.11 0.00 -0.04 0.00 0.00 33.50 31.62 3m1a n PRO 242 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 3m1a h LEU 243 N 0.71 0.68 -8.44 1.53 5.85 -1.95 -3.43 115.31 110.27 3m1a h LEU 243 Ca -0.50 -0.27 -0.63 0.00 0.84 0.00 0.00 57.88 57.33 3m1a h LEU 243 Cb 1.34 -0.19 -0.30 0.00 0.37 0.00 0.00 40.66 41.88 3m1a h LEU 243 CO 0.53 0.94 -0.86 -0.13 -0.34 0.00 0.00 178.44 178.58 3m1a s ARG 244 N -4.45 1.88 -0.30 1.25 0.52 -1.26 0.03 118.95 116.61 3m1a s ARG 244 Ca -0.08 -0.77 0.02 0.00 -0.52 0.00 0.00 55.73 54.37 3m1a s ARG 244 Cb 0.13 -1.75 0.09 0.00 0.52 0.00 0.00 34.95 33.93 3m1a s ARG 244 CO 0.83 0.43 0.02 -1.17 0.02 0.00 0.00 175.30 175.43 3m1a s LEU 245 N -0.39 3.56 0.51 2.53 0.20 0.47 -4.93 118.68 120.62 3m1a s LEU 245 Ca 0.05 -1.74 -0.21 0.00 0.69 0.00 0.00 54.13 52.93 3m1a s LEU 245 Cb -0.10 -1.34 -0.06 0.00 -0.43 0.00 0.00 46.19 44.26 3m1a s LEU 245 CO 0.00 -0.34 1.14 0.00 -0.29 0.00 0.00 176.35 176.87 3m1a s ALA 246 N 1.20 2.79 -0.08 5.97 0.00 -1.26 -0.49 121.76 129.89 3m1a s ALA 246 Ca 0.05 0.86 -0.00 0.00 0.00 0.00 0.00 51.96 52.87 3m1a s ALA 246 Cb -0.19 -3.37 0.02 0.00 0.00 0.00 0.00 23.12 19.59 3m1a s ALA 246 CO -0.11 -0.72 -0.05 -0.51 0.00 0.00 0.00 175.76 174.36 3m1a s LEU 247 N -3.54 1.09 0.00 0.00 1.43 -0.45 -4.82 118.68 112.39 3m1a s LEU 247 Ca 0.70 -0.20 0.00 0.00 -1.03 0.00 0.00 54.13 53.60 3m1a s LEU 247 Cb -0.25 -0.63 0.00 0.00 0.03 0.00 0.00 46.19 45.34 3m1a s LEU 247 CO 0.29 -0.11 0.00 0.61 0.23 0.00 0.00 176.35 177.37 3m1a n GLY 248 N 4.67 2.50 0.25 -3.19 0.00 -1.26 -0.82 105.19 107.33 3m1a n GLY 248 Ca -0.15 -1.50 0.04 0.00 0.00 0.00 0.00 46.02 44.41 3m1a n GLY 248 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3m1a h GLY 249 N 0.00 0.21 0.98 -0.02 0.00 -1.98 -2.44 103.07 99.82 3m1a h GLY 249 Ca 0.00 -0.11 -0.00 0.00 0.00 0.00 0.00 47.33 47.21 3m1a h GLY 249 CO 0.00 0.11 0.23 1.29 0.00 0.00 0.00 176.54 178.17 3m1a h ASP 250 N 0.19 0.48 -0.84 0.19 2.03 -1.98 -0.63 116.42 115.85 3m1a h ASP 250 Ca 0.04 -0.06 -0.00 0.00 -0.73 0.00 0.00 57.03 56.28 3m1a h ASP 250 Cb 0.27 -0.12 -0.04 0.00 -0.83 0.00 0.00 39.33 38.61 3m1a h ASP 250 CO 0.01 0.40 0.53 0.00 -1.03 0.00 0.00 179.24 179.15 3m1a h ALA 251 N 1.10 1.07 -0.64 4.15 0.00 -1.71 -1.72 119.26 121.51 3m1a h ALA 251 Ca 0.14 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 3m1a h ALA 251 Cb 0.02 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.44 3m1a h ALA 251 CO -0.03 0.52 0.39 0.28 0.00 0.00 0.00 179.25 180.41 3m1a h VAL 252 N 1.15 1.18 -0.47 0.00 2.07 -1.12 -0.73 116.25 118.34 3m1a h VAL 252 Ca 0.30 -0.40 -0.13 0.00 0.82 0.00 0.00 66.70 67.29 3m1a h VAL 252 Cb -0.08 0.30 -0.01 0.00 -1.52 0.00 0.00 31.29 29.98 3m1a h VAL 252 CO -0.06 0.19 -0.22 0.44 0.02 0.00 0.00 177.57 177.94 3m1a h ASP 253 N 0.87 1.01 -0.32 0.57 3.32 -0.87 -1.41 116.42 119.59 3m1a h ASP 253 Ca 0.23 -0.40 0.03 0.00 0.02 0.00 0.00 57.03 56.91 3m1a h ASP 253 Cb -0.03 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.20 3m1a h ASP 253 CO -0.04 1.19 0.12 -0.26 -1.72 0.00 0.00 179.24 178.52 3m1a h PHE 254 N 0.83 0.22 -0.47 4.55 0.04 -1.06 -1.61 116.94 119.44 3m1a h PHE 254 Ca 0.11 0.02 -0.09 0.00 2.80 0.00 0.00 57.97 60.80 3m1a h PHE 254 Cb 0.80 -0.05 -0.02 0.00 2.20 0.00 0.00 35.95 38.89 3m1a h PHE 254 CO 0.05 0.10 -0.06 -0.07 -0.60 0.00 0.00 178.31 177.73 3m1a h LEU 255 N 0.26 0.86 -0.22 1.54 3.38 -1.03 -2.02 115.31 118.09 3m1a h LEU 255 Ca 0.14 -0.34 -0.01 0.00 0.09 0.00 0.00 57.88 57.76 3m1a h LEU 255 Cb 0.10 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 3m1a h LEU 255 CO -0.14 1.00 0.10 0.74 0.09 0.00 0.00 178.44 180.23 3m1a h THR 256 N 0.71 1.15 -0.80 0.22 2.02 -1.16 -0.23 112.91 114.84 3m1a h THR 256 Ca 0.13 -0.45 -0.01 0.00 0.77 0.00 0.00 66.41 66.85 3m1a h THR 256 Cb 0.59 1.04 -0.04 0.00 -1.74 0.00 0.00 68.15 68.00 3m1a h THR 256 CO 0.04 0.15 0.47 1.23 0.37 0.00 0.00 175.52 177.78 3m1a h GLY 257 N 0.22 1.16 0.72 2.16 0.00 -1.22 0.62 103.07 106.74 3m1a h GLY 257 Ca 0.08 -0.49 -0.02 0.00 0.00 0.00 0.00 47.33 46.90 3m1a h GLY 257 CO -0.01 0.47 -0.02 0.84 0.00 0.00 0.00 176.54 177.83 3m1a h HIS 258 N 1.09 0.20 -0.68 5.60 6.17 -1.23 -1.66 115.15 124.65 3m1a h HIS 258 Ca 0.28 -0.04 0.14 0.00 0.71 0.00 0.00 60.37 61.46 3m1a h HIS 258 Cb -0.03 -0.05 -0.10 0.00 2.52 0.00 0.00 27.41 29.75 3m1a h HIS 258 CO -0.00 0.48 0.14 -0.07 0.71 0.00 0.00 177.93 179.18 3m1a h LEU 259 N -0.14 -0.02 -0.49 0.26 3.38 -0.75 -0.69 115.31 116.87 3m1a h LEU 259 Ca 0.02 0.13 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 3m1a h LEU 259 Cb 0.41 0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.32 3m1a h LEU 259 CO 0.01 -0.03 0.26 0.44 0.09 0.00 0.00 178.44 179.22 3m1a h ASP 260 N 0.25 0.62 0.34 -0.43 3.32 -0.77 -0.89 116.42 118.87 3m1a h ASP 260 Ca 0.37 -0.10 -0.22 0.00 0.02 0.00 0.00 57.03 57.10 3m1a h ASP 260 Cb 0.60 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.99 3m1a h ASP 260 CO -0.47 0.54 -0.92 0.77 -1.72 0.00 0.00 179.24 177.44 3m1a h SER 261 N 0.65 0.52 -0.21 6.45 4.64 -0.88 -0.52 113.55 124.20 3m1a h SER 261 Ca 0.17 -0.41 -0.01 0.00 -0.47 0.00 0.00 61.79 61.07 3m1a h SER 261 Cb 0.06 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 61.99 3m1a h SER 261 CO -0.03 1.21 0.08 0.58 -0.87 0.00 0.00 176.83 177.80 3m1a h VAL 262 N 0.23 1.17 -0.86 0.95 2.07 -1.12 -0.94 116.25 117.75 3m1a h VAL 262 Ca -0.07 -0.51 -0.02 0.00 0.82 0.00 0.00 66.70 66.91 3m1a h VAL 262 Cb 1.56 1.12 -0.04 0.00 -1.52 0.00 0.00 31.29 32.40 3m1a h VAL 262 CO 0.16 0.17 0.44 -0.09 0.02 0.00 0.00 177.57 178.26 3m1a h ARG 263 N 0.18 1.21 -0.59 1.57 2.43 -1.13 -1.11 114.38 116.96 3m1a h ARG 263 Ca 0.07 -0.16 -0.02 0.00 -0.81 0.00 0.00 59.98 59.06 3m1a h ARG 263 Cb 0.18 -0.23 -0.03 0.00 -0.42 0.00 0.00 29.97 29.48 3m1a h ARG 263 CO -0.01 0.91 0.30 0.00 -1.51 0.00 0.00 179.97 179.67 3m1a h ALA 264 N 1.27 0.75 -0.06 2.80 0.00 -0.86 -1.84 119.26 121.33 3m1a h ALA 264 Ca 0.30 -0.12 -0.20 0.00 0.00 0.00 0.00 54.91 54.89 3m1a h ALA 264 Cb 0.08 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.63 3m1a h ALA 264 CO -0.04 0.29 -0.80 1.49 0.00 0.00 0.00 179.25 180.20 3m1a h GLU 265 N 0.79 0.44 -0.09 0.00 4.81 -1.01 0.06 114.58 119.59 3m1a h GLU 265 Ca 0.20 -0.39 0.03 0.00 -0.13 0.00 0.00 59.36 59.07 3m1a h GLU 265 Cb 0.08 0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.53 3m1a h GLU 265 CO -0.03 1.04 -0.07 1.25 -0.73 0.00 0.00 179.01 180.47 3m1a h LEU 266 N 0.29 -0.21 -0.48 1.64 5.85 -1.13 -1.87 115.31 119.40 3m1a h LEU 266 Ca -0.05 0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.69 3m1a h LEU 266 Cb 1.39 0.11 -0.02 0.00 0.37 0.00 0.00 40.66 42.51 3m1a h LEU 266 CO 0.14 -0.09 0.18 0.74 -0.34 0.00 0.00 178.44 179.07 3m1a h THR 267 N -0.07 1.21 -0.31 1.05 2.02 -1.19 -1.31 112.91 114.31 3m1a h THR 267 Ca 0.06 -0.68 0.07 0.00 0.77 0.00 0.00 66.41 66.63 3m1a h THR 267 Cb 0.16 0.76 -0.08 0.00 -1.74 0.00 0.00 68.15 67.25 3m1a h THR 267 CO -0.14 0.25 -0.20 -0.08 0.37 0.00 0.00 175.52 175.73 3m1a h GLU 268 N 0.64 -0.16 -0.43 6.66 4.81 -0.74 -2.79 114.58 122.57 3m1a h GLU 268 Ca 0.16 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.40 3m1a h GLU 268 Cb 0.22 0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.63 3m1a h GLU 268 CO -0.01 -0.10 0.00 0.91 -0.73 0.00 0.00 179.01 179.07 3m1a n TRP 269 N -5.36 0.57 -0.35 0.92 7.02 -0.73 -4.64 117.44 114.88 3m1a n TRP 269 Ca 0.01 -0.29 0.04 0.00 -1.02 0.00 0.00 57.50 56.24 3m1a n TRP 269 Cb 0.27 0.00 0.21 0.00 -2.42 0.00 0.00 31.31 29.38 3m1a n TRP 269 CO 0.00 0.00 0.00 1.49 -2.02 0.00 0.00 177.69 177.16 3m1a h GLU 270 N 3.12 1.06 -0.41 -0.99 4.81 -0.95 -1.70 114.58 119.52 3m1a h GLU 270 Ca 0.00 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.15 3m1a h GLU 270 Cb 0.70 -0.24 -0.02 0.00 0.63 0.00 0.00 28.75 29.83 3m1a h GLU 270 CO 0.00 0.70 0.18 0.87 -0.73 0.00 0.00 179.01 180.03 3m1a h LYS 271 N 1.09 0.60 -0.73 1.92 1.57 -1.82 -0.05 116.57 119.15 3m1a h LYS 271 Ca 0.43 -0.10 -0.00 0.00 -1.87 0.00 0.00 60.65 59.11 3m1a h LYS 271 Cb 0.25 -0.10 -0.04 0.00 0.08 0.00 0.00 32.23 32.42 3m1a h LYS 271 CO -0.18 0.54 0.44 0.28 -0.57 0.00 0.00 179.45 179.97 3m1a h VAL 272 N 0.52 1.21 -0.03 0.50 2.07 -1.78 -0.09 116.25 118.64 3m1a h VAL 272 Ca 0.14 -0.45 0.03 0.00 0.82 0.00 0.00 66.70 67.23 3m1a h VAL 272 Cb 0.16 0.19 -0.03 0.00 -1.52 0.00 0.00 31.29 30.08 3m1a h VAL 272 CO -0.01 0.21 -0.14 0.28 0.02 0.00 0.00 177.57 177.93 3m1a h SER 273 N 1.00 -0.43 1.36 0.57 0.02 -0.80 -2.49 113.55 112.77 3m1a h SER 273 Ca 0.26 0.07 -0.01 0.00 -0.84 0.00 0.00 61.79 61.27 3m1a h SER 273 Cb -0.04 0.19 -0.00 0.00 0.14 0.00 0.00 62.40 62.69 3m1a h SER 273 CO -0.05 -0.20 -0.06 0.03 -1.14 0.00 0.00 176.83 175.41 3m1a h ARG 274 N -0.23 0.00 0.00 3.45 3.08 -0.90 -3.16 114.38 116.63 3m1a h ARG 274 Ca 0.06 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.11 3m1a h ARG 274 Cb 0.30 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.35 3m1a h ARG 274 CO -0.16 0.06 0.00 0.41 -1.07 0.00 0.00 179.97 179.21 3m1a n GLY 275 N 0.47 -1.03 0.05 0.04 0.00 -0.06 -2.32 105.19 102.34 3m1a n GLY 275 Ca 0.02 0.04 0.13 0.00 0.00 0.00 0.00 46.02 46.21 3m1a n GLY 275 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3m1a n THR 276 N -1.88 0.29 -2.20 2.61 -2.24 -1.19 -4.84 114.28 104.84 3m1a n THR 276 Ca 0.02 -0.16 -0.41 0.00 -2.27 0.00 0.00 64.05 61.23 3m1a n THR 276 Cb 0.16 -0.39 -0.03 0.00 -2.10 0.00 0.00 70.33 67.97 3m1a n THR 276 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 3m1a s ASP 277 N -3.80 6.88 0.00 3.42 1.01 -0.98 -5.20 116.67 118.00 3m1a s ASP 277 Ca 0.11 2.49 0.15 0.00 0.71 0.00 0.00 52.55 56.01 3m1a s ASP 277 Cb 0.15 -2.62 0.92 0.00 1.01 0.00 0.00 42.92 42.38 3m1a s ASP 277 CO 0.61 -0.51 1.34 0.49 0.21 0.00 0.00 175.17 177.30