#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 3.38 0.08 -1.46 0.00 -1.26 -5.04 121.76 117.46 3m1a s ALA 5 Ca 0.00 1.20 0.07 0.00 0.00 0.00 0.00 51.96 53.23 3m1a s ALA 5 Cb 0.00 -3.46 -0.04 0.00 0.00 0.00 0.00 23.12 19.62 3m1a s ALA 5 CO 0.00 -0.66 -0.14 0.15 0.00 0.00 0.00 175.76 175.10 3m1a s LYS 6 N -1.98 2.05 -0.33 0.00 -0.14 -1.26 -4.95 119.74 113.14 3m1a s LYS 6 Ca 0.52 -1.03 -0.16 0.00 -1.36 0.00 0.00 55.97 53.95 3m1a s LYS 6 Cb -0.38 -2.24 -0.01 0.00 -1.68 0.00 0.00 37.83 33.52 3m1a s LYS 6 CO 0.49 0.52 0.39 0.08 -0.76 0.00 0.00 175.35 176.07 3m1a s VAL 7 N -1.09 5.14 -0.17 3.17 1.01 -1.26 -0.91 120.40 126.29 3m1a s VAL 7 Ca 0.18 0.19 -0.09 0.00 0.00 0.00 0.00 61.98 62.26 3m1a s VAL 7 Cb -0.11 -3.83 -0.05 0.00 0.00 0.00 0.00 36.38 32.40 3m1a s VAL 7 CO 0.10 -0.07 0.12 0.26 0.00 0.00 0.00 175.10 175.50 3m1a s TRP 8 N 2.10 3.45 -0.24 5.22 0.52 0.28 -0.40 118.94 129.86 3m1a s TRP 8 Ca 0.14 0.36 -0.02 0.00 0.02 0.00 0.00 56.10 56.59 3m1a s TRP 8 Cb -0.16 -2.07 0.02 0.00 -1.15 0.00 0.00 33.47 30.10 3m1a s TRP 8 CO 0.12 0.42 -0.05 -1.17 0.02 0.00 0.00 176.95 176.28 3m1a s LEU 9 N -0.10 3.09 -0.24 2.99 2.96 0.23 -0.44 118.68 127.18 3m1a s LEU 9 Ca 0.10 -0.72 0.01 0.00 -0.22 0.00 0.00 54.13 53.30 3m1a s LEU 9 Cb -0.11 -1.69 0.04 0.00 0.50 0.00 0.00 46.19 44.92 3m1a s LEU 9 CO 0.00 -0.10 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.13 3m1a s VAL 10 N 1.38 2.42 0.44 1.68 1.01 -0.17 -0.56 120.40 126.60 3m1a s VAL 10 Ca 0.02 -1.22 -0.22 0.00 0.00 0.00 0.00 61.98 60.56 3m1a s VAL 10 Cb -0.16 -2.24 -0.09 0.00 0.00 0.00 0.00 36.38 33.89 3m1a s VAL 10 CO -0.04 0.20 1.04 0.42 0.00 0.00 0.00 175.10 176.72 3m1a s THR 11 N 1.24 3.80 -1.35 3.92 -4.23 -0.86 -0.89 115.64 117.27 3m1a s THR 11 Ca -0.02 1.23 -0.06 0.00 -1.18 0.00 0.00 61.69 61.67 3m1a s THR 11 Cb -0.17 -3.56 0.02 0.00 1.34 0.00 0.00 72.50 70.13 3m1a s THR 11 CO -0.07 -0.13 0.99 0.61 -0.54 0.00 0.00 174.62 175.48 3m1a n GLY 12 N -0.01 -0.43 0.17 3.99 0.00 -0.86 -2.95 105.19 105.10 3m1a n GLY 12 Ca 0.07 0.18 0.14 0.00 0.00 0.00 0.00 46.02 46.41 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 -4.56 2.78 0.20 4.61 0.00 -0.54 -4.25 120.51 118.75 3m1a n ALA 13 Ca -0.13 -0.31 0.11 0.00 0.00 0.00 0.00 53.44 53.11 3m1a n ALA 13 Cb 0.61 -1.30 0.14 0.00 0.00 0.00 0.00 19.45 18.90 3m1a n ALA 13 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3m1a h SER 14 N 0.85 0.00 -5.41 0.00 4.64 -1.90 -2.97 113.55 108.77 3m1a h SER 14 Ca 0.00 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.15 3m1a h SER 14 Cb 0.37 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 62.32 3m1a h SER 14 CO 0.00 0.07 -0.51 -0.94 -0.87 0.00 0.00 176.83 174.58 3m1a s SER 15 N -6.19 0.16 0.22 4.97 1.04 -1.26 -4.83 113.70 107.81 3m1a s SER 15 Ca 0.06 -1.14 0.00 0.00 0.48 0.00 0.00 55.95 55.35 3m1a s SER 15 Cb 0.06 0.38 0.00 0.00 0.10 0.00 0.00 66.02 66.55 3m1a s SER 15 CO 0.69 -0.83 0.00 0.61 0.98 0.00 0.00 173.24 174.68 3m1a n GLY 16 N -0.19 1.49 0.26 7.32 0.00 0.14 -2.89 105.19 111.31 3m1a n GLY 16 Ca -0.04 -0.35 0.04 0.00 0.00 0.00 0.00 46.02 45.67 3m1a n GLY 16 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3m1a h PHE 17 N 0.00 0.23 -0.97 1.61 3.57 -1.91 -1.22 116.94 118.25 3m1a h PHE 17 Ca 0.00 0.04 0.05 0.00 3.53 0.00 0.00 57.97 61.59 3m1a h PHE 17 Cb 0.00 0.01 -0.06 0.00 2.79 0.00 0.00 35.95 38.69 3m1a h PHE 17 CO 0.00 -0.07 0.63 0.78 -2.23 0.00 0.00 178.31 177.42 3m1a h GLY 18 N 0.26 1.42 1.52 2.40 0.00 -1.76 -1.36 103.07 105.55 3m1a h GLY 18 Ca 0.38 -0.47 -0.11 0.00 0.00 0.00 0.00 47.33 47.12 3m1a h GLY 18 CO -0.48 0.39 -0.31 -0.09 0.00 0.00 0.00 176.54 176.04 3m1a h ARG 19 N 1.19 0.55 -0.40 4.80 9.65 -1.06 -0.68 114.38 128.42 3m1a h ARG 19 Ca 0.39 -0.24 -0.10 0.00 -1.10 0.00 0.00 59.98 58.93 3m1a h ARG 19 Cb 0.06 -0.02 -0.02 0.00 -1.39 0.00 0.00 29.97 28.61 3m1a h ARG 19 CO -0.13 0.80 -0.17 0.00 2.80 0.00 0.00 179.97 183.27 3m1a h ALA 20 N 1.19 0.95 -0.40 2.80 0.00 -1.04 0.11 119.26 122.88 3m1a h ALA 20 Ca 0.06 -0.34 -0.09 0.00 0.00 0.00 0.00 54.91 54.53 3m1a h ALA 20 Cb 0.78 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 3m1a h ALA 20 CO 0.06 0.61 -0.12 0.82 0.00 0.00 0.00 179.25 180.63 3m1a h ILE 21 N 0.67 1.28 -0.31 0.00 2.04 -0.87 -1.39 117.51 118.92 3m1a h ILE 21 Ca 0.10 -1.22 -0.01 0.00 1.00 0.00 0.00 64.86 64.73 3m1a h ILE 21 Cb 0.66 1.23 -0.01 0.00 -0.74 0.00 0.00 36.82 37.95 3m1a h ILE 21 CO 0.05 0.41 0.14 0.00 0.00 0.00 0.00 178.15 178.75 3m1a h ALA 22 N 0.84 0.40 -0.33 1.87 0.00 -0.93 -2.46 119.26 118.65 3m1a h ALA 22 Ca 0.10 -0.11 0.05 0.00 0.00 0.00 0.00 54.91 54.95 3m1a h ALA 22 Cb 0.65 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.27 3m1a h ALA 22 CO 0.04 -0.02 0.04 1.49 0.00 0.00 0.00 179.25 180.80 3m1a h GLU 23 N 0.36 0.14 -0.47 0.00 4.57 -0.66 -2.00 114.58 116.52 3m1a h GLU 23 Ca 0.11 -0.01 0.02 0.00 -1.18 0.00 0.00 59.36 58.30 3m1a h GLU 23 Cb 0.14 -0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 28.67 3m1a h GLU 23 CO -0.01 0.09 0.29 0.00 -1.18 0.00 0.00 179.01 178.20 3m1a h ALA 24 N 1.26 0.60 0.15 2.92 0.00 -1.16 0.68 119.26 123.72 3m1a h ALA 24 Ca 0.16 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3m1a h ALA 24 Cb 0.19 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 3m1a h ALA 24 CO -0.23 -0.02 -0.14 0.00 0.00 0.00 0.00 179.25 178.86 3m1a h ALA 25 N 1.21 -0.29 -0.25 0.00 0.00 -1.19 -1.87 119.26 116.87 3m1a h ALA 25 Ca 0.19 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.92 3m1a h ALA 25 Cb 0.01 0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 3m1a h ALA 25 CO -0.08 -0.68 -0.41 -0.39 0.00 0.00 0.00 179.25 177.69 3m1a h VAL 26 N -0.32 1.30 -0.41 0.00 -1.51 -1.17 -1.26 116.25 112.87 3m1a h VAL 26 Ca 0.00 -1.58 -0.00 0.00 -1.23 0.00 0.00 66.70 63.89 3m1a h VAL 26 Cb 0.30 1.55 -0.02 0.00 -2.13 0.00 0.00 31.29 30.99 3m1a h VAL 26 CO -0.03 0.50 0.25 0.00 -1.23 0.00 0.00 177.57 177.06 3m1a h ALA 27 N 1.06 1.67 -0.10 5.19 0.00 -0.80 -2.11 119.26 124.17 3m1a h ALA 27 Ca 0.04 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3m1a h ALA 27 Cb 0.92 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.54 3m1a h ALA 27 CO 0.08 0.29 0.00 0.00 0.00 0.00 0.00 179.25 179.63 3m1a n ALA 28 N -2.47 2.55 -0.26 0.00 0.00 -0.71 -4.91 120.51 114.71 3m1a n ALA 28 Ca 0.03 -0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.10 3m1a n ALA 28 Cb 0.07 -1.17 0.00 0.00 0.00 0.00 0.00 19.45 18.36 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 1.01 0.68 3.89 0.00 0.00 -0.79 -5.06 105.19 104.91 3m1a n GLY 29 Ca 0.15 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.77 5.37 0.02 1.61 -0.00 -0.52 -4.71 116.67 115.67 3m1a s ASP 30 Ca 0.00 1.06 -0.18 0.00 -0.00 0.00 0.00 52.55 53.43 3m1a s ASP 30 Cb 0.00 -1.85 -0.06 0.00 -0.00 0.00 0.00 42.92 41.01 3m1a s ASP 30 CO 0.00 -1.37 0.52 -0.89 -0.00 0.00 0.00 175.17 173.43 3m1a s THR 31 N -3.35 4.89 -0.08 -1.27 2.01 -0.09 -4.16 115.64 113.59 3m1a s THR 31 Ca 0.58 1.10 0.02 0.00 0.31 0.00 0.00 61.69 63.71 3m1a s THR 31 Cb -0.11 -3.85 0.01 0.00 0.01 0.00 0.00 72.50 68.56 3m1a s THR 31 CO 0.51 0.51 -0.15 -0.69 -0.69 0.00 0.00 174.62 174.11 3m1a s VAL 32 N -0.77 1.39 -0.32 3.82 1.01 0.45 -0.56 120.40 125.43 3m1a s VAL 32 Ca 0.28 -0.62 -0.09 0.00 0.00 0.00 0.00 61.98 61.54 3m1a s VAL 32 Cb -0.18 -1.25 0.01 0.00 0.00 0.00 0.00 36.38 34.95 3m1a s VAL 32 CO 0.16 0.41 0.15 -0.63 0.00 0.00 0.00 175.10 175.20 3m1a s ILE 33 N 0.67 4.46 -0.05 2.22 1.09 0.42 -1.30 121.20 128.71 3m1a s ILE 33 Ca -0.14 -0.59 -0.03 0.00 -1.10 0.00 0.00 60.65 58.79 3m1a s ILE 33 Cb -0.16 -3.34 -0.04 0.00 -1.06 0.00 0.00 42.46 37.86 3m1a s ILE 33 CO 0.04 -0.01 0.11 -0.83 -0.10 0.00 0.00 174.94 174.15 3m1a s GLY 34 N 1.57 2.08 0.13 6.18 0.00 -0.25 -1.00 107.32 116.04 3m1a s GLY 34 Ca 0.03 -0.76 0.08 0.00 0.00 0.00 0.00 44.72 44.07 3m1a s GLY 34 CO 0.06 -0.59 -0.12 -0.51 0.00 0.00 0.00 173.10 171.94 3m1a s THR 35 N -1.14 3.18 0.19 0.90 -4.23 -0.07 -1.51 115.64 112.97 3m1a s THR 35 Ca 0.20 -1.43 -0.17 0.00 -1.18 0.00 0.00 61.69 59.11 3m1a s THR 35 Cb -0.12 -2.50 0.03 0.00 1.34 0.00 0.00 72.50 71.24 3m1a s THR 35 CO 0.11 0.05 0.52 0.00 -0.54 0.00 0.00 174.62 174.76 3m1a s ALA 36 N -1.32 -0.94 0.32 3.99 0.00 -0.99 -1.46 121.76 121.37 3m1a s ALA 36 Ca 0.21 -0.21 0.02 0.00 0.00 0.00 0.00 51.96 51.98 3m1a s ALA 36 Cb -0.10 0.85 0.55 0.00 0.00 0.00 0.00 23.12 24.42 3m1a s ALA 36 CO 0.13 -0.80 1.91 0.00 0.00 0.00 0.00 175.76 177.00 3m1a h ARG 37 N 2.20 0.74 -5.28 0.00 3.08 -1.88 0.17 114.38 113.41 3m1a h ARG 37 Ca -0.29 -0.11 -0.67 0.00 0.07 0.00 0.00 59.98 58.98 3m1a h ARG 37 Cb 1.26 -0.13 -0.32 0.00 0.08 0.00 0.00 29.97 30.86 3m1a h ARG 37 CO 0.38 0.62 -0.85 1.03 -1.07 0.00 0.00 179.97 180.07 3m1a s ARG 38 N -5.34 3.11 0.39 0.04 0.52 -1.26 -4.37 118.95 112.04 3m1a s ARG 38 Ca -0.09 -0.83 0.12 0.00 -0.52 0.00 0.00 55.73 54.41 3m1a s ARG 38 Cb 0.16 -2.42 0.93 0.00 0.52 0.00 0.00 34.95 34.14 3m1a s ARG 38 CO 0.78 0.12 1.88 1.79 0.02 0.00 0.00 175.30 179.88 3m1a h THR 39 N 5.69 0.80 0.00 0.02 1.35 -1.85 -1.85 112.91 117.06 3m1a h THR 39 Ca -0.25 -0.19 -0.00 0.00 -0.55 0.00 0.00 66.41 65.42 3m1a h THR 39 Cb 1.22 0.19 -0.00 0.00 -1.73 0.00 0.00 68.15 67.83 3m1a h THR 39 CO 0.52 0.10 -0.00 -0.33 -0.25 0.00 0.00 175.52 175.55 3m1a h GLU 40 N 0.56 0.00 -0.08 4.72 3.07 -1.95 -1.15 114.58 119.74 3m1a h GLU 40 Ca 0.43 0.00 0.02 0.00 -0.50 0.00 0.00 59.36 59.31 3m1a h GLU 40 Cb 0.83 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.74 3m1a h GLU 40 CO -0.17 0.00 0.09 0.00 -1.40 0.00 0.00 179.01 177.53 3m1a h ALA 41 N 2.00 1.66 -0.72 3.43 0.00 -1.75 -2.49 119.26 121.38 3m1a h ALA 41 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3m1a h ALA 41 Cb 0.01 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3m1a h ALA 41 CO 0.00 -0.14 0.00 1.28 0.00 0.00 0.00 179.25 180.39 3m1a n LEU 42 N -3.83 4.00 -0.32 0.00 4.77 -0.43 -4.62 117.00 116.56 3m1a n LEU 42 Ca -0.01 -2.00 0.12 0.00 -0.03 0.00 0.00 56.01 54.09 3m1a n LEU 42 Cb 0.19 -0.50 0.34 0.00 -2.33 0.00 0.00 43.42 41.13 3m1a n LEU 42 CO 0.27 0.96 1.21 0.44 -1.33 0.00 0.00 177.39 178.95 3m1a h ASP 43 N 4.26 0.74 -0.01 -1.43 3.32 -1.56 -1.82 116.42 119.91 3m1a h ASP 43 Ca 0.00 0.07 -0.12 0.00 0.02 0.00 0.00 57.03 56.99 3m1a h ASP 43 Cb 1.03 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 40.49 3m1a h ASP 43 CO 0.03 0.32 -0.38 -2.24 -1.72 0.00 0.00 179.24 175.25 3m1a h ASP 44 N 0.76 0.53 -0.18 6.45 3.04 -1.85 0.65 116.42 125.81 3m1a h ASP 44 Ca 0.52 -0.23 -0.11 0.00 -3.24 0.00 0.00 57.03 53.98 3m1a h ASP 44 Cb 0.81 -0.15 -0.00 0.00 -1.04 0.00 0.00 39.33 38.95 3m1a h ASP 44 CO -0.29 0.86 -0.30 0.25 -2.04 0.00 0.00 179.24 177.73 3m1a h LEU 45 N 0.42 0.58 -0.44 0.15 5.85 -1.70 -1.95 115.31 118.23 3m1a h LEU 45 Ca 0.04 -0.53 -0.06 0.00 0.84 0.00 0.00 57.88 58.17 3m1a h LEU 45 Cb 0.86 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.70 3m1a h LEU 45 CO 0.07 1.00 0.06 0.58 -0.34 0.00 0.00 178.44 179.81 3m1a h VAL 46 N 0.18 1.25 -0.38 1.05 2.07 -1.30 -1.41 116.25 117.71 3m1a h VAL 46 Ca 0.01 -0.93 0.07 0.00 0.82 0.00 0.00 66.70 66.67 3m1a h VAL 46 Cb 0.89 1.00 -0.06 0.00 -1.52 0.00 0.00 31.29 31.59 3m1a h VAL 46 CO 0.07 0.32 0.02 0.00 0.02 0.00 0.00 177.57 178.01 3m1a h ALA 47 N 0.93 0.37 0.00 1.67 0.00 -0.88 -1.45 119.26 119.90 3m1a h ALA 47 Ca 0.13 0.10 -0.05 0.00 0.00 0.00 0.00 54.91 55.09 3m1a h ALA 47 Cb 0.41 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 3m1a h ALA 47 CO 0.01 -0.37 -0.25 0.00 0.00 0.00 0.00 179.25 178.64 3m1a h ALA 48 N 1.32 1.19 -1.92 0.00 0.00 -1.17 -3.36 119.26 115.33 3m1a h ALA 48 Ca 0.19 -0.23 -0.51 0.00 0.00 0.00 0.00 54.91 54.36 3m1a h ALA 48 Cb 0.25 -0.04 -0.38 0.00 0.00 0.00 0.00 17.79 17.62 3m1a h ALA 48 CO -0.29 0.31 -1.12 0.66 0.00 0.00 0.00 179.25 178.81 3m1a n TYR 49 N -3.66 -0.24 0.14 0.00 4.01 -0.55 -4.98 117.16 111.88 3m1a n TYR 49 Ca -0.01 -3.61 0.09 0.00 -0.16 0.00 0.00 57.90 54.21 3m1a n TYR 49 Cb 0.37 -0.30 0.58 0.00 -0.31 0.00 0.00 39.34 39.68 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 3.54 0.16 0.00 -0.72 0.11 -1.43 -1.71 132.00 131.96 3m1a h PRO 50 Ca 0.07 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.18 3m1a h PRO 50 Cb 0.93 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.00 3m1a h PRO 50 CO 0.47 0.11 -0.90 -0.25 -0.21 0.00 0.00 178.00 177.22 3m1a n ASP 51 N -4.50 0.64 0.00 -2.05 10.43 -1.26 -4.44 116.55 115.37 3m1a n ASP 51 Ca 0.01 -0.09 0.00 0.00 2.57 0.00 0.00 54.79 57.28 3m1a n ASP 51 Cb 0.16 0.58 0.00 0.00 1.84 0.00 0.00 41.12 43.70 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 -2.02 6.02 -5.17 -1.24 1.74 -1.03 -5.04 116.66 109.91 3m1a n ARG 52 Ca 0.02 0.00 -0.32 0.00 -0.77 0.00 0.00 57.85 56.79 3m1a n ARG 52 Cb 0.44 -0.48 -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 -0.96 2.31 0.02 7.54 0.00 -0.67 -0.41 121.76 129.59 3m1a s ALA 53 Ca 0.00 -1.06 0.04 0.00 0.00 0.00 0.00 51.96 50.94 3m1a s ALA 53 Cb 0.00 -0.70 -0.02 0.00 0.00 0.00 0.00 23.12 22.40 3m1a s ALA 53 CO 0.00 0.51 -0.13 -2.00 0.00 0.00 0.00 175.76 174.14 3m1a s GLU 54 N -0.55 0.94 -0.19 0.00 2.12 -0.42 -4.78 118.70 115.83 3m1a s GLU 54 Ca 0.08 -0.60 -0.07 0.00 0.36 0.00 0.00 54.97 54.74 3m1a s GLU 54 Cb -0.11 -0.92 -0.04 0.00 0.26 0.00 0.00 34.13 33.32 3m1a s GLU 54 CO 0.00 0.24 0.06 0.00 -0.54 0.00 0.00 175.26 175.02 3m1a s ALA 55 N -0.59 3.38 -0.05 6.30 0.00 -1.26 -1.09 121.76 128.46 3m1a s ALA 55 Ca 0.03 -0.77 0.04 0.00 0.00 0.00 0.00 51.96 51.25 3m1a s ALA 55 Cb -0.06 -1.93 0.00 0.00 0.00 0.00 0.00 23.12 21.13 3m1a s ALA 55 CO 0.00 0.13 -0.15 0.42 0.00 0.00 0.00 175.76 176.16 3m1a s ILE 56 N 0.46 1.29 -0.06 0.00 1.01 -0.57 -4.93 121.20 118.40 3m1a s ILE 56 Ca 0.03 -0.63 -0.30 0.00 0.00 0.00 0.00 60.65 59.76 3m1a s ILE 56 Cb -0.13 -1.12 -0.04 0.00 0.01 0.00 0.00 42.46 41.17 3m1a s ILE 56 CO 0.01 0.38 1.46 -0.55 0.00 0.00 0.00 174.94 176.24 3m1a s SER 57 N 0.18 6.81 -0.14 3.58 0.15 -1.26 -2.34 113.70 120.67 3m1a s SER 57 Ca -0.06 2.05 -0.06 0.00 0.70 0.00 0.00 55.95 58.58 3m1a s SER 57 Cb -0.12 -2.54 0.06 0.00 -1.71 0.00 0.00 66.02 61.71 3m1a s SER 57 CO 0.02 -0.81 0.31 -0.22 1.20 0.00 0.00 173.24 173.75 3m1a s LEU 58 N 3.28 -0.17 -0.41 3.45 2.96 0.60 -4.90 118.68 123.48 3m1a s LEU 58 Ca 0.65 0.70 -0.14 0.00 -0.22 0.00 0.00 54.13 55.12 3m1a s LEU 58 Cb -0.30 0.93 0.03 0.00 0.50 0.00 0.00 46.19 47.36 3m1a s LEU 58 CO 0.24 -0.21 0.30 -0.62 -1.32 0.00 0.00 176.35 174.74 3m1a s ASP 59 N 2.04 6.03 0.12 3.68 -1.08 -1.26 -3.54 116.67 122.66 3m1a s ASP 59 Ca -0.03 -1.01 0.17 0.00 -0.52 0.00 0.00 52.55 51.15 3m1a s ASP 59 Cb -0.11 -2.13 0.72 0.00 -1.46 0.00 0.00 42.92 39.94 3m1a s ASP 59 CO -0.10 -0.47 1.51 0.52 0.52 0.00 0.00 175.17 177.15 3m1a n VAL 60 N 5.13 1.06 1.79 1.11 0.31 -1.26 -0.38 118.33 126.09 3m1a n VAL 60 Ca -0.11 0.32 0.16 0.00 -0.01 0.00 0.00 64.34 64.69 3m1a n VAL 60 Cb 0.46 -1.18 0.87 0.00 -0.91 0.00 0.00 33.84 33.08 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 -1.83 0.00 -3.67 2.52 -2.24 -1.26 -4.13 114.28 103.67 3m1a n THR 61 Ca 0.02 -0.00 -0.38 0.00 -2.27 0.00 0.00 64.05 61.41 3m1a n THR 61 Cb 0.16 -0.48 -0.10 0.00 -2.10 0.00 0.00 70.33 67.81 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 -2.20 5.48 0.17 3.42 -1.08 0.49 -4.97 116.67 117.96 3m1a s ASP 62 Ca 0.41 -2.08 -0.12 0.00 -0.52 0.00 0.00 52.55 50.23 3m1a s ASP 62 Cb 0.21 -1.92 0.06 0.00 -1.46 0.00 0.00 42.92 39.82 3m1a s ASP 62 CO 0.40 -0.59 1.69 1.23 0.52 0.00 0.00 175.17 178.42 3m1a h GLY 63 N 8.11 0.95 1.15 2.66 0.00 -1.83 -1.62 103.07 112.49 3m1a h GLY 63 Ca -0.15 -0.57 0.01 0.00 0.00 0.00 0.00 47.33 46.62 3m1a h GLY 63 CO 0.77 0.53 0.56 0.83 0.00 0.00 0.00 176.54 179.23 3m1a h GLU 64 N 0.80 1.14 -0.20 4.80 3.07 -1.96 -2.37 114.58 119.86 3m1a h GLU 64 Ca 0.18 -0.08 -0.10 0.00 -0.50 0.00 0.00 59.36 58.87 3m1a h GLU 64 Cb 0.29 -0.25 -0.01 0.00 -0.84 0.00 0.00 28.75 27.93 3m1a h GLU 64 CO -0.01 0.76 -0.31 -0.09 -1.40 0.00 0.00 179.01 177.97 3m1a h ARG 65 N 1.17 0.40 0.12 2.33 9.65 -1.76 -2.48 114.38 123.80 3m1a h ARG 65 Ca 0.31 -0.16 0.00 0.00 -1.10 0.00 0.00 59.98 59.03 3m1a h ARG 65 Cb -0.12 -0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 28.43 3m1a h ARG 65 CO -0.07 0.67 -0.11 0.82 2.80 0.00 0.00 179.97 184.08 3m1a h ILE 66 N 0.35 0.74 -0.64 1.20 2.04 -0.82 -0.65 117.51 119.73 3m1a h ILE 66 Ca 0.05 0.00 0.09 0.00 1.00 0.00 0.00 64.86 66.00 3m1a h ILE 66 Cb 0.72 0.74 -0.07 0.00 -0.74 0.00 0.00 36.82 37.47 3m1a h ILE 66 CO 0.06 0.00 0.27 0.44 0.00 0.00 0.00 178.15 178.91 3m1a h ASP 67 N -0.25 0.30 -0.05 1.72 3.32 -1.34 -1.22 116.42 118.90 3m1a h ASP 67 Ca 0.00 0.07 -0.00 0.00 0.02 0.00 0.00 57.03 57.12 3m1a h ASP 67 Cb 0.24 0.03 -0.00 0.00 0.22 0.00 0.00 39.33 39.82 3m1a h ASP 67 CO -0.03 0.18 0.02 0.58 -1.72 0.00 0.00 179.24 178.27 3m1a h VAL 68 N 0.47 1.10 -0.26 -1.35 2.07 -1.22 -1.40 116.25 115.67 3m1a h VAL 68 Ca 0.32 -0.29 -0.03 0.00 0.82 0.00 0.00 66.70 67.51 3m1a h VAL 68 Cb 0.37 1.21 -0.01 0.00 -1.52 0.00 0.00 31.29 31.34 3m1a h VAL 68 CO -0.29 0.08 0.03 0.58 0.02 0.00 0.00 177.57 177.99 3m1a h VAL 69 N -0.04 1.24 -0.29 2.57 2.07 -0.87 -0.16 116.25 120.78 3m1a h VAL 69 Ca 0.02 -0.81 0.04 0.00 0.82 0.00 0.00 66.70 66.77 3m1a h VAL 69 Cb 0.11 1.27 -0.03 0.00 -1.52 0.00 0.00 31.29 31.12 3m1a h VAL 69 CO -0.00 0.26 0.08 0.00 0.02 0.00 0.00 177.57 177.92 3m1a h ALA 70 N 0.85 0.31 -0.76 1.67 0.00 -1.26 -0.39 119.26 119.69 3m1a h ALA 70 Ca 0.08 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 3m1a h ALA 70 Cb 0.35 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.14 3m1a h ALA 70 CO 0.01 -0.33 0.47 0.00 0.00 0.00 0.00 179.25 179.40 3m1a h ALA 71 N 1.20 0.96 -0.33 0.00 0.00 -1.07 -1.88 119.26 118.14 3m1a h ALA 71 Ca 0.13 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 3m1a h ALA 71 Cb 0.12 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 3m1a h ALA 71 CO -0.15 0.41 0.03 0.22 0.00 0.00 0.00 179.25 179.76 3m1a h ASP 72 N 1.03 0.54 -0.52 0.00 3.58 -0.74 0.22 116.42 120.54 3m1a h ASP 72 Ca 0.27 -0.28 0.03 0.00 0.42 0.00 0.00 57.03 57.46 3m1a h ASP 72 Cb -0.06 -0.15 -0.03 0.00 1.72 0.00 0.00 39.33 40.81 3m1a h ASP 72 CO -0.05 0.69 0.31 0.58 -2.88 0.00 0.00 179.24 177.88 3m1a h VAL 73 N 0.38 1.05 -0.60 2.25 2.07 -1.01 -1.86 116.25 118.52 3m1a h VAL 73 Ca 0.10 -0.21 -0.02 0.00 0.82 0.00 0.00 66.70 67.39 3m1a h VAL 73 Cb 0.40 0.39 -0.03 0.00 -1.52 0.00 0.00 31.29 30.53 3m1a h VAL 73 CO 0.01 0.11 0.30 -0.07 0.02 0.00 0.00 177.57 177.94 3m1a h LEU 74 N 0.61 0.77 -1.66 2.57 3.38 -0.89 0.13 115.31 120.22 3m1a h LEU 74 Ca 0.21 -0.12 0.03 0.00 0.09 0.00 0.00 57.88 58.08 3m1a h LEU 74 Cb 0.03 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 3m1a h LEU 74 CO -0.10 0.67 0.27 0.00 0.09 0.00 0.00 178.44 179.37 3m1a h ALA 75 N 1.13 1.82 0.00 1.53 0.00 -0.14 0.21 119.26 123.82 3m1a h ALA 75 Ca 0.21 -0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.92 3m1a h ALA 75 Cb 0.10 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 3m1a h ALA 75 CO -0.03 0.14 -1.92 0.54 0.00 0.00 0.00 179.25 177.98 3m1a n ARG 76 N -4.48 1.16 -0.01 0.00 1.74 -0.74 -4.50 116.66 109.83 3m1a n ARG 76 Ca 0.04 -0.06 0.08 0.00 -0.77 0.00 0.00 57.85 57.14 3m1a n ARG 76 Cb 0.13 -1.38 -0.12 0.00 -1.02 0.00 0.00 32.46 30.07 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 -2.37 0.00 0.00 -1.55 4.01 0.43 -5.00 117.16 112.68 3m1a n TYR 77 Ca -0.16 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.58 3m1a n TYR 77 Cb 0.78 -0.32 0.00 0.00 -0.31 0.00 0.00 39.34 39.48 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 1.59 2.50 3.57 2.72 0.00 0.75 -4.93 105.19 111.39 3m1a n GLY 78 Ca -0.02 0.00 -0.05 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 -0.30 0.49 -0.14 1.61 1.70 -1.26 -4.96 118.95 116.09 3m1a s ARG 79 Ca 0.00 -0.19 0.00 0.00 -0.47 0.00 0.00 55.73 55.07 3m1a s ARG 79 Cb 0.00 0.22 0.02 0.00 -0.57 0.00 0.00 34.95 34.62 3m1a s ARG 79 CO 0.00 -0.21 -0.12 0.08 -1.08 0.00 0.00 175.30 173.96 3m1a s VAL 80 N -2.65 1.41 -0.06 4.99 1.01 -1.26 -4.81 120.40 119.03 3m1a s VAL 80 Ca 0.08 -0.54 -0.11 0.00 0.00 0.00 0.00 61.98 61.42 3m1a s VAL 80 Cb -0.01 -1.35 -0.30 0.00 0.00 0.00 0.00 36.38 34.72 3m1a s VAL 80 CO -0.06 0.43 0.62 0.44 0.00 0.00 0.00 175.10 176.54 3m1a h ASP 81 N 8.04 0.60 -3.19 3.32 3.32 -1.10 -3.46 116.42 123.94 3m1a h ASP 81 Ca -0.35 -0.94 -0.51 0.00 0.02 0.00 0.00 57.03 55.24 3m1a h ASP 81 Cb 1.14 -0.19 -0.37 0.00 0.22 0.00 0.00 39.33 40.12 3m1a h ASP 81 CO 0.49 1.81 -0.80 -0.69 -1.72 0.00 0.00 179.24 178.33 3m1a s VAL 82 N -2.58 0.93 -0.22 -1.35 1.01 -0.52 -0.75 120.40 116.93 3m1a s VAL 82 Ca -0.17 -0.23 -0.09 0.00 0.00 0.00 0.00 61.98 61.48 3m1a s VAL 82 Cb 0.06 -0.97 -0.05 0.00 0.00 0.00 0.00 36.38 35.41 3m1a s VAL 82 CO 0.84 0.35 0.12 -0.22 0.00 0.00 0.00 175.10 176.20 3m1a s LEU 83 N 1.75 3.97 -0.33 3.92 2.96 -0.12 -0.60 118.68 130.23 3m1a s LEU 83 Ca 0.05 0.07 -0.03 0.00 -0.22 0.00 0.00 54.13 54.00 3m1a s LEU 83 Cb -0.13 -2.05 0.06 0.00 0.50 0.00 0.00 46.19 44.57 3m1a s LEU 83 CO -0.08 0.09 0.06 -0.69 -1.32 0.00 0.00 176.35 174.41 3m1a s VAL 84 N 0.91 3.22 -0.86 1.68 1.01 0.28 0.24 120.40 126.89 3m1a s VAL 84 Ca 0.06 -1.46 -0.25 0.00 0.00 0.00 0.00 61.98 60.33 3m1a s VAL 84 Cb -0.13 -2.92 0.05 0.00 0.00 0.00 0.00 36.38 33.38 3m1a s VAL 84 CO 0.03 -0.24 1.31 0.20 0.00 0.00 0.00 175.10 176.41 3m1a s ASN 85 N 1.40 6.32 -0.03 3.32 -0.87 -0.35 -2.04 114.94 122.70 3m1a s ASN 85 Ca -0.02 -0.98 0.05 0.00 -1.57 0.00 0.00 52.86 50.34 3m1a s ASN 85 Cb -0.20 -2.54 -0.08 0.00 -0.02 0.00 0.00 41.25 38.41 3m1a s ASN 85 CO -0.01 -1.63 0.08 -3.20 -2.57 0.00 0.00 177.10 169.77 3m1a n ASN 86 N 8.90 3.70 -4.70 -1.22 5.15 -1.25 -1.60 115.26 124.24 3m1a n ASN 86 Ca 0.16 0.00 -0.41 0.00 -0.60 0.00 0.00 54.58 53.72 3m1a n ASN 86 Cb 0.50 0.99 0.01 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 -1.91 1.33 0.00 5.20 0.00 -1.15 -4.81 120.51 119.16 3m1a n ALA 87 Ca -0.04 0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.69 3m1a n ALA 87 Cb 0.37 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.56 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 0.79 -1.11 3.29 0.00 0.00 -1.26 -4.67 105.19 102.23 3m1a n GLY 88 Ca 0.06 -1.01 -0.10 0.00 0.00 0.00 0.00 46.02 44.97 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 -1.18 1.02 0.25 1.61 1.70 -1.26 -4.59 118.95 116.50 3m1a s ARG 89 Ca 0.00 -0.79 -0.16 0.00 -0.47 0.00 0.00 55.73 54.31 3m1a s ARG 89 Cb 0.00 0.44 -0.08 0.00 -0.57 0.00 0.00 34.95 34.73 3m1a s ARG 89 CO 0.00 -0.38 0.69 0.95 -1.08 0.00 0.00 175.30 175.47 3m1a s THR 90 N -3.82 4.69 -0.09 4.99 -4.23 -0.58 -5.00 115.64 111.58 3m1a s THR 90 Ca 0.04 1.02 -0.04 0.00 -1.18 0.00 0.00 61.69 61.52 3m1a s THR 90 Cb 0.03 -3.73 0.04 0.00 1.34 0.00 0.00 72.50 70.18 3m1a s THR 90 CO -0.11 0.05 0.22 -1.58 -0.54 0.00 0.00 174.62 172.65 3m1a s GLN 91 N -2.41 0.17 -0.05 3.99 0.74 -1.26 -1.41 119.66 119.42 3m1a s GLN 91 Ca 0.47 0.49 0.02 0.00 0.05 0.00 0.00 55.36 56.39 3m1a s GLN 91 Cb -0.14 -0.14 0.01 0.00 1.10 0.00 0.00 33.01 33.85 3m1a s GLN 91 CO 0.19 -0.17 -0.10 0.08 -0.55 0.00 0.00 175.29 174.74 3m1a s VAL 92 N 1.31 0.95 0.00 1.34 1.01 -0.47 -4.52 120.40 120.03 3m1a s VAL 92 Ca -0.09 -0.38 0.00 0.00 0.00 0.00 0.00 61.98 61.51 3m1a s VAL 92 Cb -0.11 -0.88 0.00 0.00 0.00 0.00 0.00 36.38 35.39 3m1a s VAL 92 CO -0.08 0.31 0.00 0.61 0.00 0.00 0.00 175.10 175.94 3m1a n GLY 93 N 3.78 1.81 3.73 4.51 0.00 -0.33 -0.28 105.19 118.41 3m1a n GLY 93 Ca -0.23 -0.41 -0.38 0.00 0.00 0.00 0.00 46.02 45.00 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 -0.34 1.37 -0.22 4.61 0.00 -1.26 -4.20 120.51 120.47 3m1a n ALA 94 Ca 0.00 0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.55 3m1a n ALA 94 Cb 0.00 -2.32 0.12 0.00 0.00 0.00 0.00 19.45 17.24 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 1.25 0.51 -0.27 0.00 3.04 -1.95 -1.74 116.94 117.77 3m1a h PHE 95 Ca -0.50 0.03 -0.05 0.00 3.98 0.00 0.00 57.97 61.42 3m1a h PHE 95 Cb 1.31 -0.13 -0.02 0.00 2.56 0.00 0.00 35.95 39.68 3m1a h PHE 95 CO 0.44 0.17 -0.05 1.49 -2.02 0.00 0.00 178.31 178.34 3m1a h GLU 96 N 0.50 0.43 0.00 1.11 4.81 -2.03 -2.91 114.58 116.49 3m1a h GLU 96 Ca 0.32 -0.09 0.00 0.00 -0.13 0.00 0.00 59.36 59.45 3m1a h GLU 96 Cb 0.35 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.67 3m1a h GLU 96 CO -0.27 0.50 -0.29 0.93 -0.73 0.00 0.00 179.01 179.14 3m1a h GLU 97 N 0.41 0.00 -6.27 1.92 4.39 -1.71 -3.46 114.58 109.87 3m1a h GLU 97 Ca 0.09 0.00 -0.55 0.00 0.34 0.00 0.00 59.36 59.23 3m1a h GLU 97 Cb 0.35 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.98 3m1a h GLU 97 CO 0.01 0.00 0.88 0.99 -1.16 0.00 0.00 179.01 179.73 3m1a s THR 98 N -3.14 3.98 0.52 1.13 2.01 -0.78 -4.97 115.64 114.39 3m1a s THR 98 Ca 0.08 1.27 -0.15 0.00 0.31 0.00 0.00 61.69 63.21 3m1a s THR 98 Cb 0.12 -3.82 -0.07 0.00 0.01 0.00 0.00 72.50 68.75 3m1a s THR 98 CO 0.66 -0.06 0.96 0.42 -0.69 0.00 0.00 174.62 175.91 3m1a s THR 99 N 3.03 4.60 0.29 -0.82 -4.23 -1.26 -4.91 115.64 112.34 3m1a s THR 99 Ca 0.61 1.06 -0.02 0.00 -1.18 0.00 0.00 61.69 62.16 3m1a s THR 99 Cb -0.27 -3.75 0.27 0.00 1.34 0.00 0.00 72.50 70.09 3m1a s THR 99 CO 0.22 -0.75 1.94 -0.08 -0.54 0.00 0.00 174.62 175.42 3m1a h GLU 100 N 0.75 1.09 -0.13 3.99 4.81 -1.99 -1.16 114.58 121.93 3m1a h GLU 100 Ca -0.46 -0.07 0.02 0.00 -0.13 0.00 0.00 59.36 58.72 3m1a h GLU 100 Cb 1.19 -0.25 -0.02 0.00 0.63 0.00 0.00 28.75 30.30 3m1a h GLU 100 CO 0.62 0.72 0.01 -0.09 -0.73 0.00 0.00 179.01 179.54 3m1a h ARG 101 N 1.12 0.06 -0.75 1.92 9.65 -1.99 0.18 114.38 124.58 3m1a h ARG 101 Ca 0.35 -0.00 -0.01 0.00 -1.10 0.00 0.00 59.98 59.22 3m1a h ARG 101 Cb -0.00 -0.01 -0.04 0.00 -1.39 0.00 0.00 29.97 28.53 3m1a h ARG 101 CO -0.10 0.04 0.44 0.93 2.80 0.00 0.00 179.97 184.09 3m1a h GLU 102 N 0.06 1.02 -0.14 0.20 5.08 -1.80 -1.26 114.58 117.74 3m1a h GLU 102 Ca 0.06 -0.09 -0.04 0.00 -1.00 0.00 0.00 59.36 58.29 3m1a h GLU 102 Cb 0.06 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 29.09 3m1a h GLU 102 CO -0.09 0.72 -0.05 1.25 -1.00 0.00 0.00 179.01 179.84 3m1a h LEU 103 N 1.04 0.30 -0.75 1.33 5.85 -0.75 -2.69 115.31 119.63 3m1a h LEU 103 Ca 0.27 -0.39 -0.02 0.00 0.84 0.00 0.00 57.88 58.58 3m1a h LEU 103 Cb -0.03 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 40.88 3m1a h LEU 103 CO -0.05 0.62 0.40 0.03 -0.34 0.00 0.00 178.44 179.10 3m1a h ARG 104 N -0.03 1.06 -0.73 1.25 3.08 -0.41 -2.05 114.38 116.54 3m1a h ARG 104 Ca 0.03 -0.13 -0.02 0.00 0.07 0.00 0.00 59.98 59.93 3m1a h ARG 104 Cb 0.50 -0.20 -0.03 0.00 0.08 0.00 0.00 29.97 30.32 3m1a h ARG 104 CO 0.02 0.80 0.37 -0.44 -1.07 0.00 0.00 179.97 179.65 3m1a h ASP 105 N 1.04 0.94 -0.36 7.04 3.32 -1.26 -0.81 116.42 126.34 3m1a h ASP 105 Ca 0.26 -0.12 -0.07 0.00 0.02 0.00 0.00 57.03 57.13 3m1a h ASP 105 Cb 0.06 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.36 3m1a h ASP 105 CO -0.04 0.79 -0.04 0.25 -1.72 0.00 0.00 179.24 178.48 3m1a h LEU 106 N 1.02 0.65 -1.29 1.55 5.85 -1.26 -2.26 115.31 119.57 3m1a h LEU 106 Ca 0.25 -0.34 0.08 0.00 0.84 0.00 0.00 57.88 58.71 3m1a h LEU 106 Cb 0.09 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 40.89 3m1a h LEU 106 CO -0.04 0.84 0.53 -0.26 -0.34 0.00 0.00 178.44 179.17 3m1a h PHE 107 N 0.46 0.86 -0.16 1.25 0.04 -1.18 -1.17 116.94 117.04 3m1a h PHE 107 Ca 0.10 0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.88 3m1a h PHE 107 Cb 0.53 -0.28 -0.01 0.00 2.20 0.00 0.00 35.95 38.39 3m1a h PHE 107 CO 0.04 0.43 0.08 0.93 -0.60 0.00 0.00 178.31 179.19 3m1a h GLU 108 N 0.83 0.23 -0.34 1.51 4.39 -0.79 0.68 114.58 121.08 3m1a h GLU 108 Ca 0.36 -0.03 -0.11 0.00 0.34 0.00 0.00 59.36 59.92 3m1a h GLU 108 Cb 0.33 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.93 3m1a h GLU 108 CO -0.14 0.26 -0.21 -0.07 -1.16 0.00 0.00 179.01 177.70 3m1a h LEU 109 N 0.14 0.77 0.00 1.33 3.38 -1.19 -0.89 115.31 118.86 3m1a h LEU 109 Ca 0.06 -0.42 0.00 0.00 0.09 0.00 0.00 57.88 57.60 3m1a h LEU 109 Cb 0.11 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.64 3m1a h LEU 109 CO -0.01 1.03 -1.69 1.41 0.09 0.00 0.00 178.44 179.28 3m1a n HIS 110 N -4.29 0.00 0.03 1.13 8.25 -0.46 -4.44 115.22 115.44 3m1a n HIS 110 Ca -0.03 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.43 3m1a n HIS 110 Cb 0.43 -0.35 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 -2.02 0.35 -0.20 1.59 0.31 0.10 -4.69 118.33 113.77 3m1a n VAL 111 Ca -0.02 0.11 -0.08 0.00 -0.01 0.00 0.00 64.34 64.34 3m1a n VAL 111 Cb 0.48 -0.95 0.02 0.00 -0.91 0.00 0.00 33.84 32.48 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 0.95 0.35 3.52 0.04 -1.26 -0.53 116.94 120.01 3m1a h PHE 112 Ca 0.00 -0.11 -0.02 0.00 2.80 0.00 0.00 57.97 60.64 3m1a h PHE 112 Cb 0.00 -0.27 0.00 0.00 2.20 0.00 0.00 35.95 37.88 3m1a h PHE 112 CO 0.00 0.81 -0.17 0.78 -0.60 0.00 0.00 178.31 179.14 3m1a h GLY 113 N 0.81 -0.49 0.34 -1.45 0.00 -1.31 -1.55 103.07 99.43 3m1a h GLY 113 Ca 0.18 0.18 0.16 0.00 0.00 0.00 0.00 47.33 47.85 3m1a h GLY 113 CO 0.00 -0.18 0.61 -2.55 0.00 0.00 0.00 176.54 174.42 3m1a h PRO 114 N -0.55 0.75 -0.30 4.80 0.11 -1.75 -1.08 132.00 133.98 3m1a h PRO 114 Ca -0.05 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 65.97 3m1a h PRO 114 Cb 0.41 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.34 3m1a h PRO 114 CO 0.08 0.49 0.00 0.00 -0.21 0.00 0.00 178.00 178.36 3m1a h ALA 115 N 1.60 0.40 -0.57 -0.75 0.00 -0.84 -1.25 119.26 117.85 3m1a h ALA 115 Ca 0.51 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 55.15 3m1a h ALA 115 Cb 0.78 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 3m1a h ALA 115 CO -0.28 0.15 0.17 -0.09 0.00 0.00 0.00 179.25 179.20 3m1a h ARG 116 N 0.32 0.89 -0.27 0.00 2.43 -0.94 -1.58 114.38 115.23 3m1a h ARG 116 Ca 0.08 -0.19 -0.05 0.00 -0.81 0.00 0.00 59.98 59.01 3m1a h ARG 116 Cb 0.43 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.84 3m1a h ARG 116 CO 0.01 0.81 -0.05 1.25 -1.51 0.00 0.00 179.97 180.48 3m1a h LEU 117 N 0.80 0.50 -0.54 3.80 6.46 -1.15 -1.63 115.31 123.55 3m1a h LEU 117 Ca 0.18 -0.35 0.06 0.00 -0.12 0.00 0.00 57.88 57.66 3m1a h LEU 117 Cb 0.29 -0.14 -0.06 0.00 -0.73 0.00 0.00 40.66 40.03 3m1a h LEU 117 CO -0.00 0.74 0.24 0.74 -0.62 0.00 0.00 178.44 179.53 3m1a h THR 118 N 0.26 0.87 -0.87 1.05 2.02 -1.19 -2.40 112.91 112.66 3m1a h THR 118 Ca 0.07 -0.15 -0.01 0.00 0.77 0.00 0.00 66.41 67.08 3m1a h THR 118 Cb 0.51 0.39 -0.04 0.00 -1.74 0.00 0.00 68.15 67.26 3m1a h THR 118 CO 0.02 0.08 0.49 0.03 0.37 0.00 0.00 175.52 176.51 3m1a h ARG 119 N 0.45 1.21 -0.26 6.66 3.08 -1.07 -1.04 114.38 123.41 3m1a h ARG 119 Ca 0.25 -0.13 0.02 0.00 0.07 0.00 0.00 59.98 60.19 3m1a h ARG 119 Cb 0.23 -0.24 -0.01 0.00 0.08 0.00 0.00 29.97 30.03 3m1a h ARG 119 CO -0.22 0.88 0.17 0.00 -1.07 0.00 0.00 179.97 179.73 3m1a h ALA 120 N 1.26 1.90 0.00 0.04 0.00 -0.81 -3.25 119.26 118.40 3m1a h ALA 120 Ca 0.31 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.20 3m1a h ALA 120 Cb 0.01 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.73 3m1a h ALA 120 CO -0.05 0.07 -0.58 1.28 0.00 0.00 0.00 179.25 179.97 3m1a n LEU 121 N -4.50 0.48 -0.11 0.00 4.77 -0.87 -4.52 117.00 112.25 3m1a n LEU 121 Ca 0.01 -0.47 -0.10 0.00 -0.03 0.00 0.00 56.01 55.43 3m1a n LEU 121 Cb 0.13 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.19 3m1a n LEU 121 CO 0.35 0.12 0.86 -0.07 -1.33 0.00 0.00 177.39 177.32 3m1a h LEU 122 N 0.00 0.49 -0.45 2.23 4.07 -1.24 -3.27 115.31 117.13 3m1a h LEU 122 Ca 0.00 -0.21 0.09 0.00 0.08 0.00 0.00 57.88 57.84 3m1a h LEU 122 Cb 0.27 -0.13 -0.09 0.00 1.08 0.00 0.00 40.66 41.80 3m1a h LEU 122 CO 0.00 0.57 -0.11 -0.65 -1.08 0.00 0.00 178.44 177.17 3m1a h PRO 123 N 0.38 0.00 -1.87 1.13 0.11 -1.79 -1.00 132.00 128.96 3m1a h PRO 123 Ca 0.11 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.22 3m1a h PRO 123 Cb 0.26 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.37 3m1a h PRO 123 CO -0.00 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 177.79 3m1a n GLN 124 N -5.33 0.20 0.00 1.05 -0.00 -1.24 -0.69 117.38 111.38 3m1a n GLN 124 Ca 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 57.03 3m1a n GLN 124 Cb 0.24 -1.40 0.00 0.00 -0.00 0.00 0.00 30.24 29.08 3m1a n GLN 124 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 3m1a n ARG 126 N 1.26 0.00 -0.30 2.61 1.74 -0.38 -1.86 116.66 119.72 3m1a n ARG 126 Ca 0.00 0.00 -0.00 0.00 -0.77 0.00 0.00 57.85 57.08 3m1a n ARG 126 Cb 0.10 0.00 0.13 0.00 -1.02 0.00 0.00 32.46 31.67 3m1a n ARG 126 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 3m1a h GLU 127 N 0.00 0.96 -0.14 5.56 5.08 -1.16 -1.84 114.58 123.03 3m1a h GLU 127 Ca 0.00 -0.06 -0.20 0.00 -1.00 0.00 0.00 59.36 58.11 3m1a h GLU 127 Cb 0.00 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.03 3m1a h GLU 127 CO 0.00 0.64 -0.70 -0.09 -1.00 0.00 0.00 179.01 177.85 3m1a h ARG 128 N 0.99 0.61 0.00 2.33 2.43 -1.63 -3.47 114.38 115.64 3m1a h ARG 128 Ca 0.36 -0.47 0.00 0.00 -0.81 0.00 0.00 59.98 59.05 3m1a h ARG 128 Cb 0.11 0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.75 3m1a h ARG 128 CO -0.15 1.09 0.00 0.41 -1.51 0.00 0.00 179.97 179.81 3m1a n GLY 129 N 0.54 0.46 3.32 2.80 0.00 -0.69 -5.07 105.19 106.55 3m1a n GLY 129 Ca -0.05 -0.91 -0.10 0.00 0.00 0.00 0.00 46.02 44.96 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 -2.82 -0.21 0.00 1.61 1.04 -1.26 -4.35 113.70 107.70 3m1a s SER 130 Ca 0.00 -0.34 0.00 0.00 0.48 0.00 0.00 55.95 56.09 3m1a s SER 130 Cb 0.00 0.47 0.00 0.00 0.10 0.00 0.00 66.02 66.59 3m1a s SER 130 CO 0.00 -0.85 0.00 0.61 0.98 0.00 0.00 173.24 173.98 3m1a n GLY 131 N -0.22 3.34 3.03 7.32 0.00 -1.25 -4.64 105.19 112.77 3m1a n GLY 131 Ca -0.16 -1.08 -0.21 0.00 0.00 0.00 0.00 46.02 44.57 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 1.40 -0.23 1.61 0.01 0.07 -0.34 113.70 116.23 3m1a s SER 132 Ca 0.00 -0.22 -0.04 0.00 1.31 0.00 0.00 55.95 57.00 3m1a s SER 132 Cb 0.00 -0.36 -0.01 0.00 0.21 0.00 0.00 66.02 65.86 3m1a s SER 132 CO 0.00 0.09 -0.02 -0.69 0.41 0.00 0.00 173.24 173.03 3m1a s VAL 133 N 0.13 3.49 -0.29 3.43 1.01 0.46 -0.94 120.40 127.69 3m1a s VAL 133 Ca -0.03 -0.50 -0.00 0.00 0.00 0.00 0.00 61.98 61.45 3m1a s VAL 133 Cb -0.09 -2.62 0.05 0.00 0.00 0.00 0.00 36.38 33.73 3m1a s VAL 133 CO 0.01 0.38 -0.04 -0.69 0.00 0.00 0.00 175.10 174.76 3m1a s VAL 134 N 1.49 2.69 -0.28 2.92 1.01 0.14 -0.65 120.40 127.72 3m1a s VAL 134 Ca 0.05 -1.49 -0.09 0.00 0.00 0.00 0.00 61.98 60.45 3m1a s VAL 134 Cb -0.15 -2.57 -0.03 0.00 0.00 0.00 0.00 36.38 33.64 3m1a s VAL 134 CO -0.02 -0.09 0.13 0.20 0.00 0.00 0.00 175.10 175.32 3m1a s ASN 135 N 1.20 5.53 -0.67 3.32 0.02 0.52 -1.21 114.94 123.66 3m1a s ASN 135 Ca -0.06 -0.25 -0.26 0.00 -1.02 0.00 0.00 52.86 51.26 3m1a s ASN 135 Cb -0.20 -2.01 0.04 0.00 0.02 0.00 0.00 41.25 39.10 3m1a s ASN 135 CO -0.03 -0.09 1.19 -0.63 0.02 0.00 0.00 177.10 177.56 3m1a s ILE 136 N 1.66 3.93 0.00 0.60 -1.09 -0.63 -1.14 121.20 124.54 3m1a s ILE 136 Ca 0.06 0.43 0.00 0.00 -2.23 0.00 0.00 60.65 58.91 3m1a s ILE 136 Cb -0.16 -4.81 0.00 0.00 -1.58 0.00 0.00 42.46 35.91 3m1a s ILE 136 CO 0.07 -1.61 0.00 -0.24 -1.23 0.00 0.00 174.94 171.92 3m1a n SER 137 N 8.76 0.00 -3.64 3.58 2.88 0.63 -4.89 113.62 120.94 3m1a n SER 137 Ca 0.03 0.00 -0.02 0.00 -1.33 0.00 0.00 58.87 57.55 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 -0.14 0.57 -3.46 0.15 -1.22 -4.34 113.70 104.26 3m1a s SER 138 Ca 0.00 -0.18 0.27 0.00 0.70 0.00 0.00 55.95 56.73 3m1a s SER 138 Cb 0.00 0.29 1.55 0.00 -1.71 0.00 0.00 66.02 66.15 3m1a s SER 138 CO 0.00 -0.52 2.06 2.19 1.20 0.00 0.00 173.24 178.17 3m1a h PHE 139 N 2.00 0.00 0.00 3.44 -5.15 -1.74 -1.62 116.94 113.88 3m1a h PHE 139 Ca -0.24 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.53 3m1a h PHE 139 Cb 1.21 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.38 3m1a h PHE 139 CO 0.33 0.00 0.00 0.41 -2.00 0.00 0.00 178.31 177.05 3m1a n GLY 140 N -1.48 -0.85 0.09 6.09 0.00 -1.26 -1.84 105.19 105.94 3m1a n GLY 140 Ca 0.04 -0.06 0.11 0.00 0.00 0.00 0.00 46.02 46.11 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 -0.09 -1.27 0.01 -0.02 0.00 -0.61 -3.46 105.19 99.75 3m1a n GLY 141 Ca 0.05 0.03 0.01 0.00 0.00 0.00 0.00 46.02 46.11 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 -2.02 5.42 -3.42 1.61 1.13 -0.77 -3.72 117.38 115.61 3m1a n GLN 142 Ca 0.03 -0.06 -0.12 0.00 -1.94 0.00 0.00 57.00 54.90 3m1a n GLN 142 Cb 0.24 -0.68 -0.02 0.00 0.11 0.00 0.00 30.24 29.90 3m1a n GLN 142 CO 0.00 0.00 0.00 -0.48 -1.44 0.00 0.00 177.06 175.14 3m1a s LEU 143 N -1.97 -0.57 0.29 1.08 0.05 -1.22 -5.03 118.68 111.32 3m1a s LEU 143 Ca 0.01 0.02 -0.02 0.00 0.05 0.00 0.00 54.13 54.20 3m1a s LEU 143 Cb 0.02 2.59 -0.02 0.00 -2.05 0.00 0.00 46.19 46.74 3m1a s LEU 143 CO 0.11 -0.96 0.35 -0.55 -0.55 0.00 0.00 176.35 174.75 3m1a s SER 144 N -2.70 0.74 0.18 1.48 0.15 -1.26 -4.37 113.70 107.91 3m1a s SER 144 Ca 0.01 -1.43 -0.14 0.00 0.70 0.00 0.00 55.95 55.08 3m1a s SER 144 Cb -0.01 0.56 0.05 0.00 -1.71 0.00 0.00 66.02 64.91 3m1a s SER 144 CO -0.12 -1.11 0.69 2.22 1.20 0.00 0.00 173.24 176.12 3m1a n PHE 145 N -0.48 -1.38 -1.65 3.44 -1.74 -1.26 -5.08 117.46 109.31 3m1a n PHE 145 Ca 0.02 -1.03 -0.46 0.00 -0.56 0.00 0.00 57.45 55.42 3m1a n PHE 145 Cb 0.63 0.51 -0.04 0.00 1.52 0.00 0.00 39.48 42.10 3m1a n PHE 145 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 3m1a n ALA 146 N -1.36 0.79 -0.52 1.98 0.00 -1.26 -1.61 120.51 118.52 3m1a n ALA 146 Ca -0.11 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.78 3m1a n ALA 146 Cb 0.42 -2.26 0.00 0.00 0.00 0.00 0.00 19.45 17.61 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 2.65 1.90 0.40 0.00 0.00 -1.26 -4.67 105.19 104.21 3m1a n GLY 147 Ca 0.15 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.21 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 0.31 0.03 1.61 -0.00 -0.63 -1.19 117.46 115.59 3m1a n PHE 148 Ca 0.00 -0.56 -0.12 0.00 -0.00 0.00 0.00 57.45 56.77 3m1a n PHE 148 Cb 0.00 -0.07 -0.07 0.00 -0.00 0.00 0.00 39.48 39.34 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 1.16 0.01 -0.46 -2.13 4.64 -1.79 0.06 113.55 115.04 3m1a h SER 149 Ca 0.00 -0.03 -0.04 0.00 -0.47 0.00 0.00 61.79 61.25 3m1a h SER 149 Cb 0.73 -0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.79 3m1a h SER 149 CO 0.02 0.04 0.14 0.00 -0.87 0.00 0.00 176.83 176.16 3m1a h ALA 150 N 0.98 0.61 0.38 5.18 0.00 -1.87 -0.71 119.26 123.83 3m1a h ALA 150 Ca 0.00 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.72 3m1a h ALA 150 Cb 0.03 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.64 3m1a h ALA 150 CO -0.00 0.26 -0.18 -0.92 0.00 0.00 0.00 179.25 178.40 3m1a h TYR 151 N 0.61 -0.48 -0.59 0.00 3.20 -1.75 -1.88 116.97 116.08 3m1a h TYR 151 Ca 0.15 -0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.04 3m1a h TYR 151 Cb 0.27 0.16 -0.04 0.00 1.54 0.00 0.00 36.73 38.66 3m1a h TYR 151 CO 0.01 -0.25 0.35 0.77 -1.64 0.00 0.00 178.16 177.40 3m1a h SER 152 N -0.59 0.56 -0.66 -2.11 0.02 -0.98 -1.74 113.55 108.05 3m1a h SER 152 Ca -0.05 0.01 0.09 0.00 -0.84 0.00 0.00 61.79 60.99 3m1a h SER 152 Cb 0.44 -0.11 -0.07 0.00 0.14 0.00 0.00 62.40 62.80 3m1a h SER 152 CO 0.09 0.39 0.30 0.00 -1.14 0.00 0.00 176.83 176.46 3m1a h ALA 153 N 1.27 0.88 -0.36 3.77 0.00 -0.93 0.79 119.26 124.68 3m1a h ALA 153 Ca 0.24 0.06 -0.16 0.00 0.00 0.00 0.00 54.91 55.05 3m1a h ALA 153 Cb 0.05 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 3m1a h ALA 153 CO -0.11 -0.10 -0.41 1.79 0.00 0.00 0.00 179.25 180.41 3m1a h THR 154 N 0.53 1.27 -0.35 0.00 1.35 -1.02 -2.34 112.91 112.34 3m1a h THR 154 Ca 0.32 -1.59 -0.15 0.00 -0.55 0.00 0.00 66.41 64.45 3m1a h THR 154 Cb 0.35 1.44 -0.01 0.00 -1.73 0.00 0.00 68.15 68.20 3m1a h THR 154 CO -0.27 0.53 -0.37 0.11 -0.25 0.00 0.00 175.52 175.27 3m1a h LYS 155 N 0.73 0.83 -0.47 4.72 1.79 -0.89 -1.99 116.57 121.28 3m1a h LYS 155 Ca 0.05 -0.42 -0.09 0.00 -2.18 0.00 0.00 60.65 58.01 3m1a h LYS 155 Cb 1.01 0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 31.65 3m1a h LYS 155 CO 0.10 1.06 -0.07 0.00 -1.08 0.00 0.00 179.45 179.46 3m1a h ALA 156 N 0.90 0.98 -0.14 3.86 0.00 -0.86 0.58 119.26 124.58 3m1a h ALA 156 Ca 0.06 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 3m1a h ALA 156 Cb 0.93 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 3m1a h ALA 156 CO 0.09 0.61 0.07 0.00 0.00 0.00 0.00 179.25 180.01 3m1a h ALA 157 N 1.15 0.18 -0.88 0.00 0.00 -1.23 -1.17 119.26 117.31 3m1a h ALA 157 Ca 0.13 -0.08 0.08 0.00 0.00 0.00 0.00 54.91 55.05 3m1a h ALA 157 Cb 0.56 -0.05 -0.07 0.00 0.00 0.00 0.00 17.79 18.23 3m1a h ALA 157 CO 0.03 -0.26 0.54 1.25 0.00 0.00 0.00 179.25 180.81 3m1a h LEU 158 N 0.09 0.82 -0.75 0.00 5.85 -1.03 -1.14 115.31 119.14 3m1a h LEU 158 Ca 0.05 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.80 3m1a h LEU 158 Cb 0.12 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 40.98 3m1a h LEU 158 CO -0.01 0.50 0.48 -0.33 -0.34 0.00 0.00 178.44 178.73 3m1a h GLU 159 N 0.94 1.01 0.01 1.25 5.08 -0.46 -1.02 114.58 121.39 3m1a h GLU 159 Ca 0.41 -0.08 -0.21 0.00 -1.00 0.00 0.00 59.36 58.48 3m1a h GLU 159 Cb 0.28 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 3m1a h GLU 159 CO -0.21 0.69 -0.93 1.96 -1.00 0.00 0.00 179.01 179.53 3m1a h GLN 160 N 1.03 0.26 -0.54 2.33 1.08 -0.76 0.30 115.11 118.80 3m1a h GLN 160 Ca 0.27 -0.29 0.04 0.00 -1.45 0.00 0.00 58.65 57.22 3m1a h GLN 160 Cb -0.07 0.09 -0.04 0.00 -0.05 0.00 0.00 27.48 27.40 3m1a h GLN 160 CO -0.05 1.02 0.28 -0.07 -0.95 0.00 0.00 178.83 179.06 3m1a h LEU 161 N 0.14 0.42 -0.28 1.46 3.38 -1.13 -1.50 115.31 117.79 3m1a h LEU 161 Ca -0.06 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 3m1a h LEU 161 Cb 1.57 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 42.25 3m1a h LEU 161 CO 0.15 0.29 0.12 0.28 0.09 0.00 0.00 178.44 179.37 3m1a h SER 162 N 0.55 0.38 -0.39 -0.43 0.02 -0.71 0.21 113.55 113.18 3m1a h SER 162 Ca 0.23 -0.15 -0.00 0.00 -0.84 0.00 0.00 61.79 61.03 3m1a h SER 162 Cb 0.13 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 62.55 3m1a h SER 162 CO -0.15 0.42 0.23 -0.33 -1.14 0.00 0.00 176.83 175.86 3m1a h GLU 163 N 0.31 0.53 -0.40 3.45 5.08 -0.13 0.17 114.58 123.59 3m1a h GLU 163 Ca 0.10 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.37 3m1a h GLU 163 Cb 0.15 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 3m1a h GLU 163 CO -0.01 0.40 0.12 0.78 -1.00 0.00 0.00 179.01 179.31 3m1a h GLY 164 N 0.50 0.67 0.96 -3.84 0.00 -1.19 -2.99 103.07 97.19 3m1a h GLY 164 Ca 0.14 -0.40 -0.00 0.00 0.00 0.00 0.00 47.33 47.06 3m1a h GLY 164 CO -0.02 0.37 0.15 -2.00 0.00 0.00 0.00 176.54 175.03 3m1a h LEU 165 N 0.50 0.32 -0.78 3.11 5.85 -0.66 -2.88 115.31 120.77 3m1a h LEU 165 Ca 0.13 -0.07 0.13 0.00 0.84 0.00 0.00 57.88 58.90 3m1a h LEU 165 Cb 0.27 -0.08 -0.09 0.00 0.37 0.00 0.00 40.66 41.13 3m1a h LEU 165 CO -0.00 0.30 0.37 0.00 -0.34 0.00 0.00 178.44 178.77 3m1a h ALA 166 N 1.03 1.12 -0.10 1.25 0.00 -0.64 0.17 119.26 122.09 3m1a h ALA 166 Ca 0.09 0.08 -0.08 0.00 0.00 0.00 0.00 54.91 55.01 3m1a h ALA 166 Cb 0.05 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 3m1a h ALA 166 CO -0.02 -0.11 -0.29 0.22 0.00 0.00 0.00 179.25 179.06 3m1a h ASP 167 N 0.57 0.19 0.55 0.00 3.58 -1.42 -2.52 116.42 117.37 3m1a h ASP 167 Ca 0.41 -0.06 -0.29 0.00 0.42 0.00 0.00 57.03 57.52 3m1a h ASP 167 Cb 0.55 -0.05 0.01 0.00 1.72 0.00 0.00 39.33 41.56 3m1a h ASP 167 CO -0.34 0.47 -1.31 -0.33 -2.88 0.00 0.00 179.24 174.85 3m1a h GLU 168 N 0.17 0.33 -0.01 0.28 5.08 -0.78 -3.38 114.58 116.27 3m1a h GLU 168 Ca 0.03 -0.56 0.00 0.00 -1.00 0.00 0.00 59.36 57.83 3m1a h GLU 168 Cb 0.60 0.21 0.00 0.00 0.50 0.00 0.00 28.75 30.06 3m1a h GLU 168 CO 0.04 1.26 -0.58 1.33 -1.00 0.00 0.00 179.01 180.06 3m1a n VAL 169 N -3.57 0.00 -0.25 3.13 0.24 -0.66 -4.33 118.33 112.90 3m1a n VAL 169 Ca -0.11 -0.21 0.06 0.00 -2.04 0.00 0.00 64.34 62.04 3m1a n VAL 169 Cb 1.04 1.18 0.19 0.00 -1.47 0.00 0.00 33.84 34.78 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 3.40 0.99 0.00 2.33 0.00 -1.59 -0.12 119.26 124.28 3m1a h ALA 170 Ca 0.00 0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.07 3m1a h ALA 170 Cb 0.64 0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.64 3m1a h ALA 170 CO 0.00 -0.32 0.00 -1.35 0.00 0.00 0.00 179.25 177.58 3m1a h PRO 171 N 0.29 0.00 -0.01 0.00 0.11 -1.85 -1.97 132.00 128.58 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 0.72 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.83 3m1a h PRO 171 CO -0.50 0.00 -0.08 1.19 -0.21 0.00 0.00 178.00 178.40 3m1a n PHE 172 N -3.03 0.00 -1.00 0.65 0.99 -0.07 -4.92 117.46 110.08 3m1a n PHE 172 Ca -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.43 3m1a n PHE 172 Cb 0.10 -0.05 0.00 0.00 -1.00 0.00 0.00 39.48 38.52 3m1a n PHE 172 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3m1a n GLY 173 N 1.22 0.42 3.75 1.37 0.00 -0.74 -4.05 105.19 107.15 3m1a n GLY 173 Ca 0.17 -0.77 -0.38 0.00 0.00 0.00 0.00 46.02 45.04 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 -2.00 5.18 -0.06 -0.61 1.01 -1.10 -3.87 121.20 119.75 3m1a s ILE 174 Ca 0.00 0.84 -0.11 0.00 0.00 0.00 0.00 60.65 61.37 3m1a s ILE 174 Cb 0.00 -3.75 -0.05 0.00 0.01 0.00 0.00 42.46 38.67 3m1a s ILE 174 CO 0.00 0.39 0.29 -0.54 0.00 0.00 0.00 174.94 175.08 3m1a s LYS 175 N 0.24 3.74 -0.12 2.79 1.02 0.54 -4.03 119.74 123.92 3m1a s LYS 175 Ca 0.23 0.17 0.01 0.00 0.02 0.00 0.00 55.97 56.40 3m1a s LYS 175 Cb -0.15 -3.22 0.02 0.00 -0.52 0.00 0.00 37.83 33.96 3m1a s LYS 175 CO 0.09 0.70 -0.13 0.08 -0.92 0.00 0.00 175.35 175.18 3m1a s VAL 176 N -0.98 1.40 -0.14 3.17 1.01 -1.26 -0.40 120.40 123.20 3m1a s VAL 176 Ca 0.20 -0.55 0.01 0.00 0.00 0.00 0.00 61.98 61.65 3m1a s VAL 176 Cb -0.15 -1.32 0.02 0.00 0.00 0.00 0.00 36.38 34.93 3m1a s VAL 176 CO 0.09 0.43 -0.17 -0.22 0.00 0.00 0.00 175.10 175.23 3m1a s LEU 177 N 1.34 1.84 -0.29 3.92 2.96 0.18 -4.56 118.68 124.06 3m1a s LEU 177 Ca 0.00 -0.51 -0.13 0.00 -0.22 0.00 0.00 54.13 53.27 3m1a s LEU 177 Cb -0.14 -1.24 -0.03 0.00 0.50 0.00 0.00 46.19 45.28 3m1a s LEU 177 CO -0.07 0.00 0.30 -0.63 -1.32 0.00 0.00 176.35 174.63 3m1a s ILE 178 N 1.16 5.23 -0.17 6.68 1.01 0.72 -0.35 121.20 135.48 3m1a s ILE 178 Ca -0.01 0.25 -0.08 0.00 0.00 0.00 0.00 60.65 60.81 3m1a s ILE 178 Cb -0.14 -3.67 -0.04 0.00 0.01 0.00 0.00 42.46 38.62 3m1a s ILE 178 CO -0.06 0.12 0.09 -0.69 0.00 0.00 0.00 174.94 174.40 3m1a s VAL 179 N 1.92 5.07 -0.62 2.92 1.01 -0.29 -0.29 120.40 130.12 3m1a s VAL 179 Ca 0.11 0.06 0.05 0.00 0.00 0.00 0.00 61.98 62.20 3m1a s VAL 179 Cb -0.16 -3.27 0.19 0.00 0.00 0.00 0.00 36.38 33.15 3m1a s VAL 179 CO 0.11 0.50 0.53 -0.62 0.00 0.00 0.00 175.10 175.61 3m1a n GLU 180 N 3.10 1.63 -2.73 2.72 1.02 0.08 -0.27 120.64 126.19 3m1a n GLU 180 Ca -0.17 -4.22 -0.33 0.00 -0.02 0.00 0.00 57.16 52.43 3m1a n GLU 180 Cb 0.53 -2.10 -0.06 0.00 -0.02 0.00 0.00 31.44 29.79 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 -1.42 4.12 0.00 3.49 0.04 -1.26 -1.55 135.00 138.41 3m1a s PRO 181 Ca 0.30 1.02 0.00 0.00 0.04 0.00 0.00 61.00 62.36 3m1a s PRO 181 Cb 0.03 -2.19 0.00 0.00 0.04 0.00 0.00 34.50 32.38 3m1a s PRO 181 CO -0.14 -0.08 0.00 0.41 0.04 0.00 0.00 177.00 177.23 3m1a n GLY 182 N -0.90 1.45 3.68 0.56 0.00 -0.02 -3.57 105.19 106.38 3m1a n GLY 182 Ca 0.06 -1.64 -0.41 0.00 0.00 0.00 0.00 46.02 44.03 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 -3.46 3.49 0.10 4.61 0.00 -1.26 -5.02 121.76 120.22 3m1a s ALA 183 Ca 0.00 0.10 0.06 0.00 0.00 0.00 0.00 51.96 52.12 3m1a s ALA 183 Cb 0.00 -3.26 -0.04 0.00 0.00 0.00 0.00 23.12 19.82 3m1a s ALA 183 CO 0.00 -0.62 -0.02 -0.06 0.00 0.00 0.00 175.76 175.06 3m1a s PHE 184 N 2.06 2.92 0.36 0.00 0.08 -1.26 -2.21 117.98 119.93 3m1a s PHE 184 Ca 0.40 -0.07 -0.28 0.00 0.12 0.00 0.00 56.93 57.10 3m1a s PHE 184 Cb -0.17 -1.50 -0.10 0.00 -0.57 0.00 0.00 43.02 40.68 3m1a s PHE 184 CO 0.14 0.47 1.37 1.03 -0.10 0.00 0.00 175.22 178.12 3m1a s ARG 185 N -2.37 4.19 -0.06 0.44 0.52 0.57 -4.81 118.95 117.44 3m1a s ARG 185 Ca 0.25 2.33 0.09 0.00 -0.52 0.00 0.00 55.73 57.88 3m1a s ARG 185 Cb -0.11 -2.97 0.22 0.00 0.52 0.00 0.00 34.95 32.61 3m1a s ARG 185 CO 0.17 -0.37 1.16 0.25 0.02 0.00 0.00 175.30 176.54 3m1a n THR 186 N 0.55 1.40 0.22 0.02 -2.24 -1.26 -4.63 114.28 108.33 3m1a n THR 186 Ca 0.01 -1.42 0.11 0.00 -2.27 0.00 0.00 64.05 60.48 3m1a n THR 186 Cb 0.41 0.22 0.42 0.00 -2.10 0.00 0.00 70.33 69.28 3m1a n THR 186 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 3m1a h ASN 187 N 0.80 0.00 0.02 3.42 -0.26 -1.92 -2.56 115.58 115.08 3m1a h ASN 187 Ca 0.00 0.00 -0.39 0.00 -0.56 0.00 0.00 56.30 55.35 3m1a h ASN 187 Cb 0.82 0.00 -0.06 0.00 -1.06 0.00 0.00 38.32 38.02 3m1a h ASN 187 CO 0.04 0.19 -2.28 0.00 -1.06 0.00 0.00 177.43 174.32 3m1a n LEU 188 N -3.29 2.51 -0.45 1.61 -0.00 -1.26 -4.70 117.00 111.42 3m1a n LEU 188 Ca 0.01 0.12 0.08 0.00 -0.00 0.00 0.00 56.01 56.22 3m1a n LEU 188 Cb 0.45 -0.93 0.18 0.00 -0.00 0.00 0.00 43.42 43.12 3m1a n LEU 188 CO 0.33 0.75 0.63 0.49 -0.00 0.00 0.00 177.39 179.59 3m1a n PHE 189 N -3.71 0.43 -0.46 1.47 3.72 -1.25 -5.04 117.46 112.62 3m1a n PHE 189 Ca -0.44 -0.87 0.06 0.00 -0.05 0.00 0.00 57.45 56.15 3m1a n PHE 189 Cb 0.94 -0.20 -0.02 0.00 -0.94 0.00 0.00 39.48 39.26 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 -0.82 -1.82 3.56 1.37 0.00 -0.96 0.24 105.19 106.76 3m1a n GLY 190 Ca 0.16 -1.39 -0.28 0.00 0.00 0.00 0.00 46.02 44.51 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 -1.90 2.02 1.09 1.61 3.01 -1.26 -1.43 119.74 122.87 3m1a s LYS 191 Ca 0.00 -1.22 -0.15 0.00 -1.01 0.00 0.00 55.97 53.59 3m1a s LYS 191 Cb 0.00 -2.17 0.23 0.00 -1.01 0.00 0.00 37.83 34.88 3m1a s LYS 191 CO 0.00 0.45 1.10 0.20 0.51 0.00 0.00 175.35 177.61 3m1a s GLY 192 N -2.62 1.57 0.60 -3.33 0.00 -1.26 -4.74 107.32 97.54 3m1a s GLY 192 Ca 0.23 -0.62 -0.18 0.00 0.00 0.00 0.00 44.72 44.16 3m1a s GLY 192 CO 0.14 0.11 1.15 0.00 0.00 0.00 0.00 173.10 174.50 3m1a s ALA 193 N -2.99 2.55 -0.11 3.20 0.00 -1.26 -4.92 121.76 118.22 3m1a s ALA 193 Ca 0.68 0.79 -0.08 0.00 0.00 0.00 0.00 51.96 53.34 3m1a s ALA 193 Cb -0.15 -3.38 0.04 0.00 0.00 0.00 0.00 23.12 19.63 3m1a s ALA 193 CO 0.57 -1.10 0.29 0.00 0.00 0.00 0.00 175.76 175.52 3m1a s ALA 194 N -1.92 -0.70 -0.09 0.00 0.00 -1.26 -1.53 121.76 116.26 3m1a s ALA 194 Ca 0.72 0.93 0.03 0.00 0.00 0.00 0.00 51.96 53.65 3m1a s ALA 194 Cb -0.25 -0.56 0.00 0.00 0.00 0.00 0.00 23.12 22.32 3m1a s ALA 194 CO 0.34 -0.17 -0.21 -0.47 0.00 0.00 0.00 175.76 175.26 3m1a s TYR 195 N 0.59 2.27 -0.16 0.00 5.04 -0.50 -4.98 117.35 119.61 3m1a s TYR 195 Ca -0.04 -0.93 0.01 0.00 -2.44 0.00 0.00 57.07 53.67 3m1a s TYR 195 Cb -0.05 -1.54 0.00 0.00 0.35 0.00 0.00 41.96 40.72 3m1a s TYR 195 CO -0.03 -0.39 -0.17 -0.06 -1.34 0.00 0.00 175.55 173.55 3m1a s PHE 196 N 0.46 2.77 0.72 4.97 0.08 -1.26 -1.36 117.98 124.34 3m1a s PHE 196 Ca -0.17 -1.19 -0.13 0.00 0.12 0.00 0.00 56.93 55.56 3m1a s PHE 196 Cb -0.17 -1.89 0.03 0.00 -0.57 0.00 0.00 43.02 40.42 3m1a s PHE 196 CO 0.07 -0.56 1.12 -1.12 -0.10 0.00 0.00 175.22 174.63 3m1a s SER 197 N 0.92 4.69 0.25 1.36 0.01 0.62 -4.98 113.70 116.57 3m1a s SER 197 Ca -0.04 2.00 -0.30 0.00 1.31 0.00 0.00 55.95 58.93 3m1a s SER 197 Cb -0.15 -2.55 -0.14 0.00 0.21 0.00 0.00 66.02 63.39 3m1a s SER 197 CO -0.02 -1.92 1.09 1.21 0.41 0.00 0.00 173.24 174.01 3m1a n GLU 198 N -2.88 1.35 -3.71 12.44 2.13 -1.26 -4.89 120.64 123.82 3m1a n GLU 198 Ca 0.10 0.48 -0.38 0.00 0.66 0.00 0.00 57.16 58.02 3m1a n GLU 198 Cb 0.52 -1.91 -0.11 0.00 0.27 0.00 0.00 31.44 30.21 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 -1.07 2.29 0.49 5.31 2.02 -1.26 -4.78 118.70 121.70 3m1a s GLU 199 Ca 0.64 -1.65 -0.06 0.00 0.02 0.00 0.00 54.97 53.92 3m1a s GLU 199 Cb -0.74 -3.64 -0.04 0.00 0.10 0.00 0.00 34.13 29.80 3m1a s GLU 199 CO 0.57 -1.01 0.80 -0.80 0.02 0.00 0.00 175.26 174.84 3m1a s ASN 200 N 1.98 6.26 0.40 -0.19 0.01 -1.26 -4.73 114.94 117.40 3m1a s ASN 200 Ca 0.05 0.96 0.16 0.00 -0.71 0.00 0.00 52.86 53.31 3m1a s ASN 200 Cb -0.23 -2.26 1.02 0.00 0.41 0.00 0.00 41.25 40.20 3m1a s ASN 200 CO -0.02 -0.60 1.84 -0.65 -1.51 0.00 0.00 177.10 176.17 3m1a h PRO 201 N 0.19 0.46 0.00 -0.60 0.11 -1.99 0.14 132.00 130.30 3m1a h PRO 201 Ca -0.47 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.60 3m1a h PRO 201 Cb 1.20 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.21 3m1a h PRO 201 CO 0.62 0.30 -0.06 0.00 -0.21 0.00 0.00 178.00 178.64 3m1a h ALA 202 N 1.61 1.60 -0.00 -0.75 0.00 -2.04 -3.22 119.26 116.46 3m1a h ALA 202 Ca 0.49 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.34 3m1a h ALA 202 Cb 1.12 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.90 3m1a h ALA 202 CO -0.21 0.08 -0.09 0.66 0.00 0.00 0.00 179.25 179.70 3m1a n TYR 203 N -4.03 0.00 -0.26 0.00 4.01 0.29 -4.81 117.16 112.36 3m1a n TYR 203 Ca -0.03 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.72 3m1a n TYR 203 Cb 0.15 0.00 0.14 0.00 -0.31 0.00 0.00 39.34 39.32 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 0.50 1.03 -0.87 -0.72 0.00 -0.98 -0.38 119.26 117.84 3m1a h ALA 204 Ca 0.00 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 3m1a h ALA 204 Cb 0.09 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 3m1a h ALA 204 CO 0.00 0.04 0.46 1.49 0.00 0.00 0.00 179.25 181.24 3m1a h GLU 205 N 0.71 1.23 0.17 0.00 4.81 -1.87 0.12 114.58 119.74 3m1a h GLU 205 Ca 0.35 -0.16 -0.24 0.00 -0.13 0.00 0.00 59.36 59.18 3m1a h GLU 205 Cb 0.31 -0.23 0.02 0.00 0.63 0.00 0.00 28.75 29.48 3m1a h GLU 205 CO -0.23 0.91 -1.09 0.87 -0.73 0.00 0.00 179.01 178.74 3m1a h LYS 206 N 1.22 0.36 0.02 1.92 1.79 -1.83 -3.39 116.57 116.66 3m1a h LYS 206 Ca 0.30 -0.62 -0.25 0.00 -2.18 0.00 0.00 60.65 57.91 3m1a h LYS 206 Cb 0.06 0.23 -0.03 0.00 -1.58 0.00 0.00 32.23 30.91 3m1a h LYS 206 CO -0.05 1.30 -1.27 0.28 -1.08 0.00 0.00 179.45 178.63 3m1a h VAL 207 N -0.21 1.40 -0.53 0.50 2.07 -1.05 -3.36 116.25 115.07 3m1a h VAL 207 Ca -0.20 -3.14 0.08 0.00 0.82 0.00 0.00 66.70 64.25 3m1a h VAL 207 Cb 1.81 2.72 -0.10 0.00 -1.52 0.00 0.00 31.29 34.20 3m1a h VAL 207 CO 0.18 0.82 -0.47 1.23 0.02 0.00 0.00 177.57 179.34 3m1a h GLY 208 N 2.97 -0.62 2.00 2.17 0.00 -0.93 -1.16 103.07 107.50 3m1a h GLY 208 Ca -0.12 0.61 -0.00 0.00 0.00 0.00 0.00 47.33 47.82 3m1a h GLY 208 CO 0.12 -0.15 -0.02 -2.55 0.00 0.00 0.00 176.54 173.95 3m1a h PRO 209 N -0.27 0.00 -0.20 4.80 0.11 -1.77 -1.56 132.00 133.11 3m1a h PRO 209 Ca 0.15 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 66.08 3m1a h PRO 209 Cb 0.57 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.68 3m1a h PRO 209 CO -0.66 0.02 -0.56 1.15 -0.21 0.00 0.00 178.00 177.74 3m1a h THR 210 N 0.00 1.31 -0.60 -1.15 2.02 -1.41 -2.23 112.91 110.85 3m1a h THR 210 Ca -0.00 -1.78 0.09 0.00 0.77 0.00 0.00 66.41 65.49 3m1a h THR 210 Cb 0.04 1.89 -0.07 0.00 -1.74 0.00 0.00 68.15 68.27 3m1a h THR 210 CO 0.00 0.56 0.24 -0.09 0.37 0.00 0.00 175.52 176.60 3m1a h ARG 211 N 0.44 0.42 -0.72 6.66 2.43 -0.59 -1.55 114.38 121.46 3m1a h ARG 211 Ca -0.01 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.11 3m1a h ARG 211 Cb 1.18 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 30.60 3m1a h ARG 211 CO 0.12 0.27 0.38 1.96 -1.51 0.00 0.00 179.97 181.20 3m1a h GLN 212 N 0.43 1.00 -0.20 0.20 1.08 -1.38 -1.55 115.11 114.69 3m1a h GLN 212 Ca 0.30 -0.11 -0.03 0.00 -1.45 0.00 0.00 58.65 57.35 3m1a h GLN 212 Cb 0.34 -0.20 -0.01 0.00 -0.05 0.00 0.00 27.48 27.57 3m1a h GLN 212 CO -0.28 0.74 0.01 1.25 -0.95 0.00 0.00 178.83 179.59 3m1a h LEU 213 N 1.00 0.35 -0.46 1.46 7.12 -0.67 -0.94 115.31 123.17 3m1a h LEU 213 Ca 0.25 -0.30 0.00 0.00 0.13 0.00 0.00 57.88 57.96 3m1a h LEU 213 Cb 0.04 -0.09 0.00 0.00 -0.53 0.00 0.00 40.66 40.08 3m1a h LEU 213 CO -0.04 0.57 0.00 -0.37 -0.13 0.00 0.00 178.44 178.47 3m1a h VAL 214 N 0.12 0.00 0.00 1.05 -1.51 -1.32 -3.22 116.25 111.38 3m1a h VAL 214 Ca 0.06 -0.74 -0.08 0.00 -1.23 0.00 0.00 66.70 64.71 3m1a h VAL 214 Cb 0.38 1.72 -0.01 0.00 -2.13 0.00 0.00 31.29 31.25 3m1a h VAL 214 CO 0.01 0.00 -0.70 1.56 -1.23 0.00 0.00 177.57 177.21 3m1a h GLN 215 N 0.00 0.00 0.00 5.19 4.20 -1.05 -3.52 115.11 119.94 3m1a h GLN 215 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3m1a h GLN 215 Cb 0.78 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.56 3m1a h GLN 215 CO 0.00 0.26 0.00 0.41 -0.67 0.00 0.00 178.83 178.83 3m1a n GLY 216 N 1.23 -0.31 0.00 3.46 0.00 -0.38 -5.07 105.19 104.12 3m1a n GLY 216 Ca -0.01 -1.78 0.00 0.00 0.00 0.00 0.00 46.02 44.23 3m1a n GLY 216 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3m1a n PRO 222 N -0.28 0.00 -4.32 1.61 -0.04 -1.26 -4.80 135.00 125.90 3m1a n PRO 222 Ca 0.00 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.14 3m1a n PRO 222 Cb 0.00 0.00 -0.09 0.00 -0.04 0.00 0.00 33.50 33.37 3m1a n PRO 222 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 3m1a s GLY 223 N 0.00 1.83 -0.49 0.55 0.00 -0.94 -4.96 107.32 103.31 3m1a s GLY 223 Ca 0.00 -1.03 -0.18 0.00 0.00 0.00 0.00 44.72 43.51 3m1a s GLY 223 CO 0.00 -0.92 0.53 -0.35 0.00 0.00 0.00 173.10 172.36 3m1a s ASP 224 N -1.69 6.19 0.43 1.64 3.68 -1.26 -0.31 116.67 125.35 3m1a s ASP 224 Ca 0.20 -1.05 0.13 0.00 2.13 0.00 0.00 52.55 53.96 3m1a s ASP 224 Cb -0.11 -2.25 0.94 0.00 -1.45 0.00 0.00 42.92 40.05 3m1a s ASP 224 CO 0.11 -0.79 1.96 1.55 0.13 0.00 0.00 175.17 178.13 3m1a h PRO 225 N 8.90 0.04 -0.36 4.34 0.13 -1.95 -0.69 132.00 142.41 3m1a h PRO 225 Ca -0.28 -0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 64.84 3m1a h PRO 225 Cb 1.10 -0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.21 3m1a h PRO 225 CO 0.93 0.23 0.22 0.00 -0.23 0.00 0.00 178.00 179.15 3m1a h ALA 226 N 1.77 0.46 -0.44 -0.56 0.00 -1.92 -0.33 119.26 118.23 3m1a h ALA 226 Ca 0.01 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 3m1a h ALA 226 Cb 0.36 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 3m1a h ALA 226 CO 0.03 -0.04 0.17 0.87 0.00 0.00 0.00 179.25 180.28 3m1a h LYS 227 N 0.47 0.63 -0.30 0.00 1.57 -1.80 -1.66 116.57 115.49 3m1a h LYS 227 Ca 0.13 -0.09 -0.03 0.00 -1.87 0.00 0.00 60.65 58.79 3m1a h LYS 227 Cb 0.01 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.19 3m1a h LYS 227 CO -0.02 0.53 0.06 0.00 -0.57 0.00 0.00 179.45 179.45 3m1a h ALA 228 N 1.56 0.39 -0.77 3.86 0.00 -0.73 -1.44 119.26 122.13 3m1a h ALA 228 Ca 0.15 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 3m1a h ALA 228 Cb 0.14 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 3m1a h ALA 228 CO -0.01 0.06 0.35 0.00 0.00 0.00 0.00 179.25 179.65 3m1a h ALA 229 N 0.89 0.99 -0.65 0.00 0.00 -0.85 -1.97 119.26 117.68 3m1a h ALA 229 Ca 0.09 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.84 3m1a h ALA 229 Cb 0.31 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 3m1a h ALA 229 CO 0.00 0.58 0.40 0.00 0.00 0.00 0.00 179.25 180.23 3m1a h ALA 230 N 1.18 1.49 -0.38 0.00 0.00 -1.13 -2.47 119.26 117.94 3m1a h ALA 230 Ca 0.26 -0.06 -0.15 0.00 0.00 0.00 0.00 54.91 54.96 3m1a h ALA 230 Cb 0.15 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 3m1a h ALA 230 CO -0.03 0.45 -0.35 0.00 0.00 0.00 0.00 179.25 179.32 3m1a h ALA 231 N 1.56 0.66 -0.01 0.00 0.00 -0.63 -0.31 119.26 120.53 3m1a h ALA 231 Ca 0.23 -0.44 0.01 0.00 0.00 0.00 0.00 54.91 54.71 3m1a h ALA 231 Cb -0.06 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 3m1a h ALA 231 CO -0.05 0.67 -0.02 0.82 0.00 0.00 0.00 179.25 180.68 3m1a h ILE 232 N 0.74 0.94 -0.83 0.00 2.04 -1.18 -0.17 117.51 119.05 3m1a h ILE 232 Ca 0.07 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.98 3m1a h ILE 232 Cb 0.92 0.94 -0.06 0.00 -0.74 0.00 0.00 36.82 37.89 3m1a h ILE 232 CO 0.09 0.00 0.52 0.03 0.00 0.00 0.00 178.15 178.78 3m1a h ARG 233 N -0.03 0.94 -0.79 2.37 3.08 -1.14 -1.53 114.38 117.28 3m1a h ARG 233 Ca 0.01 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 60.00 3m1a h ARG 233 Cb 0.05 -0.21 -0.04 0.00 0.08 0.00 0.00 29.97 29.85 3m1a h ARG 233 CO -0.03 0.62 0.45 1.25 -1.07 0.00 0.00 179.97 181.20 3m1a h LEU 234 N 0.97 0.97 -0.96 3.04 5.85 -0.79 -0.32 115.31 124.07 3m1a h LEU 234 Ca 0.35 -0.08 -0.09 0.00 0.84 0.00 0.00 57.88 58.89 3m1a h LEU 234 Cb 0.10 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 40.87 3m1a h LEU 234 CO -0.15 0.77 -0.23 0.00 -0.34 0.00 0.00 178.44 178.49 3m1a h ALA 235 N 1.24 1.12 0.00 1.25 0.00 -0.34 -2.49 119.26 120.04 3m1a h ALA 235 Ca 0.28 -0.33 -0.15 0.00 0.00 0.00 0.00 54.91 54.71 3m1a h ALA 235 Cb 0.00 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 3m1a h ALA 235 CO -0.05 0.55 -0.71 -0.07 0.00 0.00 0.00 179.25 178.97 3m1a h LEU 236 N 0.43 0.00 0.00 0.00 3.38 -0.99 -3.10 115.31 115.03 3m1a h LEU 236 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 3m1a h LEU 236 Cb 0.64 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.39 3m1a h LEU 236 CO 0.05 0.71 0.00 -0.67 0.09 0.00 0.00 178.44 178.61 3m1a n ASP 237 N -3.40 0.00 -4.72 -0.43 2.03 -0.16 -4.79 116.55 105.08 3m1a n ASP 237 Ca 0.00 0.18 -0.39 0.00 0.52 0.00 0.00 54.79 55.10 3m1a n ASP 237 Cb 0.77 -0.39 -0.05 0.00 -0.72 0.00 0.00 41.12 40.74 3m1a n ASP 237 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 3m1a s THR 238 N -2.78 5.01 0.18 5.18 2.01 -0.99 -4.98 115.64 119.29 3m1a s THR 238 Ca 0.20 1.41 -0.25 0.00 0.31 0.00 0.00 61.69 63.36 3m1a s THR 238 Cb 0.18 -4.02 0.06 0.00 0.01 0.00 0.00 72.50 68.73 3m1a s THR 238 CO 0.46 0.28 1.55 -0.08 -0.69 0.00 0.00 174.62 176.15 3m1a h GLU 239 N 6.54 -0.09 -4.13 4.92 4.81 -1.88 -3.00 114.58 121.75 3m1a h GLU 239 Ca -0.42 0.01 -0.76 0.00 -0.13 0.00 0.00 59.36 58.06 3m1a h GLU 239 Cb 1.20 0.02 -0.24 0.00 0.63 0.00 0.00 28.75 30.36 3m1a h GLU 239 CO 0.74 -0.06 0.17 0.15 -0.73 0.00 0.00 179.01 179.28 3m1a s LYS 240 N -5.76 3.47 -0.04 1.92 1.02 -1.26 -5.05 119.74 114.04 3m1a s LYS 240 Ca -0.13 -2.15 -0.30 0.00 0.02 0.00 0.00 55.97 53.41 3m1a s LYS 240 Cb 0.15 -4.47 -0.05 0.00 -0.52 0.00 0.00 37.83 32.93 3m1a s LYS 240 CO 0.66 -1.39 1.47 0.99 -0.92 0.00 0.00 175.35 176.16 3m1a s THR 241 N 0.98 3.72 0.63 2.17 2.01 -1.13 -5.00 115.64 119.02 3m1a s THR 241 Ca 0.18 1.01 -0.18 0.00 0.31 0.00 0.00 61.69 63.01 3m1a s THR 241 Cb -0.13 -3.65 -0.02 0.00 0.01 0.00 0.00 72.50 68.71 3m1a s THR 241 CO -0.06 -0.04 1.26 -2.16 -0.69 0.00 0.00 174.62 172.92 3m1a s PRO 242 N 3.09 2.69 0.23 4.92 0.04 -1.26 -4.92 135.00 139.80 3m1a s PRO 242 Ca 0.66 1.96 -0.05 0.00 0.04 0.00 0.00 61.00 63.60 3m1a s PRO 242 Cb -0.31 -1.88 0.24 0.00 0.04 0.00 0.00 34.50 32.59 3m1a s PRO 242 CO 0.26 -1.46 1.76 1.25 0.04 0.00 0.00 177.00 178.85 3m1a h LEU 243 N 0.63 0.94 -8.38 -3.56 5.85 -1.94 -3.43 115.31 105.42 3m1a h LEU 243 Ca -0.51 -0.19 -0.60 0.00 0.84 0.00 0.00 57.88 57.42 3m1a h LEU 243 Cb 1.32 -0.25 -0.30 0.00 0.37 0.00 0.00 40.66 41.80 3m1a h LEU 243 CO 0.54 0.92 -0.85 -0.13 -0.34 0.00 0.00 178.44 178.58 3m1a s ARG 244 N -5.24 1.80 -0.37 1.25 0.52 -1.26 -0.20 118.95 115.45 3m1a s ARG 244 Ca -0.11 -0.72 0.01 0.00 -0.52 0.00 0.00 55.73 54.39 3m1a s ARG 244 Cb 0.15 -1.66 0.11 0.00 0.52 0.00 0.00 34.95 34.08 3m1a s ARG 244 CO 0.83 0.38 0.15 -1.17 0.02 0.00 0.00 175.30 175.51 3m1a s LEU 245 N -0.31 2.92 0.36 2.53 2.96 0.60 -4.94 118.68 122.81 3m1a s LEU 245 Ca 0.03 -2.14 -0.28 0.00 -0.22 0.00 0.00 54.13 51.53 3m1a s LEU 245 Cb -0.10 -1.09 -0.11 0.00 0.50 0.00 0.00 46.19 45.40 3m1a s LEU 245 CO 0.01 -0.35 1.44 0.00 -1.32 0.00 0.00 176.35 176.13 3m1a s ALA 246 N 0.97 3.56 -0.10 5.97 0.00 -1.26 -0.74 121.76 130.15 3m1a s ALA 246 Ca 0.13 1.49 -0.01 0.00 0.00 0.00 0.00 51.96 53.58 3m1a s ALA 246 Cb -0.21 -3.58 0.03 0.00 0.00 0.00 0.00 23.12 19.36 3m1a s ALA 246 CO -0.12 -0.94 -0.06 -0.51 0.00 0.00 0.00 175.76 174.13 3m1a s LEU 247 N -1.98 1.06 0.00 0.00 1.43 -0.60 -4.86 118.68 113.73 3m1a s LEU 247 Ca 0.52 -0.25 0.00 0.00 -1.03 0.00 0.00 54.13 53.37 3m1a s LEU 247 Cb -0.45 -0.75 0.00 0.00 0.03 0.00 0.00 46.19 45.03 3m1a s LEU 247 CO 0.60 -0.13 0.00 0.61 0.23 0.00 0.00 176.35 177.66 3m1a n GLY 248 N 4.94 2.30 0.31 -3.19 0.00 -1.26 -0.84 105.19 107.46 3m1a n GLY 248 Ca -0.12 -1.63 -0.01 0.00 0.00 0.00 0.00 46.02 44.26 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 1.20 0.69 -0.02 0.00 -1.97 -2.15 103.07 100.82 3m1a h GLY 249 Ca 0.00 -0.38 0.05 0.00 0.00 0.00 0.00 47.33 47.00 3m1a h GLY 249 CO 0.00 0.29 0.32 1.29 0.00 0.00 0.00 176.54 178.44 3m1a h ASP 250 N 0.97 0.46 0.08 0.19 2.03 -1.98 -0.68 116.42 117.49 3m1a h ASP 250 Ca 0.34 0.03 0.01 0.00 -0.73 0.00 0.00 57.03 56.68 3m1a h ASP 250 Cb 0.08 -0.06 -0.01 0.00 -0.83 0.00 0.00 39.33 38.51 3m1a h ASP 250 CO -0.14 0.31 -0.11 0.00 -1.03 0.00 0.00 179.24 178.27 3m1a h ALA 251 N 1.32 -0.19 -0.59 4.15 0.00 -1.69 -1.39 119.26 120.87 3m1a h ALA 251 Ca 0.27 -0.02 0.11 0.00 0.00 0.00 0.00 54.91 55.26 3m1a h ALA 251 Cb 0.17 0.16 -0.08 0.00 0.00 0.00 0.00 17.79 18.04 3m1a h ALA 251 CO -0.17 -0.63 0.14 0.28 0.00 0.00 0.00 179.25 178.87 3m1a h VAL 252 N -0.23 0.67 -0.19 0.00 2.07 -1.01 -0.74 116.25 116.83 3m1a h VAL 252 Ca 0.01 -0.10 -0.02 0.00 0.82 0.00 0.00 66.70 67.42 3m1a h VAL 252 Cb 0.23 0.37 -0.01 0.00 -1.52 0.00 0.00 31.29 30.36 3m1a h VAL 252 CO -0.05 0.05 0.04 0.44 0.02 0.00 0.00 177.57 178.07 3m1a h ASP 253 N 0.28 0.29 -0.30 0.57 3.32 -0.91 -0.23 116.42 119.44 3m1a h ASP 253 Ca 0.30 -0.25 0.05 0.00 0.02 0.00 0.00 57.03 57.16 3m1a h ASP 253 Cb 0.43 -0.08 -0.05 0.00 0.22 0.00 0.00 39.33 39.86 3m1a h ASP 253 CO -0.37 0.46 -0.02 -0.26 -1.72 0.00 0.00 179.24 177.33 3m1a h PHE 254 N 0.11 -0.05 -0.56 4.55 0.04 -0.97 -0.82 116.94 119.24 3m1a h PHE 254 Ca 0.06 0.02 -0.04 0.00 2.80 0.00 0.00 57.97 60.81 3m1a h PHE 254 Cb 0.29 0.07 -0.02 0.00 2.20 0.00 0.00 35.95 38.48 3m1a h PHE 254 CO 0.01 -0.07 0.19 -0.07 -0.60 0.00 0.00 178.31 177.78 3m1a h LEU 255 N 0.07 0.80 -0.76 1.54 3.38 -0.87 -1.86 115.31 117.62 3m1a h LEU 255 Ca 0.15 -0.20 -0.10 0.00 0.09 0.00 0.00 57.88 57.82 3m1a h LEU 255 Cb 0.20 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 3m1a h LEU 255 CO -0.26 0.79 -0.12 0.71 0.09 0.00 0.00 178.44 179.65 3m1a h THR 256 N 0.78 1.26 -0.30 0.22 1.35 -0.86 -1.24 112.91 114.13 3m1a h THR 256 Ca 0.18 -1.20 -0.00 0.00 -0.55 0.00 0.00 66.41 64.84 3m1a h THR 256 Cb 0.26 1.04 -0.01 0.00 -1.73 0.00 0.00 68.15 67.70 3m1a h THR 256 CO -0.01 0.41 0.18 1.23 -0.25 0.00 0.00 175.52 177.09 3m1a h GLY 257 N 0.97 0.43 0.91 5.82 0.00 -0.77 -0.94 103.07 109.48 3m1a h GLY 257 Ca 0.12 -0.17 -0.05 0.00 0.00 0.00 0.00 47.33 47.23 3m1a h GLY 257 CO 0.04 0.17 0.03 0.84 0.00 0.00 0.00 176.54 177.62 3m1a h HIS 258 N 0.38 0.63 -0.38 5.60 6.17 -1.23 -1.71 115.15 124.60 3m1a h HIS 258 Ca 0.11 -0.10 0.08 0.00 0.71 0.00 0.00 60.37 61.17 3m1a h HIS 258 Cb -0.00 -0.17 -0.08 0.00 2.52 0.00 0.00 27.41 29.68 3m1a h HIS 258 CO -0.05 0.67 -0.12 -0.07 0.71 0.00 0.00 177.93 179.07 3m1a h LEU 259 N 0.40 -0.44 -0.49 0.26 3.38 -1.13 0.53 115.31 117.83 3m1a h LEU 259 Ca 0.10 0.13 0.06 0.00 0.09 0.00 0.00 57.88 58.26 3m1a h LEU 259 Cb 0.41 0.27 -0.05 0.00 0.09 0.00 0.00 40.66 41.37 3m1a h LEU 259 CO 0.01 -0.16 0.19 0.44 0.09 0.00 0.00 178.44 179.01 3m1a h ASP 260 N -0.04 0.20 0.33 -0.43 3.32 -1.05 -0.88 116.42 117.87 3m1a h ASP 260 Ca 0.19 0.05 -0.24 0.00 0.02 0.00 0.00 57.03 57.05 3m1a h ASP 260 Cb 0.33 0.03 0.01 0.00 0.22 0.00 0.00 39.33 39.91 3m1a h ASP 260 CO -0.42 0.15 -1.00 0.77 -1.72 0.00 0.00 179.24 177.02 3m1a h SER 261 N 0.37 0.57 -0.70 6.45 4.64 -1.01 -0.62 113.55 123.25 3m1a h SER 261 Ca 0.23 -0.48 -0.07 0.00 -0.47 0.00 0.00 61.79 61.01 3m1a h SER 261 Cb 0.23 -0.18 -0.03 0.00 -0.31 0.00 0.00 62.40 62.11 3m1a h SER 261 CO -0.23 1.29 0.18 0.58 -0.87 0.00 0.00 176.83 177.78 3m1a h VAL 262 N 0.23 1.26 -0.40 0.95 2.07 -0.84 -1.96 116.25 117.57 3m1a h VAL 262 Ca -0.10 -0.95 -0.13 0.00 0.82 0.00 0.00 66.70 66.34 3m1a h VAL 262 Cb 1.65 0.53 -0.01 0.00 -1.52 0.00 0.00 31.29 31.94 3m1a h VAL 262 CO 0.18 0.37 -0.25 -0.09 0.02 0.00 0.00 177.57 177.80 3m1a h ARG 263 N 1.06 0.87 -0.59 1.57 2.43 -1.02 -1.16 114.38 117.55 3m1a h ARG 263 Ca 0.22 -0.40 -0.01 0.00 -0.81 0.00 0.00 59.98 58.97 3m1a h ARG 263 Cb 0.36 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.87 3m1a h ARG 263 CO 0.00 1.05 0.31 0.00 -1.51 0.00 0.00 179.97 179.82 3m1a h ALA 264 N 0.80 0.75 -0.19 2.80 0.00 -1.03 -2.00 119.26 120.39 3m1a h ALA 264 Ca 0.08 -0.11 -0.18 0.00 0.00 0.00 0.00 54.91 54.70 3m1a h ALA 264 Cb 0.82 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 3m1a h ALA 264 CO 0.07 0.28 -0.61 1.49 0.00 0.00 0.00 179.25 180.48 3m1a h GLU 265 N 0.79 0.66 -0.67 0.00 4.81 -1.25 -0.92 114.58 118.00 3m1a h GLU 265 Ca 0.20 -0.45 0.04 0.00 -0.13 0.00 0.00 59.36 59.03 3m1a h GLU 265 Cb 0.07 0.07 -0.05 0.00 0.63 0.00 0.00 28.75 29.47 3m1a h GLU 265 CO -0.03 1.07 0.39 1.25 -0.73 0.00 0.00 179.01 180.96 3m1a h LEU 266 N 0.49 0.62 -0.16 1.64 5.85 -1.02 -2.61 115.31 120.13 3m1a h LEU 266 Ca -0.00 0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.66 3m1a h LEU 266 Cb 1.19 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 42.10 3m1a h LEU 266 CO 0.12 0.42 -0.17 0.74 -0.34 0.00 0.00 178.44 179.21 3m1a h THR 267 N 0.75 1.35 -0.78 1.05 2.02 -1.15 -0.88 112.91 115.27 3m1a h THR 267 Ca 0.28 -1.34 0.13 0.00 0.77 0.00 0.00 66.41 66.26 3m1a h THR 267 Cb 0.09 1.87 -0.09 0.00 -1.74 0.00 0.00 68.15 68.28 3m1a h THR 267 CO -0.14 0.40 0.36 -0.08 0.37 0.00 0.00 175.52 176.43 3m1a h GLU 268 N 0.02 0.52 -0.33 6.66 4.81 -1.10 -2.46 114.58 122.71 3m1a h GLU 268 Ca 0.02 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 3m1a h GLU 268 Cb 0.71 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.97 3m1a h GLU 268 CO 0.04 0.35 0.00 0.91 -0.73 0.00 0.00 179.01 179.58 3m1a n TRP 269 N -4.93 0.42 -0.23 0.92 7.02 -0.99 -4.63 117.44 115.03 3m1a n TRP 269 Ca 0.15 -0.21 -0.01 0.00 -1.02 0.00 0.00 57.50 56.40 3m1a n TRP 269 Cb 0.39 0.00 0.10 0.00 -2.42 0.00 0.00 31.31 29.39 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 4.21 0.64 -0.65 -0.99 4.81 -0.65 -0.13 114.58 121.82 3m1a h GLU 270 Ca 0.00 -0.04 0.03 0.00 -0.13 0.00 0.00 59.36 59.23 3m1a h GLU 270 Cb 0.92 -0.15 -0.04 0.00 0.63 0.00 0.00 28.75 30.12 3m1a h GLU 270 CO 0.00 0.43 0.40 0.87 -0.73 0.00 0.00 179.01 179.97 3m1a h LYS 271 N 0.66 0.75 -0.20 1.92 1.57 -1.82 0.13 116.57 119.59 3m1a h LYS 271 Ca 0.30 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 59.03 3m1a h LYS 271 Cb 0.22 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.35 3m1a h LYS 271 CO -0.20 0.49 0.09 0.28 -0.57 0.00 0.00 179.45 179.55 3m1a h VAL 272 N 0.77 1.14 -0.71 0.50 2.07 -1.73 -2.59 116.25 115.70 3m1a h VAL 272 Ca 0.27 -0.41 0.11 0.00 0.82 0.00 0.00 66.70 67.49 3m1a h VAL 272 Cb 0.05 1.05 -0.08 0.00 -1.52 0.00 0.00 31.29 30.79 3m1a h VAL 272 CO -0.12 0.14 0.32 0.28 0.02 0.00 0.00 177.57 178.20 3m1a h SER 273 N 0.18 0.36 1.40 0.57 0.02 -0.18 -2.22 113.55 113.69 3m1a h SER 273 Ca 0.07 0.08 0.00 0.00 -0.84 0.00 0.00 61.79 61.10 3m1a h SER 273 Cb 0.13 0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.70 3m1a h SER 273 CO -0.01 0.19 0.00 0.03 -1.14 0.00 0.00 176.83 175.90 3m1a h ARG 274 N 0.51 0.00 -0.30 3.45 3.08 -0.70 -3.32 114.38 117.10 3m1a h ARG 274 Ca 0.37 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.42 3m1a h ARG 274 Cb 0.46 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.51 3m1a h ARG 274 CO -0.32 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 178.99 3m1a n GLY 275 N 1.06 0.44 0.59 0.04 0.00 -0.83 -3.96 105.19 102.51 3m1a n GLY 275 Ca 0.05 -0.34 0.13 0.00 0.00 0.00 0.00 46.02 45.86 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 0.40 0.09 -1.76 2.61 -2.24 -1.25 -4.95 114.28 107.17 3m1a n THR 276 Ca 0.11 -0.33 -0.42 0.00 -2.27 0.00 0.00 64.05 61.14 3m1a n THR 276 Cb 0.26 0.60 -0.02 0.00 -2.10 0.00 0.00 70.33 69.07 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 -1.85 6.37 0.00 3.42 1.01 -1.25 -5.22 116.67 119.15 3m1a s ASP 277 Ca 0.35 2.92 0.15 0.00 0.71 0.00 0.00 52.55 56.68 3m1a s ASP 277 Cb 0.20 -2.62 0.88 0.00 1.01 0.00 0.00 42.92 42.39 3m1a s ASP 277 CO 0.31 -0.94 1.30 0.33 0.21 0.00 0.00 175.17 176.38