#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3m1a s LYS 6 N 0.00 3.91 -0.32 0.00 3.01 -1.26 -4.90 119.74 120.18 3m1a s LYS 6 Ca 0.00 0.40 -0.16 0.00 -1.01 0.00 0.00 55.97 55.20 3m1a s LYS 6 Cb 0.00 -2.85 -0.02 0.00 -1.01 0.00 0.00 37.83 33.95 3m1a s LYS 6 CO 0.00 0.44 0.41 0.08 0.51 0.00 0.00 175.35 176.79 3m1a s VAL 7 N -1.56 5.12 -0.19 3.17 1.01 -1.26 -1.81 120.40 124.88 3m1a s VAL 7 Ca 0.40 0.34 -0.07 0.00 0.00 0.00 0.00 61.98 62.64 3m1a s VAL 7 Cb -0.14 -3.82 -0.04 0.00 0.00 0.00 0.00 36.38 32.38 3m1a s VAL 7 CO 0.20 -0.04 0.06 0.26 0.00 0.00 0.00 175.10 175.59 3m1a s TRP 8 N 2.15 3.24 -0.23 5.22 0.52 0.78 -0.83 118.94 129.80 3m1a s TRP 8 Ca 0.15 0.05 -0.03 0.00 0.02 0.00 0.00 56.10 56.29 3m1a s TRP 8 Cb -0.16 -2.09 0.00 0.00 -1.15 0.00 0.00 33.47 30.07 3m1a s TRP 8 CO 0.11 0.12 -0.04 -1.17 0.02 0.00 0.00 176.95 176.00 3m1a s LEU 9 N 0.45 3.00 -0.20 2.99 2.96 0.11 0.51 118.68 128.50 3m1a s LEU 9 Ca 0.03 -0.52 0.01 0.00 -0.22 0.00 0.00 54.13 53.43 3m1a s LEU 9 Cb -0.13 -1.73 0.04 0.00 0.50 0.00 0.00 46.19 44.88 3m1a s LEU 9 CO 0.01 -0.05 -0.13 -0.69 -1.32 0.00 0.00 176.35 174.16 3m1a s VAL 10 N 1.44 1.81 0.42 1.68 1.01 -0.02 -0.53 120.40 126.22 3m1a s VAL 10 Ca 0.04 -1.03 -0.15 0.00 0.00 0.00 0.00 61.98 60.85 3m1a s VAL 10 Cb -0.15 -1.80 -0.08 0.00 0.00 0.00 0.00 36.38 34.35 3m1a s VAL 10 CO -0.03 0.27 0.86 0.42 0.00 0.00 0.00 175.10 176.61 3m1a s THR 11 N 1.34 4.62 -1.32 3.92 -4.23 -0.29 -0.80 115.64 118.87 3m1a s THR 11 Ca 0.00 1.02 -0.04 0.00 -1.18 0.00 0.00 61.69 61.48 3m1a s THR 11 Cb -0.15 -3.68 0.02 0.00 1.34 0.00 0.00 72.50 70.02 3m1a s THR 11 CO -0.09 -0.46 0.95 0.61 -0.54 0.00 0.00 174.62 175.09 3m1a n GLY 12 N -1.06 -0.40 0.18 3.99 0.00 -0.77 -2.71 105.19 104.41 3m1a n GLY 12 Ca 0.05 0.16 0.14 0.00 0.00 0.00 0.00 46.02 46.37 3m1a n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m1a n ALA 13 N -4.46 2.74 1.21 4.61 0.00 -0.17 -3.92 120.51 120.52 3m1a n ALA 13 Ca -0.17 -0.30 0.13 0.00 0.00 0.00 0.00 53.44 53.10 3m1a n ALA 13 Cb 0.62 -1.31 0.42 0.00 0.00 0.00 0.00 19.45 19.18 3m1a n ALA 13 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3m1a n SER 14 N -0.71 0.72 -3.62 0.00 3.41 -1.26 -2.57 113.62 109.59 3m1a n SER 14 Ca 0.17 -0.59 -0.11 0.00 -0.26 0.00 0.00 58.87 58.08 3m1a n SER 14 Cb 0.27 0.08 -0.04 0.00 -0.26 0.00 0.00 64.21 64.26 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 -2.64 -0.31 1.01 4.04 1.04 -1.25 -4.84 113.70 110.75 3m1a s SER 15 Ca 0.22 -0.29 0.00 0.00 0.48 0.00 0.00 55.95 56.35 3m1a s SER 15 Cb 0.19 0.53 0.00 0.00 0.10 0.00 0.00 66.02 66.84 3m1a s SER 15 CO 0.55 -0.93 0.00 0.61 0.98 0.00 0.00 173.24 174.45 3m1a n GLY 16 N -0.29 2.93 0.23 7.32 0.00 0.28 -2.79 105.19 112.87 3m1a n GLY 16 Ca -0.15 -0.32 -0.04 0.00 0.00 0.00 0.00 46.02 45.51 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 0.64 -0.39 1.61 0.05 -1.90 -2.56 116.94 114.39 3m1a h PHE 17 Ca 0.00 0.02 0.08 0.00 3.82 0.00 0.00 57.97 61.89 3m1a h PHE 17 Cb 0.00 -0.20 -0.09 0.00 2.00 0.00 0.00 35.95 37.66 3m1a h PHE 17 CO 0.00 0.35 -0.22 0.78 -0.18 0.00 0.00 178.31 179.04 3m1a h GLY 18 N 0.67 0.03 0.99 -1.45 0.00 -1.66 0.28 103.07 101.93 3m1a h GLY 18 Ca 0.24 0.28 0.00 0.00 0.00 0.00 0.00 47.33 47.85 3m1a h GLY 18 CO -0.12 -0.20 0.31 -0.09 0.00 0.00 0.00 176.54 176.44 3m1a h ARG 19 N -0.15 0.66 -0.60 4.80 2.43 -1.32 0.28 114.38 120.48 3m1a h ARG 19 Ca 0.19 -0.05 -0.10 0.00 -0.81 0.00 0.00 59.98 59.21 3m1a h ARG 19 Cb 0.45 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 29.83 3m1a h ARG 19 CO -0.49 0.47 -0.00 0.00 -1.51 0.00 0.00 179.97 178.44 3m1a h ALA 20 N 1.16 0.82 -0.52 2.80 0.00 -1.02 0.17 119.26 122.66 3m1a h ALA 20 Ca 0.18 -0.31 -0.07 0.00 0.00 0.00 0.00 54.91 54.71 3m1a h ALA 20 Cb -0.03 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 3m1a h ALA 20 CO -0.04 0.66 0.07 0.82 0.00 0.00 0.00 179.25 180.77 3m1a h ILE 21 N 0.97 1.25 -0.35 0.00 2.04 -0.36 -1.30 117.51 119.77 3m1a h ILE 21 Ca 0.17 -0.97 -0.05 0.00 1.00 0.00 0.00 64.86 65.01 3m1a h ILE 21 Cb 0.56 0.87 -0.01 0.00 -0.74 0.00 0.00 36.82 37.50 3m1a h ILE 21 CO 0.03 0.35 0.03 0.00 0.00 0.00 0.00 178.15 178.56 3m1a h ALA 22 N 0.98 0.47 -0.77 1.87 0.00 -0.66 -1.87 119.26 119.27 3m1a h ALA 22 Ca 0.16 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 3m1a h ALA 22 Cb 0.42 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 3m1a h ALA 22 CO 0.01 0.19 0.30 0.93 0.00 0.00 0.00 179.25 180.69 3m1a h GLU 23 N 0.42 1.15 0.00 0.00 5.08 -0.96 -2.77 114.58 117.50 3m1a h GLU 23 Ca 0.10 -0.21 -0.10 0.00 -1.00 0.00 0.00 59.36 58.15 3m1a h GLU 23 Cb 0.40 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 3m1a h GLU 23 CO 0.01 0.94 -0.46 0.00 -1.00 0.00 0.00 179.01 178.50 3m1a h ALA 24 N 1.16 1.15 -0.09 3.43 0.00 -1.05 -1.84 119.26 122.02 3m1a h ALA 24 Ca 0.26 -0.42 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 3m1a h ALA 24 Cb 0.22 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3m1a h ALA 24 CO -0.02 0.58 -0.20 0.00 0.00 0.00 0.00 179.25 179.61 3m1a h ALA 25 N 1.54 0.15 -0.79 0.00 0.00 -1.22 -2.49 119.26 116.44 3m1a h ALA 25 Ca -0.00 -0.37 -0.03 0.00 0.00 0.00 0.00 54.91 54.51 3m1a h ALA 25 Cb 0.86 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.59 3m1a h ALA 25 CO 0.06 0.09 0.40 -0.39 0.00 0.00 0.00 179.25 179.41 3m1a h VAL 26 N -0.16 1.25 -0.23 0.00 -1.51 -1.46 -0.44 116.25 113.69 3m1a h VAL 26 Ca 0.00 -0.67 0.04 0.00 -1.23 0.00 0.00 66.70 64.85 3m1a h VAL 26 Cb 0.80 0.23 -0.01 0.00 -2.13 0.00 0.00 31.29 30.17 3m1a h VAL 26 CO 0.04 0.29 0.16 0.00 -1.23 0.00 0.00 177.57 176.84 3m1a h ALA 27 N 1.21 2.07 -0.01 5.19 0.00 -1.38 -1.45 119.26 124.90 3m1a h ALA 27 Ca 0.27 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.18 3m1a h ALA 27 Cb 0.09 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.86 3m1a h ALA 27 CO -0.04 -0.12 -0.06 0.00 0.00 0.00 0.00 179.25 179.02 3m1a n ALA 28 N -2.55 2.72 0.00 0.00 0.00 -0.72 -4.90 120.51 115.05 3m1a n ALA 28 Ca 0.02 -0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.11 3m1a n ALA 28 Cb 0.23 -1.26 0.00 0.00 0.00 0.00 0.00 19.45 18.42 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 1.19 0.83 3.91 0.00 0.00 -0.55 -5.08 105.19 105.49 3m1a n GLY 29 Ca 0.18 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.34 4.92 -0.20 1.61 -0.00 -0.25 -4.83 116.67 115.57 3m1a s ASP 30 Ca 0.00 0.77 -0.08 0.00 -0.00 0.00 0.00 52.55 53.24 3m1a s ASP 30 Cb 0.00 -1.43 -0.04 0.00 -0.00 0.00 0.00 42.92 41.45 3m1a s ASP 30 CO 0.00 -1.60 0.10 -0.89 -0.00 0.00 0.00 175.17 172.77 3m1a s THR 31 N -3.38 4.97 -0.09 -1.27 2.01 -0.75 -4.18 115.64 112.95 3m1a s THR 31 Ca 0.60 0.04 0.04 0.00 0.31 0.00 0.00 61.69 62.67 3m1a s THR 31 Cb -0.11 -3.27 0.00 0.00 0.01 0.00 0.00 72.50 69.13 3m1a s THR 31 CO 0.48 0.42 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.93 3m1a s VAL 32 N 0.63 1.83 -0.26 3.82 1.01 0.53 -0.15 120.40 127.82 3m1a s VAL 32 Ca 0.05 -0.89 -0.07 0.00 0.00 0.00 0.00 61.98 61.07 3m1a s VAL 32 Cb -0.13 -1.60 -0.01 0.00 0.00 0.00 0.00 36.38 34.65 3m1a s VAL 32 CO 0.01 0.51 0.06 -0.63 0.00 0.00 0.00 175.10 175.05 3m1a s ILE 33 N 0.38 4.04 -0.14 2.22 1.09 0.18 -1.11 121.20 127.87 3m1a s ILE 33 Ca -0.17 -0.40 -0.05 0.00 -1.10 0.00 0.00 60.65 58.93 3m1a s ILE 33 Cb -0.17 -2.95 -0.04 0.00 -1.06 0.00 0.00 42.46 38.24 3m1a s ILE 33 CO 0.07 0.26 0.03 -0.83 -0.10 0.00 0.00 174.94 174.37 3m1a s GLY 34 N 1.55 1.87 0.04 6.18 0.00 0.55 -0.84 107.32 116.68 3m1a s GLY 34 Ca 0.05 -0.77 0.05 0.00 0.00 0.00 0.00 44.72 44.05 3m1a s GLY 34 CO 0.02 -0.22 -0.09 -0.51 0.00 0.00 0.00 173.10 172.31 3m1a s THR 35 N -0.17 3.48 0.22 0.90 -4.23 0.02 -1.08 115.64 114.77 3m1a s THR 35 Ca 0.06 -0.97 -0.13 0.00 -1.18 0.00 0.00 61.69 59.46 3m1a s THR 35 Cb -0.12 -2.55 0.00 0.00 1.34 0.00 0.00 72.50 71.17 3m1a s THR 35 CO 0.02 0.29 0.46 0.00 -0.54 0.00 0.00 174.62 174.85 3m1a s ALA 36 N -1.07 -0.39 0.13 3.99 0.00 -0.98 -1.00 121.76 122.45 3m1a s ALA 36 Ca 0.18 -0.70 -0.18 0.00 0.00 0.00 0.00 51.96 51.26 3m1a s ALA 36 Cb -0.11 0.97 -0.03 0.00 0.00 0.00 0.00 23.12 23.95 3m1a s ALA 36 CO 0.10 -0.81 1.76 0.00 0.00 0.00 0.00 175.76 176.81 3m1a h ARG 37 N 2.29 0.40 -5.09 0.00 2.47 -1.87 0.13 114.38 112.70 3m1a h ARG 37 Ca -0.28 -0.03 -0.65 0.00 -1.26 0.00 0.00 59.98 57.76 3m1a h ARG 37 Cb 1.25 -0.09 -0.27 0.00 -1.65 0.00 0.00 29.97 29.22 3m1a h ARG 37 CO 0.38 0.30 -0.72 1.03 0.56 0.00 0.00 179.97 181.52 3m1a s ARG 38 N -6.03 3.42 0.26 0.04 1.81 -1.26 -4.45 118.95 112.74 3m1a s ARG 38 Ca -0.13 -0.62 -0.02 0.00 -1.72 0.00 0.00 55.73 53.24 3m1a s ARG 38 Cb 0.09 -2.93 0.48 0.00 -0.45 0.00 0.00 34.95 32.14 3m1a s ARG 38 CO 0.71 -0.06 1.78 1.79 -0.68 0.00 0.00 175.30 178.83 3m1a h THR 39 N 5.58 0.79 0.00 0.02 1.35 -1.86 -1.79 112.91 116.99 3m1a h THR 39 Ca -0.37 -0.23 0.00 0.00 -0.55 0.00 0.00 66.41 65.26 3m1a h THR 39 Cb 1.17 0.06 0.00 0.00 -1.73 0.00 0.00 68.15 67.66 3m1a h THR 39 CO 0.60 0.12 0.00 -0.62 -0.25 0.00 0.00 175.52 175.37 3m1a n GLU 40 N -4.84 0.10 0.29 4.72 4.71 -1.26 -1.63 120.64 122.73 3m1a n GLU 40 Ca 0.16 0.51 0.18 0.00 -0.01 0.00 0.00 57.16 58.00 3m1a n GLU 40 Cb 0.38 -1.76 0.83 0.00 -1.01 0.00 0.00 31.44 29.87 3m1a n GLU 40 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3m1a h ALA 41 N 2.11 1.02 -0.53 0.62 0.00 -1.75 -2.74 119.26 117.99 3m1a h ALA 41 Ca 0.00 -0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.73 3m1a h ALA 41 Cb 0.10 -0.00 -0.10 0.00 0.00 0.00 0.00 17.79 17.79 3m1a h ALA 41 CO 0.00 0.02 0.13 1.28 0.00 0.00 0.00 179.25 180.69 3m1a n LEU 42 N -3.14 5.05 0.11 0.00 4.77 -0.65 -4.72 117.00 118.43 3m1a n LEU 42 Ca -0.01 -3.33 0.03 0.00 -0.03 0.00 0.00 56.01 52.68 3m1a n LEU 42 Cb 0.24 -0.67 0.40 0.00 -2.33 0.00 0.00 43.42 41.07 3m1a n LEU 42 CO 0.26 0.89 0.93 0.44 -1.33 0.00 0.00 177.39 178.58 3m1a h ASP 43 N 1.92 0.26 0.07 -1.43 5.19 -1.64 -2.81 116.42 117.98 3m1a h ASP 43 Ca 0.20 -0.04 -0.24 0.00 -0.62 0.00 0.00 57.03 56.33 3m1a h ASP 43 Cb 1.96 -0.07 0.01 0.00 0.18 0.00 0.00 39.33 41.41 3m1a h ASP 43 CO 0.53 0.37 -0.93 -2.24 -3.12 0.00 0.00 179.24 173.85 3m1a h ASP 44 N 0.27 0.79 -0.72 6.45 -0.00 -1.86 -2.27 116.42 119.08 3m1a h ASP 44 Ca 0.06 -0.60 -0.05 0.00 -0.00 0.00 0.00 57.03 56.44 3m1a h ASP 44 Cb 0.30 -0.24 -0.03 0.00 -0.00 0.00 0.00 39.33 39.36 3m1a h ASP 44 CO 0.01 1.39 0.25 0.25 -0.00 0.00 0.00 179.24 181.15 3m1a h LEU 45 N 0.38 1.03 -0.16 0.15 5.85 -1.90 -2.88 115.31 117.78 3m1a h LEU 45 Ca -0.09 -0.19 -0.20 0.00 0.84 0.00 0.00 57.88 58.24 3m1a h LEU 45 Cb 1.57 -0.27 0.01 0.00 0.37 0.00 0.00 40.66 42.34 3m1a h LEU 45 CO 0.18 0.95 -0.68 0.58 -0.34 0.00 0.00 178.44 179.13 3m1a h VAL 46 N 1.06 1.30 0.00 1.05 2.07 -1.55 -2.27 116.25 117.91 3m1a h VAL 46 Ca 0.24 -1.90 0.00 0.00 0.82 0.00 0.00 66.70 65.86 3m1a h VAL 46 Cb 0.27 1.99 0.00 0.00 -1.52 0.00 0.00 31.29 32.03 3m1a h VAL 46 CO -0.01 0.60 0.00 0.00 0.02 0.00 0.00 177.57 178.17 3m1a h ALA 47 N 0.55 1.00 0.00 1.67 0.00 -1.43 -1.93 119.26 119.11 3m1a h ALA 47 Ca -0.04 0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.73 3m1a h ALA 47 Cb 1.31 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.07 3m1a h ALA 47 CO 0.14 0.00 -1.68 0.00 0.00 0.00 0.00 179.25 177.71 3m1a n ALA 48 N -2.06 2.17 -3.24 0.00 0.00 -1.09 -4.51 120.51 111.78 3m1a n ALA 48 Ca 0.01 -0.64 -0.24 0.00 0.00 0.00 0.00 53.44 52.57 3m1a n ALA 48 Cb 0.30 -0.79 -0.07 0.00 0.00 0.00 0.00 19.45 18.90 3m1a n ALA 48 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3m1a n TYR 49 N -2.67 1.30 0.28 0.00 4.01 -0.86 -4.96 117.16 114.27 3m1a n TYR 49 Ca -0.11 -3.81 0.18 0.00 -0.16 0.00 0.00 57.90 54.00 3m1a n TYR 49 Cb 0.79 -0.43 0.92 0.00 -0.31 0.00 0.00 39.34 40.30 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 3.84 0.00 0.00 -0.72 0.11 -1.58 -1.70 132.00 131.94 3m1a h PRO 50 Ca 0.12 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 66.12 3m1a h PRO 50 Cb 0.79 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.88 3m1a h PRO 50 CO 0.61 0.00 -1.95 -0.25 -0.21 0.00 0.00 178.00 176.20 3m1a n ASP 51 N -2.78 0.17 0.00 -2.05 10.43 -1.26 -4.59 116.55 116.47 3m1a n ASP 51 Ca -0.02 0.07 0.00 0.00 2.57 0.00 0.00 54.79 57.41 3m1a n ASP 51 Cb 0.10 1.42 0.00 0.00 1.84 0.00 0.00 41.12 44.48 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 -2.48 0.15 -4.67 -1.24 1.74 -0.95 -5.02 116.66 104.18 3m1a n ARG 52 Ca -0.11 -0.54 -0.23 0.00 -0.77 0.00 0.00 57.85 56.19 3m1a n ARG 52 Cb 0.74 -0.79 -0.15 0.00 -1.02 0.00 0.00 32.46 31.24 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 -0.18 1.39 0.00 7.54 0.00 -0.68 -0.34 121.76 129.48 3m1a s ALA 53 Ca 0.00 -0.79 0.01 0.00 0.00 0.00 0.00 51.96 51.18 3m1a s ALA 53 Cb 0.00 -0.31 -0.00 0.00 0.00 0.00 0.00 23.12 22.80 3m1a s ALA 53 CO 0.00 0.32 -0.03 -2.00 0.00 0.00 0.00 175.76 174.05 3m1a s GLU 54 N -0.66 0.25 -0.12 0.00 2.12 -0.26 -4.78 118.70 115.25 3m1a s GLU 54 Ca 0.06 -0.18 -0.03 0.00 0.36 0.00 0.00 54.97 55.18 3m1a s GLU 54 Cb -0.07 -0.20 -0.03 0.00 0.26 0.00 0.00 34.13 34.09 3m1a s GLU 54 CO 0.00 0.05 0.01 0.00 -0.54 0.00 0.00 175.26 174.78 3m1a s ALA 55 N -0.25 3.26 -0.00 6.30 0.00 -1.26 -0.33 121.76 129.48 3m1a s ALA 55 Ca -0.01 -0.79 0.03 0.00 0.00 0.00 0.00 51.96 51.19 3m1a s ALA 55 Cb -0.02 -1.58 -0.01 0.00 0.00 0.00 0.00 23.12 21.51 3m1a s ALA 55 CO -0.00 0.45 -0.11 0.42 0.00 0.00 0.00 175.76 176.52 3m1a s ILE 56 N -0.42 0.84 -0.18 0.00 1.01 -0.24 -4.96 121.20 117.25 3m1a s ILE 56 Ca 0.08 -0.50 -0.29 0.00 0.00 0.00 0.00 60.65 59.94 3m1a s ILE 56 Cb -0.12 -0.71 -0.03 0.00 0.01 0.00 0.00 42.46 41.61 3m1a s ILE 56 CO 0.02 0.20 1.50 -0.55 0.00 0.00 0.00 174.94 176.12 3m1a s SER 57 N -0.34 6.61 -0.14 3.58 0.15 -1.26 -2.31 113.70 120.00 3m1a s SER 57 Ca 0.04 1.73 -0.05 0.00 0.70 0.00 0.00 55.95 58.36 3m1a s SER 57 Cb -0.04 -2.53 0.06 0.00 -1.71 0.00 0.00 66.02 61.79 3m1a s SER 57 CO -0.00 -1.04 0.29 -0.22 1.20 0.00 0.00 173.24 173.46 3m1a s LEU 58 N 4.44 -0.18 -0.44 3.45 2.96 0.45 -4.92 118.68 124.44 3m1a s LEU 58 Ca 0.66 0.65 -0.16 0.00 -0.22 0.00 0.00 54.13 55.06 3m1a s LEU 58 Cb -0.25 0.83 0.04 0.00 0.50 0.00 0.00 46.19 47.31 3m1a s LEU 58 CO 0.25 -0.22 0.36 -0.62 -1.32 0.00 0.00 176.35 174.80 3m1a s ASP 59 N 2.14 6.14 0.20 3.68 -1.08 -1.26 -3.82 116.67 122.66 3m1a s ASP 59 Ca -0.02 -1.02 0.17 0.00 -0.52 0.00 0.00 52.55 51.16 3m1a s ASP 59 Cb -0.11 -2.18 0.81 0.00 -1.46 0.00 0.00 42.92 39.98 3m1a s ASP 59 CO -0.09 -0.55 1.51 0.52 0.52 0.00 0.00 175.17 177.08 3m1a n VAL 60 N 5.22 1.18 0.48 1.11 0.31 -1.26 -0.73 118.33 124.65 3m1a n VAL 60 Ca -0.11 0.50 0.13 0.00 -0.01 0.00 0.00 64.34 64.85 3m1a n VAL 60 Cb 0.46 -1.46 0.40 0.00 -0.91 0.00 0.00 33.84 32.34 3m1a n VAL 60 CO 0.00 0.00 0.00 0.74 -1.32 0.00 0.00 176.83 176.25 3m1a h THR 61 N 0.00 0.00 -3.28 2.52 2.02 -1.92 -3.37 112.91 108.87 3m1a h THR 61 Ca 0.00 -0.52 -0.73 0.00 0.77 0.00 0.00 66.41 65.93 3m1a h THR 61 Cb 0.12 1.47 -0.29 0.00 -1.74 0.00 0.00 68.15 67.71 3m1a h THR 61 CO 0.00 0.00 -0.38 -0.62 0.37 0.00 0.00 175.52 174.89 3m1a s ASP 62 N -4.86 5.73 0.28 4.18 -1.08 0.09 -4.94 116.67 116.08 3m1a s ASP 62 Ca 0.08 -1.90 -0.01 0.00 -0.52 0.00 0.00 52.55 50.19 3m1a s ASP 62 Cb 0.10 -2.02 0.45 0.00 -1.46 0.00 0.00 42.92 39.99 3m1a s ASP 62 CO 0.56 -0.70 1.91 1.23 0.52 0.00 0.00 175.17 178.69 3m1a h GLY 63 N 8.48 1.40 0.91 2.66 0.00 -1.83 -1.51 103.07 113.18 3m1a h GLY 63 Ca -0.22 -0.45 -0.01 0.00 0.00 0.00 0.00 47.33 46.65 3m1a h GLY 63 CO 0.87 0.34 0.10 0.83 0.00 0.00 0.00 176.54 178.68 3m1a h GLU 64 N 1.12 0.30 -0.46 4.80 3.07 -1.95 -2.45 114.58 119.02 3m1a h GLU 64 Ca 0.40 -0.05 -0.02 0.00 -0.50 0.00 0.00 59.36 59.19 3m1a h GLU 64 Cb 0.13 -0.05 -0.02 0.00 -0.84 0.00 0.00 28.75 27.97 3m1a h GLU 64 CO -0.14 0.33 0.20 -0.09 -1.40 0.00 0.00 179.01 177.91 3m1a h ARG 65 N 0.20 0.66 -0.24 2.33 9.65 -1.83 -2.61 114.38 122.54 3m1a h ARG 65 Ca 0.07 -0.08 0.01 0.00 -1.10 0.00 0.00 59.98 58.88 3m1a h ARG 65 Cb 0.13 -0.12 -0.02 0.00 -1.39 0.00 0.00 29.97 28.57 3m1a h ARG 65 CO -0.01 0.53 0.12 0.82 2.80 0.00 0.00 179.97 184.23 3m1a h ILE 66 N 0.65 1.00 -0.79 1.20 2.04 -0.82 -0.57 117.51 120.23 3m1a h ILE 66 Ca 0.16 -0.09 -0.04 0.00 1.00 0.00 0.00 64.86 65.89 3m1a h ILE 66 Cb 0.11 0.72 -0.03 0.00 -0.74 0.00 0.00 36.82 36.88 3m1a h ILE 66 CO -0.02 0.05 0.33 0.44 0.00 0.00 0.00 178.15 178.94 3m1a h ASP 67 N 0.25 1.08 -0.16 1.72 3.32 -1.29 0.05 116.42 121.39 3m1a h ASP 67 Ca 0.10 -0.17 -0.01 0.00 0.02 0.00 0.00 57.03 56.97 3m1a h ASP 67 Cb 0.02 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.28 3m1a h ASP 67 CO -0.06 0.95 0.08 0.58 -1.72 0.00 0.00 179.24 179.06 3m1a h VAL 68 N 1.14 1.13 -0.19 -1.35 2.07 -1.17 -2.15 116.25 115.72 3m1a h VAL 68 Ca 0.26 -0.37 -0.05 0.00 0.82 0.00 0.00 66.70 67.37 3m1a h VAL 68 Cb 0.20 1.08 -0.01 0.00 -1.52 0.00 0.00 31.29 31.04 3m1a h VAL 68 CO -0.02 0.12 -0.08 0.58 0.02 0.00 0.00 177.57 178.19 3m1a h VAL 69 N 0.13 1.30 -0.70 2.57 2.07 -0.80 -1.04 116.25 119.79 3m1a h VAL 69 Ca 0.06 -1.11 0.08 0.00 0.82 0.00 0.00 66.70 66.55 3m1a h VAL 69 Cb 0.12 1.63 -0.07 0.00 -1.52 0.00 0.00 31.29 31.45 3m1a h VAL 69 CO -0.01 0.33 0.36 0.00 0.02 0.00 0.00 177.57 178.28 3m1a h ALA 70 N 0.71 0.96 -0.24 1.67 0.00 -1.03 -0.67 119.26 120.65 3m1a h ALA 70 Ca 0.04 0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.85 3m1a h ALA 70 Cb 0.55 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 3m1a h ALA 70 CO 0.02 -0.02 -0.45 0.00 0.00 0.00 0.00 179.25 178.81 3m1a h ALA 71 N 1.41 0.78 -0.26 0.00 0.00 -1.13 -1.62 119.26 118.44 3m1a h ALA 71 Ca 0.34 -0.46 -0.19 0.00 0.00 0.00 0.00 54.91 54.60 3m1a h ALA 71 Cb 0.31 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.00 3m1a h ALA 71 CO -0.24 0.66 -0.57 0.22 0.00 0.00 0.00 179.25 179.31 3m1a h ASP 72 N 0.48 0.91 -0.31 0.00 3.58 -0.52 0.10 116.42 120.65 3m1a h ASP 72 Ca 0.03 -0.50 -0.08 0.00 0.42 0.00 0.00 57.03 56.91 3m1a h ASP 72 Cb 0.97 -0.26 -0.01 0.00 1.72 0.00 0.00 39.33 41.75 3m1a h ASP 72 CO 0.09 1.28 -0.12 0.58 -2.88 0.00 0.00 179.24 178.20 3m1a h VAL 73 N 0.61 1.29 -0.93 2.25 2.07 -1.08 -0.77 116.25 119.70 3m1a h VAL 73 Ca 0.01 -1.19 -0.01 0.00 0.82 0.00 0.00 66.70 66.32 3m1a h VAL 73 Cb 1.17 1.42 -0.04 0.00 -1.52 0.00 0.00 31.29 32.32 3m1a h VAL 73 CO 0.12 0.38 0.54 -0.07 0.02 0.00 0.00 177.57 178.56 3m1a h LEU 74 N 0.38 1.13 -0.20 2.57 3.38 -1.25 -0.26 115.31 121.05 3m1a h LEU 74 Ca 0.07 -0.08 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 3m1a h LEU 74 Cb 0.63 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 3m1a h LEU 74 CO 0.04 0.88 -0.02 0.00 0.09 0.00 0.00 178.44 179.43 3m1a h ALA 75 N 1.30 0.27 0.00 1.53 0.00 -0.75 0.18 119.26 121.79 3m1a h ALA 75 Ca 0.33 -0.23 -0.21 0.00 0.00 0.00 0.00 54.91 54.80 3m1a h ALA 75 Cb -0.02 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 3m1a h ALA 75 CO -0.06 0.02 -1.20 0.00 0.00 0.00 0.00 179.25 178.01 3m1a h ARG 76 N 0.11 0.00 0.00 0.00 3.08 -1.11 -3.35 114.38 113.11 3m1a h ARG 76 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.10 3m1a h ARG 76 Cb 0.44 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.49 3m1a h ARG 76 CO 0.01 0.67 -1.66 0.66 -1.07 0.00 0.00 179.97 178.58 3m1a n TYR 77 N -3.17 0.00 0.00 3.04 4.01 -0.12 -5.00 117.16 115.93 3m1a n TYR 77 Ca -0.06 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.68 3m1a n TYR 77 Cb 0.93 -0.34 0.00 0.00 -0.31 0.00 0.00 39.34 39.62 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 1.38 2.88 3.58 2.72 0.00 0.63 -4.93 105.19 111.46 3m1a n GLY 78 Ca -0.02 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.95 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 0.00 0.38 -0.13 1.61 1.70 -1.25 -4.97 118.95 116.29 3m1a s ARG 79 Ca 0.00 -0.11 0.01 0.00 -0.47 0.00 0.00 55.73 55.16 3m1a s ARG 79 Cb 0.00 0.18 0.02 0.00 -0.57 0.00 0.00 34.95 34.57 3m1a s ARG 79 CO 0.00 -0.16 -0.16 0.08 -1.08 0.00 0.00 175.30 173.98 3m1a s VAL 80 N -2.32 1.61 -0.13 4.99 1.01 -1.26 -4.81 120.40 119.49 3m1a s VAL 80 Ca 0.08 -0.69 -0.16 0.00 0.00 0.00 0.00 61.98 61.22 3m1a s VAL 80 Cb -0.01 -1.48 -0.25 0.00 0.00 0.00 0.00 36.38 34.63 3m1a s VAL 80 CO -0.05 0.46 0.45 0.44 0.00 0.00 0.00 175.10 176.41 3m1a h ASP 81 N 7.70 0.30 -3.21 3.32 3.32 -1.36 -3.47 116.42 123.02 3m1a h ASP 81 Ca -0.35 -0.81 -0.58 0.00 0.02 0.00 0.00 57.03 55.32 3m1a h ASP 81 Cb 1.16 -0.10 -0.35 0.00 0.22 0.00 0.00 39.33 40.26 3m1a h ASP 81 CO 0.52 1.62 -0.83 -0.69 -1.72 0.00 0.00 179.24 178.15 3m1a s VAL 82 N -2.46 1.43 -0.21 -1.35 1.01 -0.54 -0.80 120.40 117.47 3m1a s VAL 82 Ca -0.22 -0.57 -0.08 0.00 0.00 0.00 0.00 61.98 61.10 3m1a s VAL 82 Cb 0.05 -1.34 -0.04 0.00 0.00 0.00 0.00 36.38 35.05 3m1a s VAL 82 CO 0.73 0.43 0.10 -0.22 0.00 0.00 0.00 175.10 176.14 3m1a s LEU 83 N 1.26 3.85 -0.22 3.92 2.96 -0.29 -0.71 118.68 129.46 3m1a s LEU 83 Ca -0.01 0.04 0.01 0.00 -0.22 0.00 0.00 54.13 53.95 3m1a s LEU 83 Cb -0.14 -2.00 0.03 0.00 0.50 0.00 0.00 46.19 44.58 3m1a s LEU 83 CO -0.06 0.10 -0.14 -0.69 -1.32 0.00 0.00 176.35 174.24 3m1a s VAL 84 N 0.82 2.28 -0.72 1.68 1.01 0.31 -0.56 120.40 125.22 3m1a s VAL 84 Ca 0.05 -1.15 -0.19 0.00 0.00 0.00 0.00 61.98 60.69 3m1a s VAL 84 Cb -0.13 -2.11 0.11 0.00 0.00 0.00 0.00 36.38 34.25 3m1a s VAL 84 CO 0.02 0.31 0.89 0.20 0.00 0.00 0.00 175.10 176.52 3m1a s ASN 85 N 1.25 6.34 -0.00 3.32 0.02 -0.25 -1.14 114.94 124.47 3m1a s ASN 85 Ca 0.00 -1.57 0.03 0.00 -1.02 0.00 0.00 52.86 50.30 3m1a s ASN 85 Cb -0.16 -2.35 -0.04 0.00 0.02 0.00 0.00 41.25 38.73 3m1a s ASN 85 CO -0.09 -1.15 0.09 -3.20 0.02 0.00 0.00 177.10 172.77 3m1a n ASN 86 N 6.58 2.13 -4.59 -1.22 5.15 -1.15 -2.06 115.26 120.09 3m1a n ASN 86 Ca 0.02 -0.30 -0.45 0.00 -0.60 0.00 0.00 54.58 53.26 3m1a n ASN 86 Cb 0.45 1.06 -0.02 0.00 -0.53 0.00 0.00 39.78 40.74 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 -1.31 -0.24 0.00 5.20 0.00 -1.10 -4.69 120.51 118.36 3m1a n ALA 87 Ca 0.00 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.84 3m1a n ALA 87 Cb 0.06 -2.03 0.00 0.00 0.00 0.00 0.00 19.45 17.48 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 1.36 -2.20 3.44 0.00 0.00 -1.26 -4.74 105.19 101.79 3m1a n GLY 88 Ca 0.10 -1.23 -0.10 0.00 0.00 0.00 0.00 46.02 44.80 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 -1.87 1.27 0.01 1.61 1.70 -1.26 -4.42 118.95 115.99 3m1a s ARG 89 Ca 0.00 -0.90 -0.15 0.00 -0.47 0.00 0.00 55.73 54.21 3m1a s ARG 89 Cb 0.00 0.48 -0.06 0.00 -0.57 0.00 0.00 34.95 34.80 3m1a s ARG 89 CO 0.00 -0.52 0.42 0.99 -1.08 0.00 0.00 175.30 175.11 3m1a s THR 90 N -3.88 5.00 -0.11 4.99 2.01 -0.49 -5.01 115.64 118.16 3m1a s THR 90 Ca 0.09 0.86 -0.05 0.00 0.31 0.00 0.00 61.69 62.91 3m1a s THR 90 Cb 0.00 -3.73 0.05 0.00 0.01 0.00 0.00 72.50 68.84 3m1a s THR 90 CO -0.04 0.57 0.23 -1.58 -0.69 0.00 0.00 174.62 173.11 3m1a s GLN 91 N -1.10 0.15 -0.07 4.92 0.74 -1.26 -1.17 119.66 121.87 3m1a s GLN 91 Ca 0.24 0.60 0.01 0.00 0.05 0.00 0.00 55.36 56.26 3m1a s GLN 91 Cb -0.17 -0.12 0.02 0.00 1.10 0.00 0.00 33.01 33.85 3m1a s GLN 91 CO 0.14 -0.22 -0.08 0.08 -0.55 0.00 0.00 175.29 174.66 3m1a s VAL 92 N 1.79 0.88 -0.28 1.34 1.01 -0.78 -4.50 120.40 119.85 3m1a s VAL 92 Ca -0.04 -0.27 -0.32 0.00 0.00 0.00 0.00 61.98 61.35 3m1a s VAL 92 Cb -0.11 -0.87 0.18 0.00 0.00 0.00 0.00 36.38 35.58 3m1a s VAL 92 CO -0.08 0.32 1.36 -0.83 0.00 0.00 0.00 175.10 175.87 3m1a s GLY 93 N 1.16 0.01 0.44 4.51 0.00 -0.32 -0.83 107.32 112.29 3m1a s GLY 93 Ca -0.06 2.58 -0.25 0.00 0.00 0.00 0.00 44.72 46.99 3m1a s GLY 93 CO -0.02 0.98 1.32 0.00 0.00 0.00 0.00 173.10 175.38 3m1a n ALA 94 N 0.37 1.50 -0.23 3.20 0.00 -1.26 -4.17 120.51 119.93 3m1a n ALA 94 Ca 0.01 0.25 -0.03 0.00 0.00 0.00 0.00 53.44 53.67 3m1a n ALA 94 Cb 0.58 -2.30 0.03 0.00 0.00 0.00 0.00 19.45 17.76 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 2.10 -0.80 0.00 0.00 3.04 -1.95 0.95 116.94 120.29 3m1a h PHE 95 Ca -0.49 0.07 -0.02 0.00 3.98 0.00 0.00 57.97 61.51 3m1a h PHE 95 Cb 1.29 0.45 -0.00 0.00 2.56 0.00 0.00 35.95 40.24 3m1a h PHE 95 CO 0.48 -0.37 -0.11 1.49 -2.02 0.00 0.00 178.31 177.79 3m1a h GLU 96 N -0.11 0.00 0.00 1.11 4.81 -2.04 -2.63 114.58 115.72 3m1a h GLU 96 Ca 0.27 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.50 3m1a h GLU 96 Cb 0.55 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.93 3m1a h GLU 96 CO -0.72 0.11 -0.37 1.49 -0.73 0.00 0.00 179.01 178.78 3m1a h GLU 97 N 0.00 0.00 -6.19 1.92 4.57 -1.18 -3.45 114.58 110.24 3m1a h GLU 97 Ca -0.00 0.00 -0.57 0.00 -1.18 0.00 0.00 59.36 57.61 3m1a h GLU 97 Cb 0.25 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 28.80 3m1a h GLU 97 CO 0.01 0.00 0.69 0.99 -1.18 0.00 0.00 179.01 179.53 3m1a s THR 98 N -3.15 4.64 0.58 0.32 2.01 -0.79 -4.93 115.64 114.31 3m1a s THR 98 Ca 0.08 1.94 -0.09 0.00 0.31 0.00 0.00 61.69 63.92 3m1a s THR 98 Cb 0.13 -4.25 -0.04 0.00 0.01 0.00 0.00 72.50 68.35 3m1a s THR 98 CO 0.67 -0.07 0.96 0.42 -0.69 0.00 0.00 174.62 175.91 3m1a s THR 99 N 2.58 4.77 0.26 -0.82 -4.23 -1.26 -4.90 115.64 112.04 3m1a s THR 99 Ca 0.48 0.68 -0.05 0.00 -1.18 0.00 0.00 61.69 61.63 3m1a s THR 99 Cb -0.18 -3.87 0.24 0.00 1.34 0.00 0.00 72.50 70.04 3m1a s THR 99 CO 0.14 -1.05 1.92 -0.08 -0.54 0.00 0.00 174.62 175.01 3m1a h GLU 100 N -0.13 1.23 -0.78 3.99 4.81 -1.99 -0.94 114.58 120.78 3m1a h GLU 100 Ca -0.45 -0.10 0.00 0.00 -0.13 0.00 0.00 59.36 58.69 3m1a h GLU 100 Cb 1.19 -0.27 -0.04 0.00 0.63 0.00 0.00 28.75 30.27 3m1a h GLU 100 CO 0.62 0.84 0.50 -0.09 -0.73 0.00 0.00 179.01 180.15 3m1a h ARG 101 N 1.26 1.04 -0.52 1.92 2.43 -1.99 0.12 114.38 118.64 3m1a h ARG 101 Ca 0.33 -0.07 -0.12 0.00 -0.81 0.00 0.00 59.98 59.31 3m1a h ARG 101 Cb -0.09 -0.23 -0.02 0.00 -0.42 0.00 0.00 29.97 29.21 3m1a h ARG 101 CO -0.07 0.71 -0.14 0.93 -1.51 0.00 0.00 179.97 179.89 3m1a h GLU 102 N 1.06 1.00 0.13 0.20 5.08 -1.80 -0.83 114.58 119.41 3m1a h GLU 102 Ca 0.28 -0.38 -0.01 0.00 -1.00 0.00 0.00 59.36 58.25 3m1a h GLU 102 Cb -0.09 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.10 3m1a h GLU 102 CO -0.06 1.06 -0.06 1.25 -1.00 0.00 0.00 179.01 180.20 3m1a h LEU 103 N 0.88 -0.14 -0.89 1.33 5.85 -0.90 -2.23 115.31 119.21 3m1a h LEU 103 Ca 0.13 -0.12 -0.02 0.00 0.84 0.00 0.00 57.88 58.71 3m1a h LEU 103 Cb 0.70 0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.73 3m1a h LEU 103 CO 0.05 0.03 0.49 0.03 -0.34 0.00 0.00 178.44 178.71 3m1a h ARG 104 N -0.31 1.24 -0.36 1.25 3.08 -0.64 -2.27 114.38 116.37 3m1a h ARG 104 Ca -0.02 -0.14 0.04 0.00 0.07 0.00 0.00 59.98 59.93 3m1a h ARG 104 Cb 0.25 -0.24 -0.04 0.00 0.08 0.00 0.00 29.97 30.02 3m1a h ARG 104 CO 0.03 0.90 0.12 -0.44 -1.07 0.00 0.00 179.97 179.51 3m1a h ASP 105 N 1.24 0.12 -0.50 7.04 3.32 -1.09 -0.65 116.42 125.90 3m1a h ASP 105 Ca 0.31 0.04 -0.05 0.00 0.02 0.00 0.00 57.03 57.36 3m1a h ASP 105 Cb 0.02 0.03 -0.03 0.00 0.22 0.00 0.00 39.33 39.58 3m1a h ASP 105 CO -0.05 0.10 0.16 0.25 -1.72 0.00 0.00 179.24 177.98 3m1a h LEU 106 N 0.26 0.77 -0.68 1.55 5.85 -1.12 -2.08 115.31 119.87 3m1a h LEU 106 Ca 0.16 -0.13 -0.11 0.00 0.84 0.00 0.00 57.88 58.64 3m1a h LEU 106 Cb 0.14 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 40.96 3m1a h LEU 106 CO -0.17 0.75 -0.17 -0.26 -0.34 0.00 0.00 178.44 178.24 3m1a h PHE 107 N 0.81 0.95 -0.17 1.25 0.04 -1.07 -1.06 116.94 117.69 3m1a h PHE 107 Ca 0.18 -0.20 0.04 0.00 2.80 0.00 0.00 57.97 60.79 3m1a h PHE 107 Cb 0.26 -0.23 -0.04 0.00 2.20 0.00 0.00 35.95 38.14 3m1a h PHE 107 CO 0.02 0.95 -0.10 0.93 -0.60 0.00 0.00 178.31 179.50 3m1a h GLU 108 N 0.75 -0.09 -0.39 1.51 4.39 -0.48 -0.73 114.58 119.55 3m1a h GLU 108 Ca 0.11 0.01 -0.09 0.00 0.34 0.00 0.00 59.36 59.73 3m1a h GLU 108 Cb 0.69 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.35 3m1a h GLU 108 CO 0.05 -0.06 -0.10 -0.07 -1.16 0.00 0.00 179.01 177.67 3m1a h LEU 109 N -0.09 0.76 0.00 1.33 3.38 -1.29 -1.36 115.31 118.04 3m1a h LEU 109 Ca 0.10 -0.37 0.00 0.00 0.09 0.00 0.00 57.88 57.70 3m1a h LEU 109 Cb 0.24 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.78 3m1a h LEU 109 CO -0.23 0.95 -1.25 1.41 0.09 0.00 0.00 178.44 179.41 3m1a n HIS 110 N -4.34 0.09 0.01 1.13 8.25 -0.41 -4.44 115.22 115.50 3m1a n HIS 110 Ca -0.01 0.03 0.00 0.00 -0.26 0.00 0.00 57.72 57.47 3m1a n HIS 110 Cb 0.36 -0.29 0.00 0.00 1.12 0.00 0.00 29.99 31.19 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 -1.86 0.04 -0.12 1.59 0.31 -0.37 -4.66 118.33 113.27 3m1a n VAL 111 Ca 0.01 0.01 -0.09 0.00 -0.01 0.00 0.00 64.34 64.26 3m1a n VAL 111 Cb 0.43 -0.54 -0.01 0.00 -0.91 0.00 0.00 33.84 32.81 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 0.56 0.78 3.52 0.04 -1.36 -0.68 116.94 119.80 3m1a h PHE 112 Ca 0.00 -0.04 -0.03 0.00 2.80 0.00 0.00 57.97 60.69 3m1a h PHE 112 Cb 0.00 -0.17 -0.00 0.00 2.20 0.00 0.00 35.95 37.98 3m1a h PHE 112 CO 0.00 0.51 -0.50 0.78 -0.60 0.00 0.00 178.31 178.50 3m1a h GLY 113 N 0.45 -1.35 0.36 -1.45 0.00 -1.41 -0.61 103.07 99.07 3m1a h GLY 113 Ca 0.12 0.56 0.14 0.00 0.00 0.00 0.00 47.33 48.14 3m1a h GLY 113 CO -0.01 -0.45 0.56 -2.55 0.00 0.00 0.00 176.54 174.09 3m1a h PRO 114 N -1.20 0.82 -0.47 4.80 0.11 -1.76 -0.89 132.00 133.41 3m1a h PRO 114 Ca -0.10 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 65.93 3m1a h PRO 114 Cb 0.97 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 31.87 3m1a h PRO 114 CO 0.10 0.54 0.19 0.00 -0.21 0.00 0.00 178.00 178.61 3m1a h ALA 115 N 1.55 0.61 -0.52 -0.75 0.00 -0.99 -0.23 119.26 118.93 3m1a h ALA 115 Ca 0.49 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 55.21 3m1a h ALA 115 Cb 0.58 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 3m1a h ALA 115 CO -0.31 0.22 0.16 -0.09 0.00 0.00 0.00 179.25 179.23 3m1a h ARG 116 N 0.61 0.80 -0.44 0.00 2.43 -0.41 -0.17 114.38 117.21 3m1a h ARG 116 Ca 0.16 -0.17 -0.09 0.00 -0.81 0.00 0.00 59.98 59.06 3m1a h ARG 116 Cb 0.20 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.61 3m1a h ARG 116 CO -0.01 0.74 -0.09 1.25 -1.51 0.00 0.00 179.97 180.35 3m1a h LEU 117 N 0.71 0.85 -0.67 3.80 5.85 -1.13 -1.63 115.31 123.09 3m1a h LEU 117 Ca 0.17 -0.36 0.00 0.00 0.84 0.00 0.00 57.88 58.53 3m1a h LEU 117 Cb 0.27 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.04 3m1a h LEU 117 CO -0.01 1.01 0.43 0.74 -0.34 0.00 0.00 178.44 180.27 3m1a h THR 118 N 0.68 1.18 -0.55 1.05 2.02 -0.88 -2.68 112.91 113.73 3m1a h THR 118 Ca 0.11 -0.35 -0.07 0.00 0.77 0.00 0.00 66.41 66.87 3m1a h THR 118 Cb 0.63 0.22 -0.02 0.00 -1.74 0.00 0.00 68.15 67.23 3m1a h THR 118 CO 0.04 0.18 0.07 0.03 0.37 0.00 0.00 175.52 176.21 3m1a h ARG 119 N 0.90 0.89 -0.21 6.66 3.08 -0.77 -0.64 114.38 124.29 3m1a h ARG 119 Ca 0.24 -0.22 -0.03 0.00 0.07 0.00 0.00 59.98 60.04 3m1a h ARG 119 Cb -0.08 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 29.85 3m1a h ARG 119 CO -0.05 0.84 -0.02 0.00 -1.07 0.00 0.00 179.97 179.67 3m1a h ALA 120 N 1.23 1.59 0.00 0.04 0.00 -1.04 -3.25 119.26 117.83 3m1a h ALA 120 Ca 0.17 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3m1a h ALA 120 Cb 0.40 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.09 3m1a h ALA 120 CO 0.01 0.31 -1.31 1.28 0.00 0.00 0.00 179.25 179.54 3m1a n LEU 121 N -4.35 0.56 -0.06 0.00 4.77 -1.01 -4.51 117.00 112.40 3m1a n LEU 121 Ca 0.00 -0.30 -0.10 0.00 -0.03 0.00 0.00 56.01 55.58 3m1a n LEU 121 Cb 0.20 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.27 3m1a n LEU 121 CO 0.37 0.14 0.96 0.25 -1.33 0.00 0.00 177.39 177.78 3m1a h LEU 122 N 0.00 0.29 -0.32 2.23 5.85 -1.16 -3.26 115.31 118.94 3m1a h LEU 122 Ca 0.00 -0.03 0.05 0.00 0.84 0.00 0.00 57.88 58.74 3m1a h LEU 122 Cb 0.64 -0.07 -0.05 0.00 0.37 0.00 0.00 40.66 41.55 3m1a h LEU 122 CO 0.00 0.23 0.03 -0.65 -0.34 0.00 0.00 178.44 177.71 3m1a h PRO 123 N 0.32 0.12 -1.96 5.25 0.11 -1.79 0.41 132.00 134.46 3m1a h PRO 123 Ca 0.09 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.19 3m1a h PRO 123 Cb -0.01 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.07 3m1a h PRO 123 CO -0.02 0.08 0.00 0.00 -0.21 0.00 0.00 178.00 177.85 3m1a n GLN 124 N -5.14 0.05 0.00 1.05 -0.00 -1.23 -0.35 117.38 111.76 3m1a n GLN 124 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 57.01 3m1a n GLN 124 Cb 0.16 -1.48 0.00 0.00 -0.00 0.00 0.00 30.24 28.92 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 1.12 0.00 -0.00 2.61 0.63 0.13 -1.98 116.66 119.17 3m1a n ARG 126 Ca 0.00 0.00 -0.04 0.00 -0.92 0.00 0.00 57.85 56.89 3m1a n ARG 126 Cb 0.02 0.00 0.17 0.00 0.45 0.00 0.00 32.46 33.11 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 0.53 -0.03 -0.14 5.08 -0.94 -2.78 114.58 116.29 3m1a h GLU 127 Ca 0.00 -0.21 -0.18 0.00 -1.00 0.00 0.00 59.36 57.97 3m1a h GLU 127 Cb 0.00 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 3m1a h GLU 127 CO 0.00 0.75 -0.77 -0.09 -1.00 0.00 0.00 179.01 177.90 3m1a h ARG 128 N 0.46 0.26 0.00 2.33 2.43 -1.63 -3.47 114.38 114.75 3m1a h ARG 128 Ca 0.06 -0.24 0.00 0.00 -0.81 0.00 0.00 59.98 59.00 3m1a h ARG 128 Cb 0.71 0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.32 3m1a h ARG 128 CO 0.05 0.91 0.00 0.41 -1.51 0.00 0.00 179.97 179.83 3m1a n GLY 129 N 0.63 0.47 3.41 2.80 0.00 -1.05 -5.07 105.19 106.38 3m1a n GLY 129 Ca -0.04 -0.91 -0.14 0.00 0.00 0.00 0.00 46.02 44.94 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 -2.83 -0.47 0.00 1.61 1.04 -1.25 -4.47 113.70 107.34 3m1a s SER 130 Ca 0.00 0.19 0.00 0.00 0.48 0.00 0.00 55.95 56.62 3m1a s SER 130 Cb 0.00 0.51 0.00 0.00 0.10 0.00 0.00 66.02 66.63 3m1a s SER 130 CO 0.00 -0.75 0.00 0.61 0.98 0.00 0.00 173.24 174.08 3m1a n GLY 131 N 0.33 3.53 3.01 7.32 0.00 -1.26 -4.70 105.19 113.42 3m1a n GLY 131 Ca -0.18 -1.17 -0.20 0.00 0.00 0.00 0.00 46.02 44.47 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 1.22 -0.20 1.61 0.01 0.02 -0.37 113.70 115.99 3m1a s SER 132 Ca 0.00 -0.19 -0.01 0.00 1.31 0.00 0.00 55.95 57.06 3m1a s SER 132 Cb 0.00 -0.31 0.00 0.00 0.21 0.00 0.00 66.02 65.92 3m1a s SER 132 CO 0.00 0.07 -0.12 -0.69 0.41 0.00 0.00 173.24 172.91 3m1a s VAL 133 N 0.16 2.79 -0.25 3.43 1.01 0.57 -1.13 120.40 126.98 3m1a s VAL 133 Ca -0.03 -0.70 0.01 0.00 0.00 0.00 0.00 61.98 61.27 3m1a s VAL 133 Cb -0.08 -2.23 0.04 0.00 0.00 0.00 0.00 36.38 34.11 3m1a s VAL 133 CO 0.00 0.48 -0.10 -0.69 0.00 0.00 0.00 175.10 174.80 3m1a s VAL 134 N 1.31 2.46 -0.26 2.92 1.01 0.27 -0.61 120.40 127.50 3m1a s VAL 134 Ca 0.04 -1.32 -0.07 0.00 0.00 0.00 0.00 61.98 60.63 3m1a s VAL 134 Cb -0.14 -2.32 -0.02 0.00 0.00 0.00 0.00 36.38 33.90 3m1a s VAL 134 CO -0.06 0.12 0.07 0.20 0.00 0.00 0.00 175.10 175.42 3m1a s ASN 135 N 1.22 5.07 -0.68 3.32 0.02 0.12 -1.09 114.94 122.91 3m1a s ASN 135 Ca -0.04 -0.33 -0.26 0.00 -1.02 0.00 0.00 52.86 51.21 3m1a s ASN 135 Cb -0.18 -1.90 0.04 0.00 0.02 0.00 0.00 41.25 39.23 3m1a s ASN 135 CO -0.06 -0.07 1.20 -0.63 0.02 0.00 0.00 177.10 177.56 3m1a s ILE 136 N 1.58 3.91 0.00 0.60 -1.09 -0.87 -1.35 121.20 123.98 3m1a s ILE 136 Ca 0.06 0.39 0.00 0.00 -2.23 0.00 0.00 60.65 58.87 3m1a s ILE 136 Cb -0.15 -4.82 0.00 0.00 -1.58 0.00 0.00 42.46 35.90 3m1a s ILE 136 CO 0.03 -1.65 0.00 -0.24 -1.23 0.00 0.00 174.94 171.85 3m1a n SER 137 N 8.83 0.00 -3.71 3.58 2.88 0.11 -4.91 113.62 120.41 3m1a n SER 137 Ca 0.03 0.00 -0.03 0.00 -1.33 0.00 0.00 58.87 57.54 3m1a n SER 137 Cb 0.48 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 -0.18 0.55 -3.46 0.15 -1.23 -4.35 113.70 104.18 3m1a s SER 138 Ca 0.00 -0.31 0.22 0.00 0.70 0.00 0.00 55.95 56.56 3m1a s SER 138 Cb 0.00 0.42 1.51 0.00 -1.71 0.00 0.00 66.02 66.24 3m1a s SER 138 CO 0.00 -0.77 2.18 2.19 1.20 0.00 0.00 173.24 178.04 3m1a h PHE 139 N 2.00 0.00 0.00 3.44 -5.15 -1.71 -1.43 116.94 114.09 3m1a h PHE 139 Ca -0.25 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.52 3m1a h PHE 139 Cb 1.23 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.40 3m1a h PHE 139 CO 0.36 0.00 0.03 0.78 -2.00 0.00 0.00 178.31 177.47 3m1a h GLY 140 N 0.00 0.00 1.93 6.09 0.00 -1.88 -2.43 103.07 106.78 3m1a h GLY 140 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.35 3m1a h GLY 140 CO -0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 3m1a n GLY 141 N -1.19 -0.95 0.00 4.60 0.00 -0.54 -3.33 105.19 103.78 3m1a n GLY 141 Ca -0.02 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.95 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 -1.46 4.76 -3.44 1.61 6.02 -0.92 -3.92 117.38 120.03 3m1a n GLN 142 Ca 0.04 -0.12 -0.13 0.00 -0.01 0.00 0.00 57.00 56.78 3m1a n GLN 142 Cb 0.16 -0.60 -0.03 0.00 1.02 0.00 0.00 30.24 30.79 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 -1.43 -0.59 0.30 1.08 0.05 -1.21 -5.03 118.68 111.85 3m1a s LEU 143 Ca 0.00 0.15 0.01 0.00 0.05 0.00 0.00 54.13 54.34 3m1a s LEU 143 Cb 0.00 2.59 -0.02 0.00 -2.05 0.00 0.00 46.19 46.71 3m1a s LEU 143 CO 0.00 -0.89 0.34 -0.55 -0.55 0.00 0.00 176.35 174.69 3m1a s SER 144 N -2.42 0.98 0.20 1.48 0.15 -1.26 -4.40 113.70 108.44 3m1a s SER 144 Ca -0.02 -1.53 -0.22 0.00 0.70 0.00 0.00 55.95 54.89 3m1a s SER 144 Cb -0.01 0.56 0.07 0.00 -1.71 0.00 0.00 66.02 64.94 3m1a s SER 144 CO -0.08 -1.11 1.01 0.72 1.20 0.00 0.00 173.24 174.98 3m1a s PHE 145 N -3.48 0.07 0.08 3.44 -0.71 -1.26 -5.08 117.98 111.04 3m1a s PHE 145 Ca 0.35 -0.49 -0.36 0.00 -1.04 0.00 0.00 56.93 55.39 3m1a s PHE 145 Cb 0.02 0.71 -0.15 0.00 -1.21 0.00 0.00 43.02 42.39 3m1a s PHE 145 CO 0.21 -0.99 1.47 0.00 -1.34 0.00 0.00 175.22 174.57 3m1a n ALA 146 N -0.68 -0.06 -0.14 1.99 0.00 -1.26 -1.50 120.51 118.86 3m1a n ALA 146 Ca -0.04 0.48 0.00 0.00 0.00 0.00 0.00 53.44 53.88 3m1a n ALA 146 Cb 0.59 -2.20 0.00 0.00 0.00 0.00 0.00 19.45 17.85 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 3.01 1.63 0.43 0.00 0.00 -1.26 -4.64 105.19 104.36 3m1a n GLY 147 Ca 0.19 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.25 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 0.33 0.00 1.61 -0.00 -0.56 -1.17 117.46 115.67 3m1a n PHE 148 Ca 0.00 -0.54 -0.12 0.00 -0.00 0.00 0.00 57.45 56.80 3m1a n PHE 148 Cb 0.00 -0.06 -0.07 0.00 -0.00 0.00 0.00 39.48 39.36 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 1.31 0.08 0.02 -2.13 4.64 -1.80 0.17 113.55 115.84 3m1a h SER 149 Ca 0.00 -0.10 -0.00 0.00 -0.47 0.00 0.00 61.79 61.22 3m1a h SER 149 Cb 0.71 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.78 3m1a h SER 149 CO 0.01 0.16 -0.01 0.00 -0.87 0.00 0.00 176.83 176.12 3m1a h ALA 150 N 0.92 -0.03 0.27 5.18 0.00 -1.87 -0.90 119.26 122.83 3m1a h ALA 150 Ca 0.02 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3m1a h ALA 150 Cb 0.10 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 3m1a h ALA 150 CO -0.00 -0.47 -0.27 -0.92 0.00 0.00 0.00 179.25 177.59 3m1a h TYR 151 N -0.12 -0.72 -0.91 0.00 3.20 -1.76 -1.52 116.97 115.14 3m1a h TYR 151 Ca -0.00 0.00 0.04 0.00 3.14 0.00 0.00 58.73 61.91 3m1a h TYR 151 Cb 0.11 0.28 -0.06 0.00 1.54 0.00 0.00 36.73 38.61 3m1a h TYR 151 CO -0.05 -0.39 0.59 0.77 -1.64 0.00 0.00 178.16 177.44 3m1a h SER 152 N -0.57 0.96 -0.72 -2.11 0.02 -0.95 -1.33 113.55 108.85 3m1a h SER 152 Ca -0.01 -0.00 0.05 0.00 -0.84 0.00 0.00 61.79 60.99 3m1a h SER 152 Cb 0.53 -0.21 -0.05 0.00 0.14 0.00 0.00 62.40 62.81 3m1a h SER 152 CO -0.06 0.65 0.43 0.00 -1.14 0.00 0.00 176.83 176.71 3m1a h ALA 153 N 1.39 0.96 -0.43 3.77 0.00 -0.86 0.11 119.26 124.20 3m1a h ALA 153 Ca 0.37 -0.00 -0.15 0.00 0.00 0.00 0.00 54.91 55.13 3m1a h ALA 153 Cb 0.05 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 3m1a h ALA 153 CO -0.13 0.16 -0.31 1.79 0.00 0.00 0.00 179.25 180.76 3m1a h THR 154 N 0.81 1.27 -0.05 0.00 1.35 -0.50 -2.38 112.91 113.41 3m1a h THR 154 Ca 0.31 -1.48 -0.17 0.00 -0.55 0.00 0.00 66.41 64.52 3m1a h THR 154 Cb 0.12 1.27 -0.01 0.00 -1.73 0.00 0.00 68.15 67.80 3m1a h THR 154 CO -0.15 0.50 -0.73 0.11 -0.25 0.00 0.00 175.52 175.00 3m1a h LYS 155 N 0.80 0.27 -0.34 4.72 1.79 -0.76 -2.14 116.57 120.91 3m1a h LYS 155 Ca 0.08 -0.22 -0.14 0.00 -2.18 0.00 0.00 60.65 58.19 3m1a h LYS 155 Cb 0.89 0.05 -0.00 0.00 -1.58 0.00 0.00 32.23 31.59 3m1a h LYS 155 CO 0.08 0.88 -0.35 0.00 -1.08 0.00 0.00 179.45 178.99 3m1a h ALA 156 N 1.05 0.49 -0.49 3.86 0.00 -0.79 0.17 119.26 123.56 3m1a h ALA 156 Ca -0.03 -0.43 0.05 0.00 0.00 0.00 0.00 54.91 54.50 3m1a h ALA 156 Cb 1.29 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.93 3m1a h ALA 156 CO 0.12 0.56 0.21 0.00 0.00 0.00 0.00 179.25 180.14 3m1a h ALA 157 N 0.74 0.61 -0.50 0.00 0.00 -1.37 -0.19 119.26 118.54 3m1a h ALA 157 Ca 0.05 0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.03 3m1a h ALA 157 Cb 0.93 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.66 3m1a h ALA 157 CO 0.09 -0.16 0.29 1.25 0.00 0.00 0.00 179.25 180.72 3m1a h LEU 158 N 0.42 0.47 -0.80 0.00 6.46 -1.11 -1.67 115.31 119.08 3m1a h LEU 158 Ca 0.22 0.01 -0.00 0.00 -0.12 0.00 0.00 57.88 57.99 3m1a h LEU 158 Cb 0.18 -0.09 -0.04 0.00 -0.73 0.00 0.00 40.66 39.98 3m1a h LEU 158 CO -0.19 0.33 0.49 -0.33 -0.62 0.00 0.00 178.44 178.12 3m1a h GLU 159 N 0.58 1.08 0.01 1.25 5.08 -0.44 -1.11 114.58 121.03 3m1a h GLU 159 Ca 0.20 -0.09 -0.21 0.00 -1.00 0.00 0.00 59.36 58.26 3m1a h GLU 159 Cb 0.04 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.05 3m1a h GLU 159 CO -0.10 0.75 -0.93 1.96 -1.00 0.00 0.00 179.01 179.69 3m1a h GLN 160 N 1.09 0.24 -0.72 2.33 1.08 -0.81 0.01 115.11 118.33 3m1a h GLN 160 Ca 0.29 -0.28 0.06 0.00 -1.45 0.00 0.00 58.65 57.26 3m1a h GLN 160 Cb -0.06 0.08 -0.06 0.00 -0.05 0.00 0.00 27.48 27.40 3m1a h GLN 160 CO -0.06 1.01 0.42 -0.07 -0.95 0.00 0.00 178.83 179.19 3m1a h LEU 161 N 0.13 0.65 -0.24 1.46 3.38 -1.19 -1.96 115.31 117.54 3m1a h LEU 161 Ca -0.06 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 3m1a h LEU 161 Cb 1.58 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 42.21 3m1a h LEU 161 CO 0.15 0.42 0.09 0.28 0.09 0.00 0.00 178.44 179.47 3m1a h SER 162 N 0.78 0.33 -0.22 -0.43 0.02 -0.76 -1.64 113.55 111.63 3m1a h SER 162 Ca 0.32 -0.17 0.05 0.00 -0.84 0.00 0.00 61.79 61.14 3m1a h SER 162 Cb 0.16 -0.09 -0.04 0.00 0.14 0.00 0.00 62.40 62.57 3m1a h SER 162 CO -0.17 0.41 -0.06 -0.33 -1.14 0.00 0.00 176.83 175.54 3m1a h GLU 163 N 0.24 -0.01 0.14 3.45 5.08 -0.80 0.15 114.58 122.83 3m1a h GLU 163 Ca 0.08 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 3m1a h GLU 163 Cb 0.19 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 3m1a h GLU 163 CO -0.01 -0.00 -0.14 0.78 -1.00 0.00 0.00 179.01 178.64 3m1a h GLY 164 N -0.01 -0.29 0.38 -3.84 0.00 -1.35 -2.72 103.07 95.24 3m1a h GLY 164 Ca 0.11 0.16 0.07 0.00 0.00 0.00 0.00 47.33 47.67 3m1a h GLY 164 CO -0.24 -0.14 0.04 -2.00 0.00 0.00 0.00 176.54 174.20 3m1a h LEU 165 N -0.31 -0.10 -0.78 3.11 5.85 -1.17 -2.69 115.31 119.23 3m1a h LEU 165 Ca 0.00 0.09 0.09 0.00 0.84 0.00 0.00 57.88 58.90 3m1a h LEU 165 Cb 0.29 0.14 -0.07 0.00 0.37 0.00 0.00 40.66 41.39 3m1a h LEU 165 CO -0.03 -0.01 0.42 0.00 -0.34 0.00 0.00 178.44 178.48 3m1a h ALA 166 N 1.35 1.09 -0.48 1.25 0.00 -0.55 0.11 119.26 122.04 3m1a h ALA 166 Ca 0.21 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.11 3m1a h ALA 166 Cb 0.28 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 3m1a h ALA 166 CO -0.31 0.04 0.09 0.22 0.00 0.00 0.00 179.25 179.28 3m1a h ASP 167 N 0.72 0.70 0.44 0.00 3.58 -1.20 -1.94 116.42 118.71 3m1a h ASP 167 Ca 0.38 -0.13 -0.21 0.00 0.42 0.00 0.00 57.03 57.49 3m1a h ASP 167 Cb 0.36 -0.18 -0.00 0.00 1.72 0.00 0.00 39.33 41.22 3m1a h ASP 167 CO -0.25 0.71 -0.89 -0.33 -2.88 0.00 0.00 179.24 175.60 3m1a h GLU 168 N 0.72 0.31 -0.01 0.28 5.08 -0.73 -3.36 114.58 116.87 3m1a h GLU 168 Ca 0.16 -0.33 0.00 0.00 -1.00 0.00 0.00 59.36 58.19 3m1a h GLU 168 Cb 0.31 0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.65 3m1a h GLU 168 CO 0.00 1.02 -0.27 1.33 -1.00 0.00 0.00 179.01 180.09 3m1a n VAL 169 N -3.72 0.00 -0.28 3.13 0.24 -0.26 -4.36 118.33 113.08 3m1a n VAL 169 Ca -0.05 -0.37 0.10 0.00 -2.04 0.00 0.00 64.34 61.98 3m1a n VAL 169 Cb 0.81 1.18 0.24 0.00 -1.47 0.00 0.00 33.84 34.60 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 2.51 1.10 -0.16 2.33 0.00 -1.50 -1.59 119.26 121.95 3m1a h ALA 170 Ca 0.00 0.22 0.05 0.00 0.00 0.00 0.00 54.91 55.17 3m1a h ALA 170 Cb 0.50 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 3m1a h ALA 170 CO 0.00 -0.43 0.18 -1.35 0.00 0.00 0.00 179.25 177.65 3m1a h PRO 171 N 0.20 0.00 -0.25 0.00 0.11 -1.82 -0.38 132.00 129.85 3m1a h PRO 171 Ca 0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.60 3m1a h PRO 171 Cb 0.94 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.05 3m1a h PRO 171 CO -0.63 0.00 0.00 1.19 -0.21 0.00 0.00 178.00 178.35 3m1a n PHE 172 N -3.80 0.32 -1.11 0.65 3.01 -0.64 -4.93 117.46 110.97 3m1a n PHE 172 Ca 0.01 -0.16 -0.04 0.00 1.01 0.00 0.00 57.45 58.27 3m1a n PHE 172 Cb 0.30 0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 39.75 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 1.30 0.67 3.72 1.37 0.00 -0.15 -3.77 105.19 108.33 3m1a n GLY 173 Ca 0.17 -0.63 -0.40 0.00 0.00 0.00 0.00 46.02 45.17 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 -2.08 4.99 -0.12 -0.61 1.01 -0.99 -4.29 121.20 119.12 3m1a s ILE 174 Ca 0.00 1.48 -0.17 0.00 0.00 0.00 0.00 60.65 61.96 3m1a s ILE 174 Cb 0.00 -4.06 -0.04 0.00 0.01 0.00 0.00 42.46 38.37 3m1a s ILE 174 CO 0.00 0.27 0.44 -0.54 0.00 0.00 0.00 174.94 175.12 3m1a s LYS 175 N 0.65 4.32 -0.19 2.79 1.02 0.51 -4.18 119.74 124.65 3m1a s LYS 175 Ca 0.38 0.39 -0.00 0.00 0.02 0.00 0.00 55.97 56.76 3m1a s LYS 175 Cb -0.18 -3.43 0.01 0.00 -0.52 0.00 0.00 37.83 33.71 3m1a s LYS 175 CO 0.19 0.18 -0.16 0.08 -0.92 0.00 0.00 175.35 174.73 3m1a s VAL 176 N 0.56 2.42 -0.17 3.17 1.01 -1.26 -0.31 120.40 125.81 3m1a s VAL 176 Ca 0.24 -0.82 0.01 0.00 0.00 0.00 0.00 61.98 61.41 3m1a s VAL 176 Cb -0.15 -2.04 0.03 0.00 0.00 0.00 0.00 36.38 34.21 3m1a s VAL 176 CO 0.09 0.51 -0.16 -0.22 0.00 0.00 0.00 175.10 175.32 3m1a s LEU 177 N 1.34 2.02 -0.40 3.92 2.96 0.21 -4.47 118.68 124.27 3m1a s LEU 177 Ca 0.05 -0.64 -0.16 0.00 -0.22 0.00 0.00 54.13 53.16 3m1a s LEU 177 Cb -0.13 -1.32 0.01 0.00 0.50 0.00 0.00 46.19 45.25 3m1a s LEU 177 CO -0.10 -0.05 0.37 -0.63 -1.32 0.00 0.00 176.35 174.62 3m1a s ILE 178 N 1.38 5.16 -0.18 6.68 1.01 0.21 -0.70 121.20 134.75 3m1a s ILE 178 Ca 0.04 -0.34 -0.12 0.00 0.00 0.00 0.00 60.65 60.23 3m1a s ILE 178 Cb -0.14 -3.94 -0.05 0.00 0.01 0.00 0.00 42.46 38.34 3m1a s ILE 178 CO -0.11 -0.29 0.20 -0.69 0.00 0.00 0.00 174.94 174.05 3m1a s VAL 179 N 1.96 5.36 -0.61 2.92 1.01 -0.46 -0.51 120.40 130.07 3m1a s VAL 179 Ca 0.10 0.35 0.06 0.00 0.00 0.00 0.00 61.98 62.48 3m1a s VAL 179 Cb -0.17 -3.54 0.21 0.00 0.00 0.00 0.00 36.38 32.87 3m1a s VAL 179 CO 0.12 0.41 0.56 -0.62 0.00 0.00 0.00 175.10 175.58 3m1a n GLU 180 N 3.58 1.74 -2.01 2.72 1.02 -0.08 0.09 120.64 127.69 3m1a n GLU 180 Ca -0.14 -4.25 -0.33 0.00 -0.02 0.00 0.00 57.16 52.42 3m1a n GLU 180 Cb 0.52 -2.08 0.01 0.00 -0.02 0.00 0.00 31.44 29.87 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 -1.59 3.29 0.00 3.49 0.04 -1.26 -1.48 135.00 137.49 3m1a s PRO 181 Ca 0.32 1.18 0.00 0.00 0.04 0.00 0.00 61.00 62.55 3m1a s PRO 181 Cb 0.06 -2.03 0.00 0.00 0.04 0.00 0.00 34.50 32.57 3m1a s PRO 181 CO -0.11 -0.83 0.00 0.41 0.04 0.00 0.00 177.00 176.50 3m1a n GLY 182 N -1.06 1.50 3.74 0.56 0.00 -0.15 -3.11 105.19 106.67 3m1a n GLY 182 Ca 0.09 -1.51 -0.39 0.00 0.00 0.00 0.00 46.02 44.21 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 -3.34 3.44 0.19 4.61 0.00 -1.26 -5.02 121.76 120.38 3m1a s ALA 183 Ca 0.00 0.03 0.10 0.00 0.00 0.00 0.00 51.96 52.08 3m1a s ALA 183 Cb 0.00 -2.79 -0.04 0.00 0.00 0.00 0.00 23.12 20.28 3m1a s ALA 183 CO 0.00 0.06 -0.20 -0.06 0.00 0.00 0.00 175.76 175.56 3m1a s PHE 184 N 0.25 2.03 0.64 0.00 0.08 -1.26 -2.11 117.98 117.61 3m1a s PHE 184 Ca 0.32 -0.42 -0.17 0.00 0.12 0.00 0.00 56.93 56.78 3m1a s PHE 184 Cb -0.18 -0.98 -0.01 0.00 -0.57 0.00 0.00 43.02 41.28 3m1a s PHE 184 CO 0.16 0.44 1.16 1.03 -0.10 0.00 0.00 175.22 177.92 3m1a s ARG 185 N -2.92 2.75 0.00 0.44 1.81 -0.25 -3.18 118.95 117.59 3m1a s ARG 185 Ca 0.20 1.62 0.00 0.00 -1.72 0.00 0.00 55.73 55.83 3m1a s ARG 185 Cb -0.06 -1.92 0.00 0.00 -0.45 0.00 0.00 34.95 32.52 3m1a s ARG 185 CO 0.09 -1.33 0.11 0.25 -0.68 0.00 0.00 175.30 173.74 3m1a n THR 186 N -2.13 0.00 -0.02 0.02 -2.24 -1.26 -4.70 114.28 103.95 3m1a n THR 186 Ca 0.12 -0.41 -0.02 0.00 -2.27 0.00 0.00 64.05 61.48 3m1a n THR 186 Cb 0.51 1.05 0.25 0.00 -2.10 0.00 0.00 70.33 70.04 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 0.55 0.30 3.42 -1.07 -1.94 0.15 115.58 116.99 3m1a h ASN 187 Ca 0.00 -0.12 -0.33 0.00 0.07 0.00 0.00 56.30 55.92 3m1a h ASN 187 Cb 0.02 -0.14 -0.03 0.00 -2.07 0.00 0.00 38.32 36.10 3m1a h ASN 187 CO 0.00 0.65 -1.87 0.18 0.07 0.00 0.00 177.43 176.46 3m1a n LEU 188 N -4.24 1.77 -0.12 6.14 4.32 -1.26 -4.55 117.00 119.07 3m1a n LEU 188 Ca 0.01 0.30 0.02 0.00 -0.02 0.00 0.00 56.01 56.33 3m1a n LEU 188 Cb 0.28 -0.49 0.00 0.00 -1.62 0.00 0.00 43.42 41.60 3m1a n LEU 188 CO 0.40 0.63 0.20 0.49 -1.22 0.00 0.00 177.39 177.89 3m1a n PHE 189 N -3.26 0.00 -4.48 -1.77 3.72 -1.23 -5.06 117.46 105.38 3m1a n PHE 189 Ca -0.25 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.15 3m1a n PHE 189 Cb 1.05 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.59 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 0.57 -0.90 3.65 1.37 0.00 0.53 -0.56 105.19 109.85 3m1a n GLY 190 Ca 0.02 -1.15 -0.09 0.00 0.00 0.00 0.00 46.02 44.80 3m1a n GLY 190 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3m1a s LYS 191 N 0.00 1.54 0.99 1.61 -0.14 -1.26 -3.09 119.74 119.39 3m1a s LYS 191 Ca 0.00 -0.81 -0.14 0.00 -1.36 0.00 0.00 55.97 53.66 3m1a s LYS 191 Cb 0.00 0.58 0.19 0.00 -1.68 0.00 0.00 37.83 36.92 3m1a s LYS 191 CO 0.00 -0.69 1.16 0.20 -0.76 0.00 0.00 175.35 175.26 3m1a s GLY 192 N -2.86 1.61 0.89 -3.33 0.00 -1.26 -4.80 107.32 97.57 3m1a s GLY 192 Ca 0.08 -0.71 -0.11 0.00 0.00 0.00 0.00 44.72 43.98 3m1a s GLY 192 CO -0.01 -0.04 1.10 0.00 0.00 0.00 0.00 173.10 174.15 3m1a n ALA 193 N -4.03 -0.79 -3.57 3.20 0.00 -1.26 -4.80 120.51 109.26 3m1a n ALA 193 Ca 0.09 -0.51 -0.13 0.00 0.00 0.00 0.00 53.44 52.89 3m1a n ALA 193 Cb 0.59 -2.17 -0.13 0.00 0.00 0.00 0.00 19.45 17.73 3m1a n ALA 193 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3m1a s ALA 194 N -2.49 -0.39 -0.05 0.00 0.00 -1.26 -1.39 121.76 116.17 3m1a s ALA 194 Ca 0.68 0.73 0.06 0.00 0.00 0.00 0.00 51.96 53.42 3m1a s ALA 194 Cb -0.24 -0.47 -0.01 0.00 0.00 0.00 0.00 23.12 22.40 3m1a s ALA 194 CO 0.57 -0.15 -0.23 -0.47 0.00 0.00 0.00 175.76 175.48 3m1a s TYR 195 N 0.94 2.24 -0.22 0.00 5.04 -0.32 -4.97 117.35 120.06 3m1a s TYR 195 Ca -0.07 -0.65 0.01 0.00 -2.44 0.00 0.00 57.07 53.92 3m1a s TYR 195 Cb -0.09 -1.47 0.05 0.00 0.35 0.00 0.00 41.96 40.80 3m1a s TYR 195 CO -0.05 -0.20 -0.10 -0.06 -1.34 0.00 0.00 175.55 173.80 3m1a s PHE 196 N -0.13 2.61 0.70 4.97 0.08 -1.26 -1.87 117.98 123.07 3m1a s PHE 196 Ca -0.03 -1.77 -0.17 0.00 0.12 0.00 0.00 56.93 55.09 3m1a s PHE 196 Cb -0.13 -1.71 0.01 0.00 -0.57 0.00 0.00 43.02 40.62 3m1a s PHE 196 CO 0.03 -0.78 1.15 0.43 -0.10 0.00 0.00 175.22 175.95 3m1a n SER 197 N 4.63 1.27 -4.59 1.36 7.64 -0.01 -4.92 113.62 119.00 3m1a n SER 197 Ca -0.15 0.73 -0.49 0.00 1.01 0.00 0.00 58.87 59.98 3m1a n SER 197 Cb 0.45 -1.49 -0.04 0.00 -1.01 0.00 0.00 64.21 62.13 3m1a n SER 197 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 3m1a n GLU 198 N -2.06 1.30 -3.36 1.43 2.13 -1.26 -4.91 120.64 113.92 3m1a n GLU 198 Ca 0.14 0.47 -0.39 0.00 0.66 0.00 0.00 57.16 58.04 3m1a n GLU 198 Cb 0.49 -2.02 -0.09 0.00 0.27 0.00 0.00 31.44 30.09 3m1a n GLU 198 CO 0.00 0.00 0.00 -1.21 -0.41 0.00 0.00 177.13 175.51 3m1a s GLU 199 N -0.19 4.02 -0.08 5.31 2.02 -1.26 -4.84 118.70 123.68 3m1a s GLU 199 Ca 0.75 0.09 -0.11 0.00 0.02 0.00 0.00 54.97 55.72 3m1a s GLU 199 Cb -0.84 -3.66 -0.05 0.00 0.10 0.00 0.00 34.13 29.69 3m1a s GLU 199 CO 0.50 -0.30 0.26 0.54 0.02 0.00 0.00 175.26 176.28 3m1a s ASN 200 N 1.62 6.55 0.23 -0.19 6.03 -1.26 -4.91 114.94 123.01 3m1a s ASN 200 Ca 0.16 0.65 0.12 0.00 -1.03 0.00 0.00 52.86 52.76 3m1a s ASN 200 Cb -0.16 -2.15 0.80 0.00 -3.03 0.00 0.00 41.25 36.72 3m1a s ASN 200 CO 0.10 0.34 0.98 -2.65 -2.03 0.00 0.00 177.10 173.84 3m1a n PRO 201 N 2.13 -0.04 0.13 3.55 -0.02 -1.26 0.23 135.00 139.73 3m1a n PRO 201 Ca -0.17 0.86 0.12 0.00 -2.02 0.00 0.00 63.50 62.30 3m1a n PRO 201 Cb 0.54 -1.54 0.64 0.00 -0.02 0.00 0.00 33.50 33.12 3m1a n PRO 201 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3m1a h ALA 202 N 1.24 2.17 0.00 3.55 0.00 -2.04 -3.26 119.26 120.93 3m1a h ALA 202 Ca 0.51 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.42 3m1a h ALA 202 Cb 1.34 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.13 3m1a h ALA 202 CO -0.49 -0.23 -1.18 0.66 0.00 0.00 0.00 179.25 178.01 3m1a n TYR 203 N -4.48 0.00 -0.26 0.00 4.01 0.14 -4.79 117.16 111.78 3m1a n TYR 203 Ca 0.03 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.84 3m1a n TYR 203 Cb 0.29 -0.15 0.19 0.00 -0.31 0.00 0.00 39.34 39.36 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 0.80 0.93 -0.78 -0.72 0.00 -1.51 0.68 119.26 118.67 3m1a h ALA 204 Ca 0.00 0.22 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 3m1a h ALA 204 Cb 0.33 0.35 -0.04 0.00 0.00 0.00 0.00 17.79 18.43 3m1a h ALA 204 CO 0.00 -0.41 0.42 1.05 0.00 0.00 0.00 179.25 180.31 3m1a h GLU 205 N 0.17 1.08 0.12 0.00 -0.00 -1.87 0.15 114.58 114.22 3m1a h GLU 205 Ca 0.44 -0.12 -0.19 0.00 -0.00 0.00 0.00 59.36 59.49 3m1a h GLU 205 Cb 0.80 -0.21 0.01 0.00 -0.00 0.00 0.00 28.75 29.35 3m1a h GLU 205 CO -0.62 0.79 -0.88 0.87 -0.00 0.00 0.00 179.01 179.17 3m1a h LYS 206 N 1.08 0.25 0.21 1.06 1.79 -1.52 -3.40 116.57 116.04 3m1a h LYS 206 Ca 0.27 -0.43 -0.33 0.00 -2.18 0.00 0.00 60.65 57.99 3m1a h LYS 206 Cb 0.03 0.16 0.02 0.00 -1.58 0.00 0.00 32.23 30.86 3m1a h LYS 206 CO -0.04 1.21 -1.49 0.28 -1.08 0.00 0.00 179.45 178.32 3m1a h VAL 207 N -0.43 1.25 -0.88 0.50 2.07 -0.90 -3.37 116.25 114.49 3m1a h VAL 207 Ca -0.17 -2.75 0.14 0.00 0.82 0.00 0.00 66.70 64.75 3m1a h VAL 207 Cb 1.60 2.95 -0.15 0.00 -1.52 0.00 0.00 31.29 34.17 3m1a h VAL 207 CO 0.11 0.84 -0.32 0.61 0.02 0.00 0.00 177.57 178.83 3m1a n GLY 208 N 1.70 -1.75 0.31 2.17 0.00 0.51 -0.89 105.19 107.25 3m1a n GLY 208 Ca -0.17 0.98 0.02 0.00 0.00 0.00 0.00 46.02 46.85 3m1a n GLY 208 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3m1a h PRO 209 N 0.00 0.68 -0.69 1.61 0.11 -1.79 -2.36 132.00 129.55 3m1a h PRO 209 Ca 0.33 -0.07 -0.03 0.00 0.11 0.00 0.00 66.00 66.34 3m1a h PRO 209 Cb 0.55 -0.14 -0.03 0.00 0.11 0.00 0.00 31.00 31.49 3m1a h PRO 209 CO -0.88 0.51 0.31 1.15 -0.21 0.00 0.00 178.00 178.88 3m1a h THR 210 N 0.69 1.23 -0.52 -1.15 2.02 -1.21 0.61 112.91 114.57 3m1a h THR 210 Ca 0.18 -0.67 0.04 0.00 0.77 0.00 0.00 66.41 66.73 3m1a h THR 210 Cb 0.03 0.37 -0.04 0.00 -1.74 0.00 0.00 68.15 66.76 3m1a h THR 210 CO -0.03 0.28 0.27 -0.09 0.37 0.00 0.00 175.52 176.32 3m1a h ARG 211 N 0.99 0.51 0.21 6.66 2.43 -1.14 -1.61 114.38 122.43 3m1a h ARG 211 Ca 0.24 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.37 3m1a h ARG 211 Cb 0.14 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.57 3m1a h ARG 211 CO -0.03 0.34 -0.10 1.96 -1.51 0.00 0.00 179.97 180.63 3m1a h GLN 212 N 0.53 -0.28 -0.75 0.20 7.50 -1.17 -0.27 115.11 120.87 3m1a h GLN 212 Ca 0.23 0.02 0.11 0.00 0.50 0.00 0.00 58.65 59.50 3m1a h GLN 212 Cb 0.13 0.06 -0.12 0.00 0.05 0.00 0.00 27.48 27.59 3m1a h GLN 212 CO -0.15 -0.10 -0.43 1.25 -1.50 0.00 0.00 178.83 177.90 3m1a h LEU 213 N -0.40 -1.52 -0.43 1.46 6.46 -0.69 -2.07 115.31 118.11 3m1a h LEU 213 Ca -0.03 0.27 -0.18 0.00 -0.12 0.00 0.00 57.88 57.82 3m1a h LEU 213 Cb 0.30 0.72 -0.01 0.00 -0.73 0.00 0.00 40.66 40.95 3m1a h LEU 213 CO 0.05 -0.31 -0.72 -0.37 -0.62 0.00 0.00 178.44 176.48 3m1a h VAL 214 N -0.13 1.38 -0.51 1.05 -1.51 -1.28 -3.49 116.25 111.76 3m1a h VAL 214 Ca 0.23 -2.13 -0.72 0.00 -1.23 0.00 0.00 66.70 62.85 3m1a h VAL 214 Cb 0.55 2.10 -0.07 0.00 -2.13 0.00 0.00 31.29 31.74 3m1a h VAL 214 CO -0.80 0.64 2.84 0.00 -1.23 0.00 0.00 177.57 179.01 3m1a n GLN 215 N -3.84 3.33 0.00 5.19 6.02 -0.12 -5.10 117.38 122.87 3m1a n GLN 215 Ca -0.04 -2.90 0.00 0.00 -0.01 0.00 0.00 57.00 54.05 3m1a n GLN 215 Cb 0.70 -3.06 0.00 0.00 1.02 0.00 0.00 30.24 28.89 3m1a n GLN 215 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 177.06 176.99 3m1a n GLN 221 N 4.74 0.00 0.09 -1.09 -0.06 -1.19 -5.03 117.38 114.84 3m1a n GLN 221 Ca 0.52 0.00 -0.07 0.00 -2.00 0.00 0.00 57.00 55.45 3m1a n GLN 221 Cb 0.35 0.00 0.01 0.00 -4.06 0.00 0.00 30.24 26.54 3m1a n GLN 221 CO 0.00 0.00 0.00 -1.35 -0.20 0.00 0.00 177.06 175.51 3m1a h PRO 222 N 0.00 0.15 -6.58 3.69 0.11 -1.90 -3.41 132.00 124.06 3m1a h PRO 222 Ca 0.00 -0.16 -0.52 0.00 0.11 0.00 0.00 66.00 65.43 3m1a h PRO 222 Cb 0.00 0.04 -0.03 0.00 0.11 0.00 0.00 31.00 31.13 3m1a h PRO 222 CO 0.00 0.90 0.22 0.20 -0.21 0.00 0.00 178.00 179.11 3m1a s GLY 223 N -4.51 2.97 -0.37 -0.55 0.00 -0.90 -4.90 107.32 99.05 3m1a s GLY 223 Ca -0.02 0.42 -0.14 0.00 0.00 0.00 0.00 44.72 44.98 3m1a s GLY 223 CO 0.82 0.94 0.29 -0.35 0.00 0.00 0.00 173.10 174.80 3m1a s ASP 224 N -1.16 6.10 0.40 1.64 3.68 -1.26 -1.09 116.67 124.98 3m1a s ASP 224 Ca 0.37 -0.62 0.09 0.00 2.13 0.00 0.00 52.55 54.51 3m1a s ASP 224 Cb -0.24 -2.16 0.88 0.00 -1.45 0.00 0.00 42.92 39.95 3m1a s ASP 224 CO 0.28 -0.36 2.01 -0.65 0.13 0.00 0.00 175.17 176.58 3m1a h PRO 225 N 8.56 0.55 -0.48 4.34 0.11 -1.97 -0.00 132.00 143.11 3m1a h PRO 225 Ca -0.29 -0.03 -0.11 0.00 0.11 0.00 0.00 66.00 65.68 3m1a h PRO 225 Cb 1.14 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.11 3m1a h PRO 225 CO 0.69 0.36 -0.13 0.00 -0.21 0.00 0.00 178.00 178.71 3m1a h ALA 226 N 1.69 0.67 -0.31 -0.75 0.00 -1.94 -1.21 119.26 117.41 3m1a h ALA 226 Ca 0.23 -0.35 -0.11 0.00 0.00 0.00 0.00 54.91 54.68 3m1a h ALA 226 Cb 0.18 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 3m1a h ALA 226 CO -0.06 0.59 -0.25 0.87 0.00 0.00 0.00 179.25 180.39 3m1a h LYS 227 N 0.79 0.61 -0.07 0.00 1.57 -1.83 -2.09 116.57 115.56 3m1a h LYS 227 Ca 0.12 -0.24 0.01 0.00 -1.87 0.00 0.00 60.65 58.67 3m1a h LYS 227 Cb 0.69 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.96 3m1a h LYS 227 CO 0.05 0.81 -0.01 0.00 -0.57 0.00 0.00 179.45 179.74 3m1a h ALA 228 N 1.19 0.05 -0.31 3.86 0.00 -0.84 -1.97 119.26 121.24 3m1a h ALA 228 Ca 0.07 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 3m1a h ALA 228 Cb 0.72 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 3m1a h ALA 228 CO 0.06 -0.48 0.03 0.00 0.00 0.00 0.00 179.25 178.85 3m1a h ALA 229 N 1.06 1.48 -0.52 0.00 0.00 -0.94 -1.81 119.26 118.55 3m1a h ALA 229 Ca 0.03 -0.16 -0.10 0.00 0.00 0.00 0.00 54.91 54.68 3m1a h ALA 229 Cb 0.04 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 3m1a h ALA 229 CO -0.06 0.37 -0.08 0.00 0.00 0.00 0.00 179.25 179.49 3m1a h ALA 230 N 1.59 0.70 -0.58 0.00 0.00 -1.20 -2.38 119.26 117.41 3m1a h ALA 230 Ca 0.10 -0.33 -0.04 0.00 0.00 0.00 0.00 54.91 54.64 3m1a h ALA 230 Cb 0.25 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 3m1a h ALA 230 CO 0.00 0.59 0.20 0.00 0.00 0.00 0.00 179.25 180.04 3m1a h ALA 231 N 0.92 1.27 -0.59 0.00 0.00 -0.78 -0.32 119.26 119.77 3m1a h ALA 231 Ca 0.14 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 3m1a h ALA 231 Cb 0.63 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 3m1a h ALA 231 CO 0.04 0.53 0.30 0.82 0.00 0.00 0.00 179.25 180.95 3m1a h ILE 232 N 0.84 1.20 -0.26 0.00 2.04 -1.21 -1.04 117.51 119.08 3m1a h ILE 232 Ca 0.19 -0.53 -0.13 0.00 1.00 0.00 0.00 64.86 65.39 3m1a h ILE 232 Cb 0.21 0.48 -0.01 0.00 -0.74 0.00 0.00 36.82 36.76 3m1a h ILE 232 CO -0.01 0.22 -0.39 0.03 0.00 0.00 0.00 178.15 178.00 3m1a h ARG 233 N 0.79 0.61 -0.26 2.37 3.08 -0.98 -1.85 114.38 118.13 3m1a h ARG 233 Ca 0.20 -0.30 -0.01 0.00 0.07 0.00 0.00 59.98 59.94 3m1a h ARG 233 Cb 0.08 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.12 3m1a h ARG 233 CO -0.03 0.90 0.11 1.25 -1.07 0.00 0.00 179.97 181.13 3m1a h LEU 234 N 0.50 0.35 -0.72 3.04 6.46 -0.95 -1.83 115.31 122.16 3m1a h LEU 234 Ca 0.04 -0.14 -0.03 0.00 -0.12 0.00 0.00 57.88 57.63 3m1a h LEU 234 Cb 0.90 -0.09 -0.03 0.00 -0.73 0.00 0.00 40.66 40.71 3m1a h LEU 234 CO 0.08 0.40 0.33 0.00 -0.62 0.00 0.00 178.44 178.62 3m1a h ALA 235 N 0.97 0.93 -0.18 1.25 0.00 -1.02 -2.21 119.26 118.99 3m1a h ALA 235 Ca 0.09 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 3m1a h ALA 235 Cb 0.15 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 3m1a h ALA 235 CO -0.01 0.51 -0.10 -0.07 0.00 0.00 0.00 179.25 179.58 3m1a h LEU 236 N 1.01 0.26 -1.43 0.00 3.38 -1.28 -3.05 115.31 114.20 3m1a h LEU 236 Ca 0.24 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.16 3m1a h LEU 236 Cb 0.15 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.83 3m1a h LEU 236 CO -0.03 0.40 0.00 0.47 0.09 0.00 0.00 178.44 179.37 3m1a n ASP 237 N -4.29 2.16 -4.84 -0.43 8.00 -0.69 -4.88 116.55 111.58 3m1a n ASP 237 Ca -0.00 -1.78 -0.34 0.00 0.71 0.00 0.00 54.79 53.38 3m1a n ASP 237 Cb 0.25 -0.13 -0.06 0.00 -0.02 0.00 0.00 41.12 41.17 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 -1.75 4.66 0.13 -3.53 2.01 -0.87 -5.01 115.64 111.29 3m1a s THR 238 Ca 0.34 1.03 -0.28 0.00 0.31 0.00 0.00 61.69 63.08 3m1a s THR 238 Cb 0.19 -3.70 -0.05 0.00 0.01 0.00 0.00 72.50 68.95 3m1a s THR 238 CO 0.28 -0.03 1.59 1.05 -0.69 0.00 0.00 174.62 176.82 3m1a h GLU 239 N 2.72 -0.47 -4.23 4.92 9.09 -1.90 -3.30 114.58 121.42 3m1a h GLU 239 Ca -0.48 0.03 -0.74 0.00 0.05 0.00 0.00 59.36 58.22 3m1a h GLU 239 Cb 1.18 0.11 -0.24 0.00 -1.65 0.00 0.00 28.75 28.14 3m1a h GLU 239 CO 0.66 -0.31 -0.30 -1.59 0.05 0.00 0.00 179.01 177.51 3m1a s LYS 240 N -5.92 2.90 0.07 1.06 0.00 -1.26 -5.06 119.74 111.52 3m1a s LYS 240 Ca -0.15 -1.55 -0.30 0.00 0.00 0.00 0.00 55.97 53.96 3m1a s LYS 240 Cb 0.09 -4.15 -0.05 0.00 0.00 0.00 0.00 37.83 33.72 3m1a s LYS 240 CO 0.65 -1.16 1.11 0.99 0.00 0.00 0.00 175.35 176.94 3m1a s THR 241 N 1.57 4.23 0.65 3.79 2.01 -1.25 -5.01 115.64 121.64 3m1a s THR 241 Ca 0.04 1.67 -0.15 0.00 0.31 0.00 0.00 61.69 63.55 3m1a s THR 241 Cb -0.27 -4.07 -0.00 0.00 0.01 0.00 0.00 72.50 68.17 3m1a s THR 241 CO 0.04 0.16 1.10 -2.16 -0.69 0.00 0.00 174.62 173.08 3m1a s PRO 242 N 0.73 2.86 0.13 4.92 0.04 -1.26 -4.94 135.00 137.49 3m1a s PRO 242 Ca 0.55 1.37 -0.10 0.00 0.04 0.00 0.00 61.00 62.86 3m1a s PRO 242 Cb -0.27 -1.96 -0.06 0.00 0.04 0.00 0.00 34.50 32.25 3m1a s PRO 242 CO 0.30 -1.20 1.40 1.25 0.04 0.00 0.00 177.00 178.79 3m1a h LEU 243 N 0.08 0.88 -8.58 -3.56 5.85 -1.94 -3.42 115.31 104.62 3m1a h LEU 243 Ca -0.47 -0.51 -0.66 0.00 0.84 0.00 0.00 57.88 57.09 3m1a h LEU 243 Cb 1.24 -0.26 -0.29 0.00 0.37 0.00 0.00 40.66 41.73 3m1a h LEU 243 CO 0.54 1.29 -0.87 -0.13 -0.34 0.00 0.00 178.44 178.94 3m1a s ARG 244 N -3.97 1.84 -0.27 1.25 0.52 -1.26 0.64 118.95 117.70 3m1a s ARG 244 Ca -0.10 -0.91 -0.00 0.00 -0.52 0.00 0.00 55.73 54.20 3m1a s ARG 244 Cb 0.10 -1.85 0.08 0.00 0.52 0.00 0.00 34.95 33.81 3m1a s ARG 244 CO 0.88 0.50 0.05 -1.17 0.02 0.00 0.00 175.30 175.58 3m1a s LEU 245 N -0.76 2.38 0.46 2.53 0.20 0.33 -4.93 118.68 118.89 3m1a s LEU 245 Ca 0.09 -1.44 -0.24 0.00 0.69 0.00 0.00 54.13 53.24 3m1a s LEU 245 Cb -0.09 -0.96 -0.07 0.00 -0.43 0.00 0.00 46.19 44.63 3m1a s LEU 245 CO -0.00 -0.35 1.23 0.00 -0.29 0.00 0.00 176.35 176.94 3m1a s ALA 246 N 1.54 3.02 -0.11 5.97 0.00 -1.26 -0.90 121.76 130.01 3m1a s ALA 246 Ca 0.04 1.08 -0.00 0.00 0.00 0.00 0.00 51.96 53.09 3m1a s ALA 246 Cb -0.18 -3.44 0.02 0.00 0.00 0.00 0.00 23.12 19.52 3m1a s ALA 246 CO -0.16 -0.83 -0.08 -0.51 0.00 0.00 0.00 175.76 174.18 3m1a s LEU 247 N -2.95 1.26 0.00 0.00 1.43 -0.55 -4.83 118.68 113.04 3m1a s LEU 247 Ca 0.63 -0.31 0.00 0.00 -1.03 0.00 0.00 54.13 53.42 3m1a s LEU 247 Cb -0.33 -0.86 0.00 0.00 0.03 0.00 0.00 46.19 45.02 3m1a s LEU 247 CO 0.41 -0.10 0.00 0.61 0.23 0.00 0.00 176.35 177.50 3m1a n GLY 248 N 4.83 2.39 0.36 -3.19 0.00 -1.26 -0.98 105.19 107.34 3m1a n GLY 248 Ca -0.14 -1.49 0.19 0.00 0.00 0.00 0.00 46.02 44.59 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 1.72 0.91 -0.02 0.00 -1.99 -2.09 103.07 101.60 3m1a h GLY 249 Ca 0.00 -0.28 -0.01 0.00 0.00 0.00 0.00 47.33 47.04 3m1a h GLY 249 CO 0.00 -0.22 0.09 1.29 0.00 0.00 0.00 176.54 177.69 3m1a h ASP 250 N 0.52 0.25 -0.36 0.19 2.03 -1.98 -1.29 116.42 115.77 3m1a h ASP 250 Ca 0.64 -0.13 0.03 0.00 -0.73 0.00 0.00 57.03 56.83 3m1a h ASP 250 Cb 1.33 -0.06 -0.03 0.00 -0.83 0.00 0.00 39.33 39.74 3m1a h ASP 250 CO -0.43 0.31 0.18 0.00 -1.03 0.00 0.00 179.24 178.27 3m1a h ALA 251 N 0.94 0.44 -0.52 4.15 0.00 -1.64 -1.80 119.26 120.84 3m1a h ALA 251 Ca 0.06 0.01 0.07 0.00 0.00 0.00 0.00 54.91 55.05 3m1a h ALA 251 Cb 0.13 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 17.82 3m1a h ALA 251 CO -0.01 -0.19 0.21 0.28 0.00 0.00 0.00 179.25 179.54 3m1a h VAL 252 N 0.36 0.86 -0.12 0.00 2.07 -1.28 -1.51 116.25 116.63 3m1a h VAL 252 Ca 0.15 -0.14 -0.00 0.00 0.82 0.00 0.00 66.70 67.53 3m1a h VAL 252 Cb 0.06 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.25 3m1a h VAL 252 CO -0.11 0.07 0.06 0.44 0.02 0.00 0.00 177.57 178.06 3m1a h ASP 253 N 0.40 0.15 -0.58 0.57 3.32 -0.79 -1.08 116.42 118.41 3m1a h ASP 253 Ca 0.24 -0.09 0.06 0.00 0.02 0.00 0.00 57.03 57.27 3m1a h ASP 253 Cb 0.24 -0.04 -0.06 0.00 0.22 0.00 0.00 39.33 39.70 3m1a h ASP 253 CO -0.23 0.19 0.27 -0.26 -1.72 0.00 0.00 179.24 177.50 3m1a h PHE 254 N 0.09 0.49 -0.41 4.55 0.04 -1.12 -2.06 116.94 118.52 3m1a h PHE 254 Ca 0.04 0.02 -0.06 0.00 2.80 0.00 0.00 57.97 60.77 3m1a h PHE 254 Cb 0.08 -0.13 -0.02 0.00 2.20 0.00 0.00 35.95 38.08 3m1a h PHE 254 CO -0.04 0.20 0.01 -0.07 -0.60 0.00 0.00 178.31 177.82 3m1a h LEU 255 N 0.51 0.70 -0.33 1.54 3.38 -0.99 -1.55 115.31 118.57 3m1a h LEU 255 Ca 0.27 -0.30 -0.14 0.00 0.09 0.00 0.00 57.88 57.80 3m1a h LEU 255 Cb 0.23 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.79 3m1a h LEU 255 CO -0.21 0.83 -0.34 0.71 0.09 0.00 0.00 178.44 179.52 3m1a h THR 256 N 0.56 1.29 -0.95 0.22 1.35 -1.15 -0.44 112.91 113.79 3m1a h THR 256 Ca 0.12 -1.51 0.00 0.00 -0.55 0.00 0.00 66.41 64.47 3m1a h THR 256 Cb 0.46 1.50 -0.05 0.00 -1.73 0.00 0.00 68.15 68.33 3m1a h THR 256 CO 0.02 0.50 0.61 1.23 -0.25 0.00 0.00 175.52 177.63 3m1a h GLY 257 N 0.60 1.35 0.76 5.82 0.00 -1.32 0.78 103.07 111.05 3m1a h GLY 257 Ca 0.05 -0.52 -0.09 0.00 0.00 0.00 0.00 47.33 46.77 3m1a h GLY 257 CO 0.08 0.51 -0.28 0.84 0.00 0.00 0.00 176.54 177.69 3m1a h HIS 258 N 1.30 0.52 -0.81 5.60 6.17 -1.18 -2.15 115.15 124.58 3m1a h HIS 258 Ca 0.35 -0.20 0.12 0.00 0.71 0.00 0.00 60.37 61.35 3m1a h HIS 258 Cb -0.12 -0.09 -0.08 0.00 2.52 0.00 0.00 27.41 29.63 3m1a h HIS 258 CO -0.00 0.90 0.43 -0.07 0.71 0.00 0.00 177.93 179.90 3m1a h LEU 259 N -0.02 0.56 -0.23 0.26 3.38 -0.94 -1.91 115.31 116.41 3m1a h LEU 259 Ca -0.00 0.07 0.01 0.00 0.09 0.00 0.00 57.88 58.05 3m1a h LEU 259 Cb 0.89 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.60 3m1a h LEU 259 CO 0.06 0.28 0.12 0.44 0.09 0.00 0.00 178.44 179.43 3m1a h ASP 260 N 0.67 0.19 0.41 -0.43 3.32 -0.73 -2.19 116.42 117.67 3m1a h ASP 260 Ca 0.42 0.01 -0.19 0.00 0.02 0.00 0.00 57.03 57.29 3m1a h ASP 260 Cb 0.50 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 40.01 3m1a h ASP 260 CO -0.31 0.14 -0.80 0.77 -1.72 0.00 0.00 179.24 177.33 3m1a h SER 261 N 0.25 0.36 -0.23 6.45 4.64 -1.14 -1.90 113.55 121.99 3m1a h SER 261 Ca 0.09 -0.26 -0.03 0.00 -0.47 0.00 0.00 61.79 61.12 3m1a h SER 261 Cb 0.01 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 61.98 3m1a h SER 261 CO -0.05 1.02 0.04 0.58 -0.87 0.00 0.00 176.83 177.55 3m1a h VAL 262 N 0.19 1.22 -0.68 0.95 2.07 -1.35 -1.46 116.25 117.19 3m1a h VAL 262 Ca -0.04 -0.74 -0.03 0.00 0.82 0.00 0.00 66.70 66.71 3m1a h VAL 262 Cb 1.39 1.28 -0.03 0.00 -1.52 0.00 0.00 31.29 32.41 3m1a h VAL 262 CO 0.13 0.23 0.32 -0.09 0.02 0.00 0.00 177.57 178.18 3m1a h ARG 263 N 0.18 0.98 -0.33 1.57 2.43 -1.39 -1.63 114.38 116.20 3m1a h ARG 263 Ca 0.07 -0.15 0.02 0.00 -0.81 0.00 0.00 59.98 59.11 3m1a h ARG 263 Cb 0.31 -0.17 -0.03 0.00 -0.42 0.00 0.00 29.97 29.66 3m1a h ARG 263 CO 0.00 0.78 0.17 0.00 -1.51 0.00 0.00 179.97 179.41 3m1a h ALA 264 N 1.15 0.40 -0.52 2.80 0.00 -1.24 -1.75 119.26 120.10 3m1a h ALA 264 Ca 0.23 0.01 -0.10 0.00 0.00 0.00 0.00 54.91 55.05 3m1a h ALA 264 Cb 0.13 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 3m1a h ALA 264 CO -0.03 -0.21 -0.08 1.49 0.00 0.00 0.00 179.25 180.43 3m1a h GLU 265 N 0.34 0.94 -0.35 0.00 4.81 -1.09 -1.97 114.58 117.26 3m1a h GLU 265 Ca 0.13 -0.32 -0.01 0.00 -0.13 0.00 0.00 59.36 59.04 3m1a h GLU 265 Cb 0.04 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.33 3m1a h GLU 265 CO -0.09 0.98 0.19 1.25 -0.73 0.00 0.00 179.01 180.61 3m1a h LEU 266 N 0.85 0.44 -0.65 1.64 5.85 -1.10 -2.12 115.31 120.23 3m1a h LEU 266 Ca 0.14 -0.09 -0.06 0.00 0.84 0.00 0.00 57.88 58.71 3m1a h LEU 266 Cb 0.61 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.50 3m1a h LEU 266 CO 0.04 0.41 0.17 0.74 -0.34 0.00 0.00 178.44 179.46 3m1a h THR 267 N 0.44 1.25 -0.60 1.05 2.02 -1.20 -1.22 112.91 114.66 3m1a h THR 267 Ca 0.12 -0.91 -0.00 0.00 0.77 0.00 0.00 66.41 66.39 3m1a h THR 267 Cb 0.07 0.61 -0.03 0.00 -1.74 0.00 0.00 68.15 67.05 3m1a h THR 267 CO -0.02 0.35 0.36 -0.08 0.37 0.00 0.00 175.52 176.49 3m1a h GLU 268 N 0.96 0.81 -0.66 6.66 4.81 -1.22 -2.63 114.58 123.30 3m1a h GLU 268 Ca 0.21 -0.08 0.00 0.00 -0.13 0.00 0.00 59.36 59.36 3m1a h GLU 268 Cb 0.34 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.55 3m1a h GLU 268 CO -0.00 0.59 0.00 0.91 -0.73 0.00 0.00 179.01 179.78 3m1a n TRP 269 N -4.62 1.29 -0.19 0.92 7.02 -0.81 -4.59 117.44 116.46 3m1a n TRP 269 Ca 0.04 -0.53 -0.09 0.00 -1.02 0.00 0.00 57.50 55.89 3m1a n TRP 269 Cb 0.06 -0.18 0.01 0.00 -2.42 0.00 0.00 31.31 28.79 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 3.89 0.95 -0.37 -0.99 4.81 -0.83 0.01 114.58 122.05 3m1a h GLU 270 Ca 0.00 -0.29 -0.03 0.00 -0.13 0.00 0.00 59.36 58.91 3m1a h GLU 270 Cb 1.26 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 30.54 3m1a h GLU 270 CO 0.17 0.95 0.10 0.87 -0.73 0.00 0.00 179.01 180.37 3m1a h LYS 271 N 0.83 0.58 0.09 1.92 1.57 -1.81 0.74 116.57 120.50 3m1a h LYS 271 Ca 0.16 -0.13 0.02 0.00 -1.87 0.00 0.00 60.65 58.82 3m1a h LYS 271 Cb 0.50 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.70 3m1a h LYS 271 CO 0.02 0.61 -0.20 0.28 -0.57 0.00 0.00 179.45 179.60 3m1a h VAL 272 N 0.44 0.55 -0.46 0.50 2.07 -1.84 -0.93 116.25 116.59 3m1a h VAL 272 Ca 0.12 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.73 3m1a h VAL 272 Cb 0.28 0.55 -0.08 0.00 -1.52 0.00 0.00 31.29 30.52 3m1a h VAL 272 CO -0.00 0.00 -0.04 0.28 0.02 0.00 0.00 177.57 177.83 3m1a h SER 273 N -0.36 -0.28 1.13 0.57 0.02 -0.77 -1.97 113.55 111.90 3m1a h SER 273 Ca 0.03 0.12 -0.02 0.00 -0.84 0.00 0.00 61.79 61.08 3m1a h SER 273 Cb 0.39 0.23 -0.00 0.00 0.14 0.00 0.00 62.40 63.16 3m1a h SER 273 CO -0.12 -0.10 -0.10 0.03 -1.14 0.00 0.00 176.83 175.41 3m1a h ARG 274 N 0.07 0.00 0.00 3.45 3.08 -0.68 -3.15 114.38 117.15 3m1a h ARG 274 Ca 0.23 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.28 3m1a h ARG 274 Cb 0.34 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.39 3m1a h ARG 274 CO -0.41 0.10 0.00 0.41 -1.07 0.00 0.00 179.97 178.99 3m1a n GLY 275 N 0.25 -1.32 0.19 0.04 0.00 -0.37 -2.69 105.19 101.29 3m1a n GLY 275 Ca 0.01 -0.08 0.11 0.00 0.00 0.00 0.00 46.02 46.05 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 -1.51 0.06 0.95 2.61 -2.24 -1.19 -5.09 114.28 107.87 3m1a n THR 276 Ca 0.06 -0.12 0.08 0.00 -2.27 0.00 0.00 64.05 61.80 3m1a n THR 276 Cb 0.28 -0.07 0.45 0.00 -2.10 0.00 0.00 70.33 68.89 3m1a n THR 276 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97