#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d8t s MET 1 N 0.00 4.49 -0.53 -0.78 1.00 -1.26 -4.81 119.30 117.40 3d8t s MET 1 Ca 0.00 1.22 -0.21 0.00 0.00 0.00 0.00 55.69 56.70 3d8t s MET 1 Cb 0.00 -3.47 0.05 0.00 0.00 0.00 0.00 34.83 31.41 3d8t s MET 1 CO 0.00 -0.06 0.78 1.03 0.00 0.00 0.00 175.02 176.76 3d8t s ARG 2 N 1.14 3.21 -0.26 2.03 0.52 -1.26 -0.52 118.95 123.81 3d8t s ARG 2 Ca 0.46 -0.62 -0.07 0.00 -0.52 0.00 0.00 55.73 54.98 3d8t s ARG 2 Cb -0.19 -4.08 -0.02 0.00 0.52 0.00 0.00 34.95 31.17 3d8t s ARG 2 CO 0.23 -1.36 0.08 0.42 0.02 0.00 0.00 175.30 174.68 3d8t s ILE 3 N 3.26 4.22 0.22 1.52 1.01 -0.05 -0.58 121.20 130.81 3d8t s ILE 3 Ca 0.22 -0.32 -0.15 0.00 0.00 0.00 0.00 60.65 60.40 3d8t s ILE 3 Cb -0.16 -3.03 -0.08 0.00 0.01 0.00 0.00 42.46 39.20 3d8t s ILE 3 CO 0.15 0.26 0.63 0.00 0.00 0.00 0.00 174.94 175.98 3d8t s ALA 4 N 1.58 3.48 -0.15 9.38 0.00 0.61 -0.66 121.76 136.02 3d8t s ALA 4 Ca 0.05 -0.05 0.02 0.00 0.00 0.00 0.00 51.96 51.98 3d8t s ALA 4 Cb -0.16 -2.63 0.02 0.00 0.00 0.00 0.00 23.12 20.35 3d8t s ALA 4 CO 0.03 0.41 -0.19 -0.47 0.00 0.00 0.00 175.76 175.54 3d8t s TYR 5 N -1.66 2.48 -2.62 0.00 6.14 0.58 -0.44 117.35 121.83 3d8t s TYR 5 Ca 0.44 -1.32 0.25 0.00 0.64 0.00 0.00 57.07 57.08 3d8t s TYR 5 Cb -0.14 -1.73 0.39 0.00 0.42 0.00 0.00 41.96 40.91 3d8t s TYR 5 CO 0.20 -0.65 1.36 0.00 0.64 0.00 0.00 175.55 177.10 3d8t n ALA 6 N 4.35 2.73 -1.60 3.97 0.00 -0.69 -0.96 120.51 128.31 3d8t n ALA 6 Ca -0.20 -0.60 -0.29 0.00 0.00 0.00 0.00 53.44 52.35 3d8t n ALA 6 Cb 0.51 -0.91 0.12 0.00 0.00 0.00 0.00 19.45 19.17 3d8t n ALA 6 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3d8t s GLY 7 N -2.12 1.58 -0.24 0.00 0.00 -1.26 -2.14 107.32 103.13 3d8t s GLY 7 Ca 0.28 -0.53 -0.07 0.00 0.00 0.00 0.00 44.72 44.41 3d8t s GLY 7 CO 0.37 0.01 -0.27 -0.10 0.00 0.00 0.00 173.10 173.11 3d8t n LEU 8 N -3.66 2.21 -4.98 0.66 7.94 -1.26 -4.40 117.00 113.50 3d8t n LEU 8 Ca 0.07 0.13 -0.20 0.00 -1.11 0.00 0.00 56.01 54.90 3d8t n LEU 8 Cb 0.59 -0.75 0.02 0.00 0.53 0.00 0.00 43.42 43.81 3d8t n LEU 8 CO 0.57 0.65 0.22 -0.13 -1.11 0.00 0.00 177.39 177.60 3d8t s ARG 9 N -2.45 2.85 -1.48 1.96 0.52 -1.26 -4.60 118.95 114.49 3d8t s ARG 9 Ca -0.33 -0.90 0.00 0.00 -0.52 0.00 0.00 55.73 53.98 3d8t s ARG 9 Cb 0.11 -2.65 0.00 0.00 0.52 0.00 0.00 34.95 32.93 3d8t s ARG 9 CO 0.47 -0.34 0.00 0.54 0.02 0.00 0.00 175.30 175.99 3d8t n ARG 10 N -2.00 -1.16 -0.21 3.54 1.74 -1.26 -4.93 116.66 112.38 3d8t n ARG 10 Ca 0.05 0.89 -0.06 0.00 -0.77 0.00 0.00 57.85 57.97 3d8t n ARG 10 Cb 0.59 -5.16 0.04 0.00 -1.02 0.00 0.00 32.46 26.91 3d8t n ARG 10 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 3d8t h LYS 11 N 0.00 0.79 -0.26 5.56 1.57 -1.93 0.37 116.57 122.67 3d8t h LYS 11 Ca -0.34 -0.05 -0.08 0.00 -1.87 0.00 0.00 60.65 58.31 3d8t h LYS 11 Cb 1.14 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 33.27 3d8t h LYS 11 CO 0.45 0.52 -0.14 0.93 -0.57 0.00 0.00 179.45 180.64 3d8t h GLU 12 N 0.82 0.56 -0.15 3.15 4.39 -1.97 -1.98 114.58 119.40 3d8t h GLU 12 Ca 0.22 -0.25 0.04 0.00 0.34 0.00 0.00 59.36 59.71 3d8t h GLU 12 Cb -0.09 -0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 28.52 3d8t h GLU 12 CO -0.05 0.82 -0.07 1.49 -1.16 0.00 0.00 179.01 180.03 3d8t h GLU 13 N 0.29 -0.06 -0.17 2.33 4.81 -1.94 -0.64 114.58 119.20 3d8t h GLU 13 Ca 0.06 0.00 0.05 0.00 -0.13 0.00 0.00 59.36 59.34 3d8t h GLU 13 Cb 0.66 0.01 -0.07 0.00 0.63 0.00 0.00 28.75 29.99 3d8t h GLU 13 CO 0.04 -0.04 -0.39 0.35 -0.73 0.00 0.00 179.01 178.24 3d8t h PHE 14 N -0.06 -1.11 -0.56 0.92 3.57 -0.84 0.23 116.94 119.09 3d8t h PHE 14 Ca 0.08 0.05 0.04 0.00 3.53 0.00 0.00 57.97 61.67 3d8t h PHE 14 Cb 0.19 0.51 -0.04 0.00 2.79 0.00 0.00 35.95 39.40 3d8t h PHE 14 CO -0.21 -0.45 0.32 0.87 -2.23 0.00 0.00 178.31 176.60 3d8t h LYS 15 N -0.44 0.60 -0.02 1.11 1.57 -1.19 0.75 116.57 118.94 3d8t h LYS 15 Ca 0.09 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.84 3d8t h LYS 15 Cb 0.60 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.77 3d8t h LYS 15 CO -0.41 0.39 0.01 0.00 -0.57 0.00 0.00 179.45 178.88 3d8t h ALA 16 N 1.27 0.03 0.02 3.86 0.00 -0.69 -0.20 119.26 123.56 3d8t h ALA 16 Ca 0.24 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 3d8t h ALA 16 Cb 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3d8t h ALA 16 CO -0.13 -0.45 -0.01 -0.07 0.00 0.00 0.00 179.25 178.59 3d8t h LEU 17 N -0.00 -0.02 -0.70 0.00 3.38 -0.29 -2.20 115.31 115.47 3d8t h LEU 17 Ca 0.01 -0.06 0.03 0.00 0.09 0.00 0.00 57.88 57.95 3d8t h LEU 17 Cb 0.03 0.01 -0.04 0.00 0.09 0.00 0.00 40.66 40.74 3d8t h LEU 17 CO -0.00 0.04 0.44 0.00 0.09 0.00 0.00 178.44 179.01 3d8t h ALA 18 N 0.90 0.92 -0.46 1.53 0.00 -0.75 -2.29 119.26 119.11 3d8t h ALA 18 Ca -0.00 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 3d8t h ALA 18 Cb 0.08 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 3d8t h ALA 18 CO 0.00 0.21 -0.05 0.93 0.00 0.00 0.00 179.25 180.34 3d8t h GLU 19 N 0.85 0.86 0.00 0.00 5.08 -0.95 0.64 114.58 121.06 3d8t h GLU 19 Ca 0.29 -0.30 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 3d8t h GLU 19 Cb 0.03 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.22 3d8t h GLU 19 CO -0.11 0.93 -0.08 -0.22 -1.00 0.00 0.00 179.01 178.53 3d8t h LYS 20 N 0.70 0.00 -0.40 2.33 3.64 -1.04 -2.08 116.57 119.72 3d8t h LYS 20 Ca 0.12 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 3d8t h LYS 20 Cb 0.58 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.40 3d8t h LYS 20 CO 0.03 0.08 0.00 1.28 -2.27 0.00 0.00 179.45 178.57 3d8t n LEU 21 N -3.77 2.89 0.00 5.20 4.77 -0.89 -4.94 117.00 120.25 3d8t n LEU 21 Ca -0.02 -1.31 0.00 0.00 -0.03 0.00 0.00 56.01 54.64 3d8t n LEU 21 Cb 0.18 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 41.00 3d8t n LEU 21 CO 0.29 0.66 0.00 0.61 -1.33 0.00 0.00 177.39 177.62 3d8t n GLY 22 N 1.38 0.71 3.95 -0.72 0.00 -0.78 -5.06 105.19 104.66 3d8t n GLY 22 Ca 0.19 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.97 3d8t n GLY 22 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3d8t s PHE 23 N -2.22 3.48 -0.39 1.61 2.99 0.19 -4.38 117.98 119.26 3d8t s PHE 23 Ca 0.00 0.29 -0.12 0.00 0.00 0.00 0.00 56.93 57.10 3d8t s PHE 23 Cb 0.00 -1.86 0.03 0.00 0.00 0.00 0.00 43.02 41.19 3d8t s PHE 23 CO 0.00 0.15 0.24 0.99 -0.00 0.00 0.00 175.22 176.60 3d8t s THR 24 N -2.28 4.73 0.12 0.64 2.01 0.32 -3.79 115.64 117.41 3d8t s THR 24 Ca 0.39 -0.86 -0.30 0.00 0.31 0.00 0.00 61.69 61.23 3d8t s THR 24 Cb -0.09 -3.67 -0.06 0.00 0.01 0.00 0.00 72.50 68.69 3d8t s THR 24 CO 0.35 -0.29 0.99 -2.16 -0.69 0.00 0.00 174.62 172.83 3d8t s PRO 25 N 1.58 4.67 -0.02 4.92 0.04 -1.26 -0.87 135.00 144.06 3d8t s PRO 25 Ca 0.03 1.51 0.07 0.00 0.04 0.00 0.00 61.00 62.64 3d8t s PRO 25 Cb -0.20 -3.36 -0.02 0.00 0.04 0.00 0.00 34.50 30.97 3d8t s PRO 25 CO 0.07 0.18 -0.22 -0.51 0.04 0.00 0.00 177.00 176.55 3d8t s LEU 26 N -0.04 2.04 -0.30 -3.56 1.43 0.17 -4.92 118.68 113.49 3d8t s LEU 26 Ca 0.48 -0.41 -0.06 0.00 -1.03 0.00 0.00 54.13 53.10 3d8t s LEU 26 Cb -0.25 -1.17 0.02 0.00 0.03 0.00 0.00 46.19 44.82 3d8t s LEU 26 CO 0.31 0.27 0.07 -0.76 0.23 0.00 0.00 176.35 176.47 3d8t s LEU 27 N -0.45 3.88 -0.43 1.79 1.43 -1.26 -0.31 118.68 123.33 3d8t s LEU 27 Ca 0.06 -0.80 0.07 0.00 -1.03 0.00 0.00 54.13 52.44 3d8t s LEU 27 Cb -0.09 -1.86 0.23 0.00 0.03 0.00 0.00 46.19 44.49 3d8t s LEU 27 CO -0.00 -0.21 0.50 0.49 0.23 0.00 0.00 176.35 177.36 3d8t n PHE 28 N 4.84 -0.03 -1.96 0.29 3.01 -0.14 -4.93 117.46 118.55 3d8t n PHE 28 Ca -0.14 -3.58 -0.40 0.00 1.01 0.00 0.00 57.45 54.34 3d8t n PHE 28 Cb 0.47 -0.24 -0.00 0.00 -0.01 0.00 0.00 39.48 39.71 3d8t n PHE 28 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 3d8t s PRO 29 N -1.02 3.96 -0.00 -1.08 0.04 -1.24 -4.04 135.00 131.61 3d8t s PRO 29 Ca 0.35 2.29 0.05 0.00 0.04 0.00 0.00 61.00 63.73 3d8t s PRO 29 Cb 0.13 -2.80 -0.06 0.00 0.04 0.00 0.00 34.50 31.82 3d8t s PRO 29 CO -0.12 -0.55 0.21 1.33 0.04 0.00 0.00 177.00 177.91 3d8t n VAL 30 N 0.17 0.00 -4.39 -0.36 0.24 -0.91 -4.25 118.33 108.83 3d8t n VAL 30 Ca 0.03 -0.38 -0.34 0.00 -2.04 0.00 0.00 64.34 61.62 3d8t n VAL 30 Cb 0.42 0.99 -0.13 0.00 -1.47 0.00 0.00 33.84 33.65 3d8t n VAL 30 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 3d8t s GLN 31 N -1.50 3.54 -0.11 7.34 0.74 -1.26 -0.04 119.66 128.38 3d8t s GLN 31 Ca 0.02 -0.58 0.01 0.00 0.05 0.00 0.00 55.36 54.86 3d8t s GLN 31 Cb 0.04 -2.87 -0.25 0.00 1.10 0.00 0.00 33.01 31.03 3d8t s GLN 31 CO 0.21 0.14 0.41 0.00 -0.55 0.00 0.00 175.29 175.50 3d8t n ALA 32 N 3.80 1.13 -2.20 1.58 0.00 -0.19 -4.60 120.51 120.02 3d8t n ALA 32 Ca -0.18 -0.70 -0.12 0.00 0.00 0.00 0.00 53.44 52.45 3d8t n ALA 32 Cb 0.52 -0.68 -0.10 0.00 0.00 0.00 0.00 19.45 19.19 3d8t n ALA 32 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3d8t s THR 33 N -2.57 0.51 -0.04 0.00 -4.23 -1.17 -4.98 115.64 103.17 3d8t s THR 33 Ca -0.17 -1.95 -0.01 0.00 -1.18 0.00 0.00 61.69 58.38 3d8t s THR 33 Cb 0.07 -2.00 0.03 0.00 1.34 0.00 0.00 72.50 71.94 3d8t s THR 33 CO 0.78 -0.56 0.03 -0.70 -0.54 0.00 0.00 174.62 173.63 3d8t s GLU 34 N -3.94 0.10 -1.18 3.99 2.12 -1.26 -3.82 118.70 114.71 3d8t s GLU 34 Ca 0.21 0.25 -0.30 0.00 0.36 0.00 0.00 54.97 55.49 3d8t s GLU 34 Cb 0.06 -0.52 0.03 0.00 0.26 0.00 0.00 34.13 33.96 3d8t s GLU 34 CO 0.01 -0.26 0.72 1.17 -0.54 0.00 0.00 175.26 176.36 3d8t n LYS 35 N 4.84 -0.58 -3.40 4.30 4.81 -1.24 -4.93 118.16 121.97 3d8t n LYS 35 Ca -0.13 0.22 -0.39 0.00 -0.87 0.00 0.00 58.31 57.14 3d8t n LYS 35 Cb 0.50 -3.01 -0.09 0.00 0.02 0.00 0.00 35.03 32.45 3d8t n LYS 35 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 3d8t s VAL 36 N -3.49 5.17 0.36 3.15 1.01 -0.94 -4.86 120.40 120.81 3d8t s VAL 36 Ca 0.47 0.44 -0.25 0.00 0.00 0.00 0.00 61.98 62.64 3d8t s VAL 36 Cb -0.23 -3.72 -0.13 0.00 0.00 0.00 0.00 36.38 32.30 3d8t s VAL 36 CO 0.94 0.10 0.82 -2.65 0.00 0.00 0.00 175.10 174.31 3d8t n PRO 37 N 5.34 0.99 -3.26 2.72 -0.02 -1.26 -1.19 135.00 138.32 3d8t n PRO 37 Ca -0.09 0.35 -0.43 0.00 -2.02 0.00 0.00 63.50 61.31 3d8t n PRO 37 Cb 0.50 -1.72 -0.08 0.00 -0.02 0.00 0.00 33.50 32.19 3d8t n PRO 37 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3d8t s VAL 38 N -1.25 5.02 0.40 -1.45 1.01 0.41 -4.77 120.40 119.77 3d8t s VAL 38 Ca 0.62 -0.38 0.06 0.00 0.00 0.00 0.00 61.98 62.29 3d8t s VAL 38 Cb -0.65 -4.13 0.27 0.00 0.00 0.00 0.00 36.38 31.88 3d8t s VAL 38 CO 0.58 -0.55 2.04 -0.65 0.00 0.00 0.00 175.10 176.52 3d8t h PRO 39 N 8.81 0.61 -0.19 2.72 0.11 -1.91 -2.22 132.00 139.92 3d8t h PRO 39 Ca -0.27 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.81 3d8t h PRO 39 Cb 1.10 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.08 3d8t h PRO 39 CO 0.85 0.40 0.00 -1.91 -0.21 0.00 0.00 178.00 177.14 3d8t n GLU 40 N -4.47 1.47 -0.01 1.05 2.13 -1.26 -4.39 120.64 115.17 3d8t n GLU 40 Ca 0.05 -0.72 -0.11 0.00 0.66 0.00 0.00 57.16 57.04 3d8t n GLU 40 Cb 0.09 -1.19 -0.06 0.00 0.27 0.00 0.00 31.44 30.56 3d8t n GLU 40 CO 0.00 0.00 0.00 -0.92 -0.41 0.00 0.00 177.13 175.80 3d8t h TYR 41 N 1.21 0.14 -0.83 4.31 -0.00 -1.70 -1.31 116.97 118.78 3d8t h TYR 41 Ca 0.00 -0.00 0.12 0.00 -0.00 0.00 0.00 58.73 58.85 3d8t h TYR 41 Cb 0.27 -0.04 -0.08 0.00 -0.00 0.00 0.00 36.73 36.88 3d8t h TYR 41 CO 0.13 0.14 0.45 0.00 -0.00 0.00 0.00 178.16 178.87 3d8t h ARG 42 N 0.09 0.67 0.00 1.82 3.08 -1.83 -0.38 114.38 117.84 3d8t h ARG 42 Ca 0.04 -0.04 -0.09 0.00 0.07 0.00 0.00 59.98 59.96 3d8t h ARG 42 Cb 0.04 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 29.93 3d8t h ARG 42 CO -0.01 0.45 -0.43 -0.44 -1.07 0.00 0.00 179.97 178.47 3d8t h ASP 43 N 0.70 0.00 -0.17 7.04 3.32 -1.78 -1.04 116.42 124.48 3d8t h ASP 43 Ca 0.43 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 57.32 3d8t h ASP 43 Cb 0.52 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.07 3d8t h ASP 43 CO -0.31 0.43 -0.48 1.56 -1.72 0.00 0.00 179.24 178.72 3d8t h GLN 44 N 0.00 0.74 -0.53 3.56 4.20 0.04 -1.52 115.11 121.60 3d8t h GLN 44 Ca -0.00 -0.43 -0.04 0.00 0.06 0.00 0.00 58.65 58.24 3d8t h GLN 44 Cb 0.79 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.58 3d8t h GLN 44 CO 0.06 1.05 0.16 0.28 -0.67 0.00 0.00 178.83 179.71 3d8t h VAL 45 N 0.58 1.23 -0.95 -0.54 2.07 -0.93 -0.85 116.25 116.87 3d8t h VAL 45 Ca 0.03 -0.80 0.12 0.00 0.82 0.00 0.00 66.70 66.88 3d8t h VAL 45 Cb 1.04 0.75 -0.08 0.00 -1.52 0.00 0.00 31.29 31.48 3d8t h VAL 45 CO 0.10 0.29 0.58 0.03 0.02 0.00 0.00 177.57 178.59 3d8t h ARG 46 N 0.73 0.87 -0.50 1.57 3.08 -1.15 -1.98 114.38 117.01 3d8t h ARG 46 Ca 0.17 -0.05 -0.11 0.00 0.07 0.00 0.00 59.98 60.06 3d8t h ARG 46 Cb 0.29 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 30.12 3d8t h ARG 46 CO -0.00 0.58 -0.12 1.49 -1.07 0.00 0.00 179.97 180.84 3d8t h GLU 47 N 0.90 0.94 -0.57 0.04 4.81 -0.68 -2.79 114.58 117.23 3d8t h GLU 47 Ca 0.48 -0.34 0.07 0.00 -0.13 0.00 0.00 59.36 59.44 3d8t h GLU 47 Cb 0.51 -0.06 -0.06 0.00 0.63 0.00 0.00 28.75 29.76 3d8t h GLU 47 CO -0.28 1.00 0.25 1.25 -0.73 0.00 0.00 179.01 180.51 3d8t h LEU 48 N 0.84 0.32 -1.46 1.64 5.85 -0.58 -1.28 115.31 120.64 3d8t h LEU 48 Ca 0.13 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.90 3d8t h LEU 48 Cb 0.66 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.69 3d8t h LEU 48 CO 0.05 0.21 0.00 0.00 -0.34 0.00 0.00 178.44 178.36 3d8t h ALA 49 N 1.35 1.00 0.00 1.25 0.00 -1.10 -1.44 119.26 120.32 3d8t h ALA 49 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.18 3d8t h ALA 49 Cb 0.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.04 3d8t h ALA 49 CO -0.23 0.00 0.00 1.04 0.00 0.00 0.00 179.25 180.06 3d8t n GLN 50 N -2.29 0.12 0.00 0.00 1.13 -0.48 -4.88 117.38 110.98 3d8t n GLN 50 Ca -0.01 0.16 0.00 0.00 -1.94 0.00 0.00 57.00 55.21 3d8t n GLN 50 Cb 0.05 -1.66 0.00 0.00 0.11 0.00 0.00 30.24 28.74 3d8t n GLN 50 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3d8t n GLY 51 N 1.06 3.53 3.15 1.08 0.00 -0.54 -5.11 105.19 108.36 3d8t n GLY 51 Ca 0.05 -1.44 -0.13 0.00 0.00 0.00 0.00 46.02 44.51 3d8t n GLY 51 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3d8t s VAL 52 N -0.57 0.76 -0.05 1.61 -7.23 -1.26 -4.89 120.40 108.78 3d8t s VAL 52 Ca 0.00 -1.63 0.13 0.00 -1.81 0.00 0.00 61.98 58.67 3d8t s VAL 52 Cb 0.00 -1.32 -0.16 0.00 0.56 0.00 0.00 36.38 35.46 3d8t s VAL 52 CO 0.00 -0.64 0.93 0.44 -0.31 0.00 0.00 175.10 175.52 3d8t h ASP 53 N 3.54 0.00 -4.48 4.85 5.19 -0.88 -3.39 116.42 121.25 3d8t h ASP 53 Ca -0.36 0.00 -0.17 0.00 -0.62 0.00 0.00 57.03 55.88 3d8t h ASP 53 Cb 1.18 0.00 -0.23 0.00 0.18 0.00 0.00 39.33 40.46 3d8t h ASP 53 CO 0.55 0.82 -0.53 -0.22 -3.12 0.00 0.00 179.24 176.73 3d8t s LEU 54 N -6.17 1.57 -0.06 1.55 0.20 -0.72 -1.59 118.68 113.46 3d8t s LEU 54 Ca -0.02 -0.02 0.01 0.00 0.69 0.00 0.00 54.13 54.79 3d8t s LEU 54 Cb 0.09 0.55 0.02 0.00 -0.43 0.00 0.00 46.19 46.42 3d8t s LEU 54 CO 0.81 -0.23 -0.06 0.12 -0.29 0.00 0.00 176.35 176.70 3d8t s PHE 55 N -0.78 0.95 -0.15 5.38 5.36 0.96 -0.43 117.98 129.27 3d8t s PHE 55 Ca -0.09 -0.32 0.02 0.00 -0.96 0.00 0.00 56.93 55.58 3d8t s PHE 55 Cb -0.05 -0.81 0.02 0.00 -0.34 0.00 0.00 43.02 41.83 3d8t s PHE 55 CO 0.01 -0.25 -0.19 -1.17 -1.46 0.00 0.00 175.22 172.16 3d8t s LEU 56 N 1.04 1.96 -0.13 6.12 0.20 0.18 -0.68 118.68 127.36 3d8t s LEU 56 Ca -0.09 -0.56 -0.05 0.00 0.69 0.00 0.00 54.13 54.12 3d8t s LEU 56 Cb -0.14 -1.34 -0.04 0.00 -0.43 0.00 0.00 46.19 44.24 3d8t s LEU 56 CO -0.00 0.02 0.05 0.00 -0.29 0.00 0.00 176.35 176.12 3d8t s ALA 57 N 1.11 3.43 -0.18 5.97 0.00 -0.31 -0.71 121.76 131.07 3d8t s ALA 57 Ca -0.01 -0.75 0.11 0.00 0.00 0.00 0.00 51.96 51.31 3d8t s ALA 57 Cb -0.14 -1.74 -0.19 0.00 0.00 0.00 0.00 23.12 21.05 3d8t s ALA 57 CO -0.07 0.43 -0.02 0.25 0.00 0.00 0.00 175.76 176.35 3d8t n THR 58 N 2.68 1.19 -4.11 0.00 -2.24 -1.21 -0.47 114.28 110.12 3d8t n THR 58 Ca -0.18 -0.64 -0.13 0.00 -2.27 0.00 0.00 64.05 60.82 3d8t n THR 58 Cb 0.53 -0.78 -0.11 0.00 -2.10 0.00 0.00 70.33 67.87 3d8t n THR 58 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3d8t s THR 59 N -2.42 0.68 0.08 4.28 -4.23 -1.26 -4.59 115.64 108.17 3d8t s THR 59 Ca -0.15 -1.38 -0.20 0.00 -1.18 0.00 0.00 61.69 58.78 3d8t s THR 59 Cb 0.06 -1.00 -0.10 0.00 1.34 0.00 0.00 72.50 72.79 3d8t s THR 59 CO 0.64 -0.51 1.56 1.23 -0.54 0.00 0.00 174.62 176.99 3d8t h GLY 60 N 3.99 0.32 0.77 3.99 0.00 -1.87 -2.08 103.07 108.20 3d8t h GLY 60 Ca -0.36 -0.20 0.05 0.00 0.00 0.00 0.00 47.33 46.81 3d8t h GLY 60 CO 0.48 0.19 0.51 -0.39 0.00 0.00 0.00 176.54 177.32 3d8t h VAL 61 N 0.10 1.06 -0.42 4.60 -1.51 -1.97 -1.51 116.25 116.59 3d8t h VAL 61 Ca 0.06 -0.32 -0.07 0.00 -1.23 0.00 0.00 66.70 65.13 3d8t h VAL 61 Cb 0.28 0.03 -0.02 0.00 -2.13 0.00 0.00 31.29 29.46 3d8t h VAL 61 CO 0.00 0.17 -0.03 1.23 -1.23 0.00 0.00 177.57 177.72 3d8t h GLY 62 N 0.95 0.75 0.73 5.19 0.00 -1.90 0.89 103.07 109.68 3d8t h GLY 62 Ca 0.34 -0.50 -0.05 0.00 0.00 0.00 0.00 47.33 47.13 3d8t h GLY 62 CO -0.15 0.46 -0.13 -2.08 0.00 0.00 0.00 176.54 174.64 3d8t h VAL 63 N 0.65 1.35 -0.61 4.60 2.07 -0.86 -1.98 116.25 121.47 3d8t h VAL 63 Ca 0.13 -1.28 -0.01 0.00 0.82 0.00 0.00 66.70 66.36 3d8t h VAL 63 Cb 0.44 1.89 -0.03 0.00 -1.52 0.00 0.00 31.29 32.07 3d8t h VAL 63 CO 0.02 0.37 0.32 0.03 0.02 0.00 0.00 177.57 178.33 3d8t h ARG 64 N -0.05 0.85 -0.38 1.57 3.08 -0.93 -0.95 114.38 117.57 3d8t h ARG 64 Ca 0.02 -0.11 -0.10 0.00 0.07 0.00 0.00 59.98 59.86 3d8t h ARG 64 Cb 0.65 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 30.52 3d8t h ARG 64 CO 0.03 0.66 -0.19 -0.44 -1.07 0.00 0.00 179.97 178.96 3d8t h ASP 65 N 0.82 0.73 -0.32 7.04 3.32 -0.87 -1.33 116.42 125.80 3d8t h ASP 65 Ca 0.21 -0.24 -0.01 0.00 0.02 0.00 0.00 57.03 57.01 3d8t h ASP 65 Cb 0.06 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.40 3d8t h ASP 65 CO -0.03 0.91 0.15 0.25 -1.72 0.00 0.00 179.24 178.81 3d8t h LEU 66 N 0.64 0.43 -0.47 1.55 5.85 -1.02 0.21 115.31 122.50 3d8t h LEU 66 Ca 0.10 -0.13 -0.16 0.00 0.84 0.00 0.00 57.88 58.53 3d8t h LEU 66 Cb 0.68 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 3d8t h LEU 66 CO 0.05 0.43 -0.43 -0.07 -0.34 0.00 0.00 178.44 178.08 3d8t h LEU 67 N 0.39 0.85 -0.65 2.25 3.38 -0.98 -0.70 115.31 119.84 3d8t h LEU 67 Ca 0.11 -0.40 -0.07 0.00 0.09 0.00 0.00 57.88 57.61 3d8t h LEU 67 Cb 0.12 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.61 3d8t h LEU 67 CO -0.01 1.16 0.14 -0.08 0.09 0.00 0.00 178.44 179.73 3d8t h GLU 68 N 0.64 1.06 -0.18 1.13 4.57 -1.18 -2.29 114.58 118.34 3d8t h GLU 68 Ca 0.04 -0.27 0.04 0.00 -1.18 0.00 0.00 59.36 58.00 3d8t h GLU 68 Cb 1.00 -0.13 -0.04 0.00 -0.16 0.00 0.00 28.75 29.42 3d8t h GLU 68 CO 0.10 0.96 -0.07 0.00 -1.18 0.00 0.00 179.01 178.82 3d8t h ALA 69 N 1.05 0.09 -0.70 2.92 0.00 -0.51 -0.24 119.26 121.87 3d8t h ALA 69 Ca 0.20 0.07 0.14 0.00 0.00 0.00 0.00 54.91 55.32 3d8t h ALA 69 Cb 0.39 0.17 -0.10 0.00 0.00 0.00 0.00 17.79 18.26 3d8t h ALA 69 CO 0.01 -0.50 0.21 0.78 0.00 0.00 0.00 179.25 179.74 3d8t h GLY 70 N -0.04 0.98 0.94 0.00 0.00 -1.01 -0.74 103.07 103.20 3d8t h GLY 70 Ca 0.09 -0.07 -0.08 0.00 0.00 0.00 0.00 47.33 47.27 3d8t h GLY 70 CO -0.20 -0.13 -0.10 0.50 0.00 0.00 0.00 176.54 176.60 3d8t h LYS 71 N 0.33 0.68 -0.55 4.80 1.57 -0.93 -0.29 116.57 122.17 3d8t h LYS 71 Ca 0.38 -0.27 0.06 0.00 -1.87 0.00 0.00 60.65 58.96 3d8t h LYS 71 Cb 0.60 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.84 3d8t h LYS 71 CO -0.43 0.85 0.37 0.00 -0.57 0.00 0.00 179.45 179.66 3d8t h ALA 72 N 0.81 1.87 -0.04 3.86 0.00 -0.43 -1.82 119.26 123.51 3d8t h ALA 72 Ca 0.09 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3d8t h ALA 72 Cb 0.61 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.28 3d8t h ALA 72 CO 0.04 0.03 0.00 1.28 0.00 0.00 0.00 179.25 180.60 3d8t n LEU 73 N -4.47 0.74 -1.61 0.00 4.77 -0.34 -4.92 117.00 111.16 3d8t n LEU 73 Ca 0.08 -0.27 -0.13 0.00 -0.03 0.00 0.00 56.01 55.65 3d8t n LEU 73 Cb 0.25 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.32 3d8t n LEU 73 CO 0.34 0.14 -0.11 0.61 -1.33 0.00 0.00 177.39 177.04 3d8t n GLY 74 N 1.03 -0.13 3.78 -0.72 0.00 -0.68 -5.02 105.19 103.44 3d8t n GLY 74 Ca 0.19 -0.31 -0.31 0.00 0.00 0.00 0.00 46.02 45.59 3d8t n GLY 74 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3d8t s LEU 75 N -3.87 3.83 -0.55 0.99 1.43 -0.15 -5.04 118.68 115.32 3d8t s LEU 75 Ca 0.06 0.05 -0.20 0.00 -1.03 0.00 0.00 54.13 53.01 3d8t s LEU 75 Cb -0.03 -2.39 0.06 0.00 0.03 0.00 0.00 46.19 43.87 3d8t s LEU 75 CO 0.07 0.21 0.75 -0.62 0.23 0.00 0.00 176.35 176.99 3d8t s ASP 76 N -2.10 6.23 0.02 2.29 2.15 -1.26 -4.29 116.67 119.71 3d8t s ASP 76 Ca 0.27 -0.91 0.18 0.00 0.43 0.00 0.00 52.55 52.52 3d8t s ASP 76 Cb -0.12 -2.34 -0.17 0.00 -0.30 0.00 0.00 42.92 39.99 3d8t s ASP 76 CO 0.19 -1.07 0.68 0.18 -0.17 0.00 0.00 175.17 174.97 3d8t n LEU 77 N 6.65 0.62 -0.21 -1.34 4.77 -1.26 -4.39 117.00 121.85 3d8t n LEU 77 Ca -0.05 0.27 -0.07 0.00 -0.03 0.00 0.00 56.01 56.13 3d8t n LEU 77 Cb 0.45 0.12 0.03 0.00 -2.33 0.00 0.00 43.42 41.69 3d8t n LEU 77 CO 0.58 0.16 1.00 -0.33 -1.33 0.00 0.00 177.39 177.47 3d8t h GLU 78 N 0.00 0.86 0.88 3.23 5.08 -1.98 -1.48 114.58 121.17 3d8t h GLU 78 Ca -0.19 -0.14 -0.04 0.00 -1.00 0.00 0.00 59.36 57.99 3d8t h GLU 78 Cb 1.58 -0.15 0.01 0.00 0.50 0.00 0.00 28.75 30.69 3d8t h GLU 78 CO 0.04 0.71 -0.45 0.78 -1.00 0.00 0.00 179.01 179.09 3d8t h GLY 79 N 0.80 -1.28 0.46 -3.84 0.00 -1.99 0.46 103.07 97.67 3d8t h GLY 79 Ca 0.20 0.49 0.11 0.00 0.00 0.00 0.00 47.33 48.13 3d8t h GLY 79 CO -0.02 -0.46 0.56 -2.55 0.00 0.00 0.00 176.54 174.06 3d8t h PRO 80 N -1.22 0.86 -0.18 4.80 0.11 -1.76 -2.04 132.00 132.57 3d8t h PRO 80 Ca -0.12 -0.05 -0.10 0.00 0.11 0.00 0.00 66.00 65.83 3d8t h PRO 80 Cb 0.94 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 31.85 3d8t h PRO 80 CO 0.18 0.57 -0.34 -0.07 -0.21 0.00 0.00 178.00 178.13 3d8t h LEU 81 N 0.88 0.38 -1.83 2.35 3.38 -1.07 -1.55 115.31 117.86 3d8t h LEU 81 Ca 0.46 -0.15 -0.03 0.00 0.09 0.00 0.00 57.88 58.26 3d8t h LEU 81 Cb 0.47 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.11 3d8t h LEU 81 CO -0.27 0.70 -0.12 0.00 0.09 0.00 0.00 178.44 178.84 3d8t h ALA 82 N 1.32 1.21 -0.61 1.53 0.00 -0.26 -2.62 119.26 119.83 3d8t h ALA 82 Ca 0.04 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.84 3d8t h ALA 82 Cb 0.75 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.53 3d8t h ALA 82 CO 0.06 0.15 0.00 1.63 0.00 0.00 0.00 179.25 181.09 3d8t n LYS 83 N -3.53 4.54 -4.58 0.00 5.02 -0.61 -4.94 118.16 114.06 3d8t n LYS 83 Ca -0.01 -3.09 -0.30 0.00 -2.02 0.00 0.00 58.31 52.89 3d8t n LYS 83 Cb 0.26 -2.15 -0.13 0.00 -0.02 0.00 0.00 35.03 32.99 3d8t n LYS 83 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3d8t s ALA 84 N -2.47 2.40 0.04 7.82 0.00 -0.99 -4.77 121.76 123.79 3d8t s ALA 84 Ca 0.54 -1.36 -0.30 0.00 0.00 0.00 0.00 51.96 50.83 3d8t s ALA 84 Cb 0.39 -0.48 -0.07 0.00 0.00 0.00 0.00 23.12 22.95 3d8t s ALA 84 CO 0.19 0.55 1.56 0.12 0.00 0.00 0.00 175.76 178.18 3d8t s PHE 85 N -0.97 2.57 -0.11 0.00 5.36 -0.62 -4.84 117.98 119.37 3d8t s PHE 85 Ca 0.14 0.50 0.01 0.00 -0.96 0.00 0.00 56.93 56.61 3d8t s PHE 85 Cb -0.10 -3.86 -0.02 0.00 -0.34 0.00 0.00 43.02 38.71 3d8t s PHE 85 CO 0.05 -3.36 -0.13 1.03 -1.46 0.00 0.00 175.22 171.36 3d8t s ARG 86 N 2.57 3.19 0.09 10.12 0.52 -1.26 -0.03 118.95 134.15 3d8t s ARG 86 Ca 0.70 -0.67 0.08 0.00 -0.52 0.00 0.00 55.73 55.32 3d8t s ARG 86 Cb -0.37 -2.59 -0.03 0.00 0.52 0.00 0.00 34.95 32.48 3d8t s ARG 86 CO 0.30 0.32 -0.20 -0.51 0.02 0.00 0.00 175.30 175.23 3d8t s LEU 87 N 0.08 2.28 -0.05 2.53 1.02 0.14 -0.16 118.68 124.53 3d8t s LEU 87 Ca -0.05 -0.66 0.04 0.00 0.02 0.00 0.00 54.13 53.48 3d8t s LEU 87 Cb -0.15 -0.87 -0.00 0.00 0.02 0.00 0.00 46.19 45.19 3d8t s LEU 87 CO 0.04 0.06 -0.17 0.00 0.02 0.00 0.00 176.35 176.31 3d8t s ALA 88 N -1.12 1.50 0.19 4.21 0.00 -0.46 -1.16 121.76 124.91 3d8t s ALA 88 Ca 0.06 -0.66 -0.09 0.00 0.00 0.00 0.00 51.96 51.27 3d8t s ALA 88 Cb -0.10 -0.51 0.10 0.00 0.00 0.00 0.00 23.12 22.61 3d8t s ALA 88 CO 0.04 0.26 1.70 -0.09 0.00 0.00 0.00 175.76 177.67 3d8t h ARG 89 N 6.33 1.09 0.00 0.00 2.43 -1.03 -0.07 114.38 123.13 3d8t h ARG 89 Ca -0.32 -0.27 0.00 0.00 -0.81 0.00 0.00 59.98 58.58 3d8t h ARG 89 Cb 1.18 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 30.59 3d8t h ARG 89 CO 0.48 0.98 0.00 0.41 -1.51 0.00 0.00 179.97 180.32 3d8t n GLY 90 N -0.64 3.03 0.33 2.80 0.00 -1.26 -1.15 105.19 108.30 3d8t n GLY 90 Ca 0.05 -1.23 -0.01 0.00 0.00 0.00 0.00 46.02 44.82 3d8t n GLY 90 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d8t h ALA 91 N 1.59 1.34 -0.26 4.61 0.00 -1.91 -1.41 119.26 123.22 3d8t h ALA 91 Ca 0.00 -0.12 -0.11 0.00 0.00 0.00 0.00 54.91 54.68 3d8t h ALA 91 Cb 0.00 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.52 3d8t h ALA 91 CO 0.00 0.52 -0.27 0.87 0.00 0.00 0.00 179.25 180.37 3d8t h LYS 92 N 0.93 0.65 -0.60 0.00 1.57 -1.97 -0.27 116.57 116.88 3d8t h LYS 92 Ca 0.23 -0.35 -0.08 0.00 -1.87 0.00 0.00 60.65 58.59 3d8t h LYS 92 Cb 0.07 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.37 3d8t h LYS 92 CO -0.03 0.96 0.07 0.00 -0.57 0.00 0.00 179.45 179.88 3d8t h ALA 93 N 0.69 0.80 -0.36 3.86 0.00 -1.75 -2.63 119.26 119.86 3d8t h ALA 93 Ca 0.04 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 3d8t h ALA 93 Cb 0.84 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 3d8t h ALA 93 CO 0.07 0.57 0.13 0.00 0.00 0.00 0.00 179.25 180.02 3d8t h ALA 94 N 1.01 0.47 -0.72 0.00 0.00 -1.10 -1.54 119.26 117.39 3d8t h ALA 94 Ca 0.18 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 3d8t h ALA 94 Cb 0.46 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 3d8t h ALA 94 CO 0.02 0.09 0.19 -0.09 0.00 0.00 0.00 179.25 179.46 3d8t h ARG 95 N 0.44 1.14 -0.51 0.00 2.43 -0.99 0.24 114.38 117.13 3d8t h ARG 95 Ca 0.12 -0.26 0.00 0.00 -0.81 0.00 0.00 59.98 59.03 3d8t h ARG 95 Cb 0.21 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 29.59 3d8t h ARG 95 CO -0.01 0.99 0.34 0.00 -1.51 0.00 0.00 179.97 179.78 3d8t h ALA 96 N 1.10 0.65 -0.38 2.80 0.00 -1.29 0.44 119.26 122.58 3d8t h ALA 96 Ca 0.23 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.11 3d8t h ALA 96 Cb 0.35 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 3d8t h ALA 96 CO -0.00 0.10 0.22 -0.07 0.00 0.00 0.00 179.25 179.50 3d8t h LEU 97 N 0.70 0.37 -0.73 0.00 3.38 -0.89 -2.61 115.31 115.52 3d8t h LEU 97 Ca 0.19 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.15 3d8t h LEU 97 Cb -0.08 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 40.56 3d8t h LEU 97 CO -0.04 0.26 0.41 0.50 0.09 0.00 0.00 178.44 179.66 3d8t h LYS 98 N 0.46 1.02 0.00 1.13 3.64 -0.39 -0.83 116.57 121.60 3d8t h LYS 98 Ca 0.15 -0.12 -0.04 0.00 -1.27 0.00 0.00 60.65 59.37 3d8t h LYS 98 Cb -0.00 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 31.61 3d8t h LYS 98 CO -0.07 0.76 -0.20 0.93 -2.27 0.00 0.00 179.45 178.61 3d8t h GLU 99 N 1.01 0.00 -0.03 1.90 5.08 -0.79 -0.78 114.58 120.97 3d8t h GLU 99 Ca 0.26 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.62 3d8t h GLU 99 Cb 0.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.28 3d8t h GLU 99 CO -0.04 0.20 0.00 0.00 -1.00 0.00 0.00 179.01 178.16 3d8t n ALA 100 N -2.44 2.61 -1.30 3.43 0.00 -0.89 -4.91 120.51 117.00 3d8t n ALA 100 Ca -0.02 -0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.10 3d8t n ALA 100 Cb 0.27 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.43 3d8t n ALA 100 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3d8t n GLY 101 N 1.04 0.39 2.53 0.00 0.00 -0.30 -4.99 105.19 103.87 3d8t n GLY 101 Ca 0.19 -1.02 -0.21 0.00 0.00 0.00 0.00 46.02 44.99 3d8t n GLY 101 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3d8t n LEU 102 N 0.00 2.51 -4.68 0.99 4.77 -0.37 -5.02 117.00 115.21 3d8t n LEU 102 Ca 0.00 -5.09 -0.43 0.00 -0.03 0.00 0.00 56.01 50.46 3d8t n LEU 102 Cb 0.16 0.14 -0.01 0.00 -2.33 0.00 0.00 43.42 41.38 3d8t n LEU 102 CO 0.00 2.21 0.86 -2.65 -1.33 0.00 0.00 177.39 176.48 3d8t n PRO 103 N -0.02 2.00 -2.23 3.23 -0.02 -1.25 -4.27 135.00 132.44 3d8t n PRO 103 Ca 0.26 0.70 -0.35 0.00 -2.02 0.00 0.00 63.50 62.10 3d8t n PRO 103 Cb 0.59 -2.26 0.00 0.00 -0.02 0.00 0.00 33.50 31.82 3d8t n PRO 103 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 3d8t s PRO 104 N -1.69 3.34 0.27 0.52 0.04 -1.26 -4.88 135.00 131.34 3d8t s PRO 104 Ca 0.57 1.56 0.14 0.00 0.04 0.00 0.00 61.00 63.32 3d8t s PRO 104 Cb -0.60 -2.01 0.12 0.00 0.04 0.00 0.00 34.50 32.06 3d8t s PRO 104 CO 0.61 -0.85 1.47 0.45 0.04 0.00 0.00 177.00 178.71 3d8t h HIS 105 N 1.10 0.00 -2.89 0.56 3.86 -0.90 -3.46 115.15 113.41 3d8t h HIS 105 Ca -0.50 0.00 -0.11 0.00 -1.16 0.00 0.00 60.37 58.60 3d8t h HIS 105 Cb 1.26 0.00 -0.21 0.00 1.06 0.00 0.00 27.41 29.52 3d8t h HIS 105 CO 0.52 0.56 -0.23 0.00 0.86 0.00 0.00 177.93 179.64 3d8t s ALA 106 N -3.03 -0.91 -0.02 2.45 0.00 -1.12 -5.04 121.76 114.09 3d8t s ALA 106 Ca 0.03 0.58 0.01 0.00 0.00 0.00 0.00 51.96 52.57 3d8t s ALA 106 Cb 0.08 -0.08 0.02 0.00 0.00 0.00 0.00 23.12 23.14 3d8t s ALA 106 CO 0.75 -0.25 -0.02 0.08 0.00 0.00 0.00 175.76 176.32 3d8t s VAL 107 N -0.99 0.27 0.00 0.00 1.01 -1.26 -1.36 120.40 118.07 3d8t s VAL 107 Ca -0.10 -0.02 0.00 0.00 0.00 0.00 0.00 61.98 61.86 3d8t s VAL 107 Cb -0.04 -0.31 0.00 0.00 0.00 0.00 0.00 36.38 36.03 3d8t s VAL 107 CO 0.04 0.14 0.00 0.61 0.00 0.00 0.00 175.10 175.89 3d8t n GLY 108 N 3.80 -0.56 1.27 4.51 0.00 -0.04 -4.98 105.19 109.19 3d8t n GLY 108 Ca -0.23 -1.71 0.10 0.00 0.00 0.00 0.00 46.02 44.18 3d8t n GLY 108 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3d8t n ASP 109 N -1.44 4.00 0.00 1.61 5.68 -1.12 -4.46 116.55 120.81 3d8t n ASP 109 Ca 0.00 -2.16 0.00 0.00 -0.50 0.00 0.00 54.79 52.13 3d8t n ASP 109 Cb 0.00 -0.47 0.00 0.00 -1.14 0.00 0.00 41.12 39.51 3d8t n ASP 109 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3d8t n GLY 110 N 1.22 0.55 3.57 6.12 0.00 -0.30 -4.94 105.19 111.42 3d8t n GLY 110 Ca 0.22 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.92 3d8t n GLY 110 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3d8t s THR 111 N -2.00 3.56 0.27 2.61 -4.23 -1.26 -4.77 115.64 109.82 3d8t s THR 111 Ca 0.00 -0.71 -0.04 0.00 -1.18 0.00 0.00 61.69 59.76 3d8t s THR 111 Cb 0.00 -2.51 0.22 0.00 1.34 0.00 0.00 72.50 71.55 3d8t s THR 111 CO 0.00 0.46 1.89 0.28 -0.54 0.00 0.00 174.62 176.72 3d8t h SER 112 N 4.79 0.99 -0.99 3.99 0.02 -1.98 -2.73 113.55 117.64 3d8t h SER 112 Ca -0.48 -0.08 0.16 0.00 -0.84 0.00 0.00 61.79 60.54 3d8t h SER 112 Cb 1.17 -0.25 -0.09 0.00 0.14 0.00 0.00 62.40 63.36 3d8t h SER 112 CO 0.53 0.79 0.62 0.07 -1.14 0.00 0.00 176.83 177.70 3d8t h LYS 113 N 1.12 0.82 0.00 3.45 2.10 -1.99 -1.21 116.57 120.85 3d8t h LYS 113 Ca 0.28 -0.05 0.00 0.00 -2.00 0.00 0.00 60.65 58.88 3d8t h LYS 113 Cb 0.02 -0.18 0.00 0.00 -0.90 0.00 0.00 32.23 31.17 3d8t h LYS 113 CO -0.05 0.54 0.00 0.66 -2.00 0.00 0.00 179.45 178.60 3d8t h SER 114 N 0.84 0.00 1.52 7.07 4.64 -1.89 -1.66 113.55 124.07 3d8t h SER 114 Ca 0.53 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.82 3d8t h SER 114 Cb 0.72 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.81 3d8t h SER 114 CO -0.31 0.00 -0.16 -0.07 -0.87 0.00 0.00 176.83 175.42 3d8t h LEU 115 N 0.00 0.00 -0.21 5.97 3.38 -1.31 -3.38 115.31 119.75 3d8t h LEU 115 Ca 0.00 0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.03 3d8t h LEU 115 Cb 0.15 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.84 3d8t h LEU 115 CO 0.00 0.16 -0.23 -0.07 0.09 0.00 0.00 178.44 178.39 3d8t h LEU 116 N 0.00 -0.74 0.00 1.67 3.38 -1.40 -0.71 115.31 117.51 3d8t h LEU 116 Ca -0.00 0.13 0.00 0.00 0.09 0.00 0.00 57.88 58.10 3d8t h LEU 116 Cb 0.96 0.35 0.00 0.00 0.09 0.00 0.00 40.66 42.06 3d8t h LEU 116 CO 0.02 -0.27 0.00 -0.81 0.09 0.00 0.00 178.44 177.47 3d8t n PRO 117 N -5.37 0.26 0.03 1.13 -0.04 -1.26 -2.89 135.00 126.86 3d8t n PRO 117 Ca -0.01 0.09 0.12 0.00 -0.04 0.00 0.00 63.50 63.66 3d8t n PRO 117 Cb 0.28 -1.50 0.28 0.00 -0.04 0.00 0.00 33.50 32.53 3d8t n PRO 117 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3d8t n LEU 118 N -1.31 0.53 -4.73 1.53 4.77 -0.28 -4.94 117.00 112.56 3d8t n LEU 118 Ca 0.09 0.20 -0.41 0.00 -0.03 0.00 0.00 56.01 55.86 3d8t n LEU 118 Cb 0.17 -0.26 -0.04 0.00 -2.33 0.00 0.00 43.42 40.96 3d8t n LEU 118 CO 0.16 0.02 0.77 -0.76 -1.33 0.00 0.00 177.39 176.25 3d8t s LEU 119 N -3.59 4.47 0.54 2.23 1.43 -1.14 -5.00 118.68 117.63 3d8t s LEU 119 Ca 0.09 1.99 -0.16 0.00 -1.03 0.00 0.00 54.13 55.03 3d8t s LEU 119 Cb 0.16 -3.60 -0.07 0.00 0.03 0.00 0.00 46.19 42.72 3d8t s LEU 119 CO 0.68 -0.22 1.00 -2.16 0.23 0.00 0.00 176.35 175.89 3d8t s PRO 120 N -0.06 3.78 0.10 1.29 0.04 -1.26 -5.04 135.00 133.85 3d8t s PRO 120 Ca 0.50 0.97 -0.30 0.00 0.04 0.00 0.00 61.00 62.21 3d8t s PRO 120 Cb -0.28 -2.11 -0.06 0.00 0.04 0.00 0.00 34.50 32.10 3d8t s PRO 120 CO 0.33 -0.42 1.07 -0.65 0.04 0.00 0.00 177.00 177.37 3d8t s GLN 121 N -4.22 4.57 0.00 4.56 -1.52 -1.26 -4.87 119.66 116.91 3d8t s GLN 121 Ca 0.59 1.62 0.00 0.00 -1.95 0.00 0.00 55.36 55.62 3d8t s GLN 121 Cb -0.11 -3.35 0.00 0.00 -0.22 0.00 0.00 33.01 29.33 3d8t s GLN 121 CO 0.35 0.00 0.00 0.41 -0.25 0.00 0.00 175.29 175.81 3d8t n GLY 122 N 2.52 3.98 3.20 3.09 0.00 0.33 -5.05 105.19 113.26 3d8t n GLY 122 Ca 0.05 -0.99 -0.09 0.00 0.00 0.00 0.00 46.02 44.99 3d8t n GLY 122 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3d8t s ARG 123 N 1.17 0.86 1.81 1.61 3.52 -1.26 -4.22 118.95 122.44 3d8t s ARG 123 Ca 0.00 -1.13 0.00 0.00 -0.13 0.00 0.00 55.73 54.47 3d8t s ARG 123 Cb 0.00 0.30 0.00 0.00 -1.56 0.00 0.00 34.95 33.69 3d8t s ARG 123 CO 0.00 -0.26 0.00 0.41 -0.81 0.00 0.00 175.30 174.64 3d8t n GLY 124 N -0.06 0.76 3.42 8.12 0.00 -1.25 -4.73 105.19 111.45 3d8t n GLY 124 Ca -0.12 -1.32 -0.33 0.00 0.00 0.00 0.00 46.02 44.26 3d8t n GLY 124 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3d8t s VAL 125 N 0.00 2.92 -0.32 1.61 1.01 -1.26 -0.26 120.40 124.10 3d8t s VAL 125 Ca 0.00 -0.76 -0.01 0.00 0.00 0.00 0.00 61.98 61.21 3d8t s VAL 125 Cb 0.00 -2.15 0.07 0.00 0.00 0.00 0.00 36.38 34.30 3d8t s VAL 125 CO 0.00 0.57 0.03 0.00 0.00 0.00 0.00 175.10 175.70 3d8t s ALA 126 N -0.41 2.85 0.09 5.51 0.00 0.10 -0.21 121.76 129.69 3d8t s ALA 126 Ca 0.05 -1.98 -0.27 0.00 0.00 0.00 0.00 51.96 49.75 3d8t s ALA 126 Cb -0.12 -1.98 -0.06 0.00 0.00 0.00 0.00 23.12 20.96 3d8t s ALA 126 CO 0.02 -1.40 0.85 0.00 0.00 0.00 0.00 175.76 175.23 3d8t s ALA 127 N 1.18 3.33 -0.26 0.00 0.00 0.42 -1.04 121.76 125.39 3d8t s ALA 127 Ca -0.02 0.42 0.00 0.00 0.00 0.00 0.00 51.96 52.37 3d8t s ALA 127 Cb -0.20 -3.11 0.07 0.00 0.00 0.00 0.00 23.12 19.88 3d8t s ALA 127 CO -0.03 0.06 0.00 -1.17 0.00 0.00 0.00 175.76 174.63 3d8t s LEU 128 N -0.20 2.61 -0.15 0.00 2.96 0.61 -0.65 118.68 123.85 3d8t s LEU 128 Ca 0.42 -1.36 -0.29 0.00 -0.22 0.00 0.00 54.13 52.68 3d8t s LEU 128 Cb -0.22 -1.10 -0.00 0.00 0.50 0.00 0.00 46.19 45.37 3d8t s LEU 128 CO 0.26 -0.30 1.02 -1.58 -1.32 0.00 0.00 176.35 174.43 3d8t s GLN 129 N 1.44 4.36 0.45 1.98 -0.44 0.11 -0.76 119.66 126.80 3d8t s GLN 129 Ca 0.00 1.37 0.03 0.00 -2.50 0.00 0.00 55.36 54.26 3d8t s GLN 129 Cb -0.18 -3.58 -0.04 0.00 -1.64 0.00 0.00 33.01 27.57 3d8t s GLN 129 CO -0.11 -0.43 0.03 -0.51 0.50 0.00 0.00 175.29 174.77 3d8t s LEU 130 N 2.46 2.38 -0.09 3.68 1.43 -0.31 -3.29 118.68 124.93 3d8t s LEU 130 Ca 0.46 -1.57 0.13 0.00 -1.03 0.00 0.00 54.13 52.13 3d8t s LEU 130 Cb -0.17 -0.64 0.27 0.00 0.03 0.00 0.00 46.19 45.68 3d8t s LEU 130 CO 0.13 -0.75 1.13 0.00 0.23 0.00 0.00 176.35 177.10 3d8t n TYR 131 N -1.08 0.00 0.00 0.29 0.18 -1.26 -4.64 117.16 110.65 3d8t n TYR 131 Ca -0.12 -0.77 0.00 0.00 1.88 0.00 0.00 57.90 58.89 3d8t n TYR 131 Cb 0.67 -0.15 0.00 0.00 -0.38 0.00 0.00 39.34 39.48 3d8t n TYR 131 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 3d8t n GLY 132 N -0.69 1.46 3.16 -7.48 0.00 -1.26 -4.93 105.19 95.46 3d8t n GLY 132 Ca 0.11 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.03 3d8t n GLY 132 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3d8t s LYS 133 N 0.00 0.68 0.71 1.61 -2.85 -1.26 -1.35 119.74 117.28 3d8t s LYS 133 Ca 0.00 -0.71 -0.16 0.00 -1.00 0.00 0.00 55.97 54.10 3d8t s LYS 133 Cb 0.00 0.27 0.02 0.00 -2.06 0.00 0.00 37.83 36.06 3d8t s LYS 133 CO 0.00 -0.19 1.17 -2.30 0.10 0.00 0.00 175.35 174.13 3d8t n PRO 134 N 0.63 0.67 -3.88 1.78 -0.02 -1.26 -4.95 135.00 127.96 3d8t n PRO 134 Ca -0.18 0.29 -0.29 0.00 -2.02 0.00 0.00 63.50 61.30 3d8t n PRO 134 Cb 0.59 -2.41 -0.13 0.00 -0.02 0.00 0.00 33.50 31.53 3d8t n PRO 134 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3d8t s LEU 135 N -4.30 4.28 0.24 2.45 1.43 -1.26 -5.01 118.68 116.50 3d8t s LEU 135 Ca 0.77 -3.36 -0.06 0.00 -1.03 0.00 0.00 54.13 50.46 3d8t s LEU 135 Cb -0.35 -1.54 0.32 0.00 0.03 0.00 0.00 46.19 44.66 3d8t s LEU 135 CO 0.46 -0.17 1.85 -0.65 0.23 0.00 0.00 176.35 178.07 3d8t h PRO 136 N 5.99 0.92 -0.23 1.29 0.11 -1.98 0.43 132.00 138.54 3d8t h PRO 136 Ca 0.04 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 66.07 3d8t h PRO 136 Cb 0.83 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 31.73 3d8t h PRO 136 CO 0.67 0.61 0.05 -0.07 -0.21 0.00 0.00 178.00 179.05 3d8t h LEU 137 N 0.95 0.35 -0.38 2.35 3.38 -1.99 0.29 115.31 120.26 3d8t h LEU 137 Ca 0.37 -0.24 -0.04 0.00 0.09 0.00 0.00 57.88 58.06 3d8t h LEU 137 Cb 0.16 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 3d8t h LEU 137 CO -0.17 0.50 0.07 0.25 0.09 0.00 0.00 178.44 179.18 3d8t h LEU 138 N 0.19 0.60 -0.87 1.67 5.85 -1.81 -1.47 115.31 119.47 3d8t h LEU 138 Ca 0.07 -0.25 -0.02 0.00 0.84 0.00 0.00 57.88 58.52 3d8t h LEU 138 Cb 0.29 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.12 3d8t h LEU 138 CO 0.00 0.69 0.47 -0.33 -0.34 0.00 0.00 178.44 178.93 3d8t h GLU 139 N 0.47 1.22 -0.45 1.25 5.08 0.03 -1.31 114.58 120.87 3d8t h GLU 139 Ca 0.12 -0.15 0.01 0.00 -1.00 0.00 0.00 59.36 58.34 3d8t h GLU 139 Cb 0.34 -0.24 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 3d8t h GLU 139 CO 0.01 0.90 0.29 -0.91 -1.00 0.00 0.00 179.01 178.29 3d8t h ASN 140 N 1.22 0.49 -0.68 1.42 4.21 -0.30 -2.17 115.58 119.77 3d8t h ASN 140 Ca 0.30 -0.01 -0.01 0.00 1.21 0.00 0.00 56.30 57.80 3d8t h ASN 140 Cb 0.04 -0.12 -0.03 0.00 -1.12 0.00 0.00 38.32 37.09 3d8t h ASN 140 CO -0.05 0.35 0.38 0.00 -1.29 0.00 0.00 177.43 176.82 3d8t h ALA 141 N 1.18 0.87 -0.69 -0.83 0.00 -0.94 -0.78 119.26 118.07 3d8t h ALA 141 Ca 0.17 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 3d8t h ALA 141 Cb -0.04 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.44 3d8t h ALA 141 CO -0.05 0.38 0.34 -0.07 0.00 0.00 0.00 179.25 179.85 3d8t h LEU 142 N 0.93 0.89 -0.50 0.00 3.38 -1.14 -0.41 115.31 118.47 3d8t h LEU 142 Ca 0.24 -0.13 -0.07 0.00 0.09 0.00 0.00 57.88 58.02 3d8t h LEU 142 Cb 0.03 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 3d8t h LEU 142 CO -0.04 0.77 0.05 0.00 0.09 0.00 0.00 178.44 179.31 3d8t h ALA 143 N 1.16 0.66 0.00 1.53 0.00 -1.06 -2.27 119.26 119.29 3d8t h ALA 143 Ca 0.24 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 3d8t h ALA 143 Cb 0.10 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 3d8t h ALA 143 CO -0.03 0.42 -0.16 0.93 0.00 0.00 0.00 179.25 180.41 3d8t h GLU 144 N 0.71 0.00 0.00 0.00 5.08 -0.94 0.16 114.58 119.59 3d8t h GLU 144 Ca 0.15 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 3d8t h GLU 144 Cb 0.44 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.69 3d8t h GLU 144 CO 0.02 0.16 0.00 0.54 -1.00 0.00 0.00 179.01 178.72 3d8t n ARG 145 N -3.72 0.71 0.00 2.33 5.12 -0.18 -4.91 116.66 116.01 3d8t n ARG 145 Ca -0.02 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.91 3d8t n ARG 145 Cb 0.27 -1.50 0.00 0.00 -1.16 0.00 0.00 32.46 30.07 3d8t n ARG 145 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3d8t n GLY 146 N 1.08 0.82 3.98 -0.13 0.00 0.04 -0.51 105.19 110.47 3d8t n GLY 146 Ca 0.19 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.01 3d8t n GLY 146 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3d8t s TYR 147 N -2.00 3.28 -0.17 1.61 1.51 -0.95 -3.92 117.35 116.70 3d8t s TYR 147 Ca 0.00 -0.10 -0.07 0.00 -1.01 0.00 0.00 57.07 55.89 3d8t s TYR 147 Cb 0.00 -1.82 -0.04 0.00 -0.11 0.00 0.00 41.96 39.99 3d8t s TYR 147 CO 0.00 0.18 0.06 0.50 -1.11 0.00 0.00 175.55 175.18 3d8t s ARG 148 N -4.11 3.86 -0.17 -0.62 3.52 0.64 -4.17 118.95 117.90 3d8t s ARG 148 Ca 0.40 -0.33 -0.22 0.00 -0.13 0.00 0.00 55.73 55.46 3d8t s ARG 148 Cb -0.09 -3.18 -0.03 0.00 -1.56 0.00 0.00 34.95 30.09 3d8t s ARG 148 CO 0.31 0.35 0.65 0.08 -0.81 0.00 0.00 175.30 175.88 3d8t s VAL 149 N 0.16 5.02 -0.44 7.11 1.01 -1.26 0.03 120.40 132.02 3d8t s VAL 149 Ca 0.05 1.26 -0.09 0.00 0.00 0.00 0.00 61.98 63.19 3d8t s VAL 149 Cb -0.12 -3.97 0.09 0.00 0.00 0.00 0.00 36.38 32.38 3d8t s VAL 149 CO 0.00 0.13 0.30 -0.22 0.00 0.00 0.00 175.10 175.32 3d8t s LEU 150 N 1.71 5.39 0.34 3.92 2.96 -0.21 -4.95 118.68 127.84 3d8t s LEU 150 Ca 0.31 -1.66 -0.27 0.00 -0.22 0.00 0.00 54.13 52.28 3d8t s LEU 150 Cb -0.16 -2.00 -0.09 0.00 0.50 0.00 0.00 46.19 44.43 3d8t s LEU 150 CO 0.12 -0.61 1.08 -2.16 -1.32 0.00 0.00 176.35 173.46 3d8t s PRO 151 N 1.41 4.41 -0.30 0.98 0.04 -1.26 -0.28 135.00 140.00 3d8t s PRO 151 Ca 0.04 1.67 -0.02 0.00 0.04 0.00 0.00 61.00 62.74 3d8t s PRO 151 Cb -0.24 -2.89 0.10 0.00 0.04 0.00 0.00 34.50 31.50 3d8t s PRO 151 CO 0.01 0.04 0.10 -0.51 0.04 0.00 0.00 177.00 176.68 3d8t s LEU 152 N -2.00 1.80 -0.19 -3.56 1.43 0.06 -4.88 118.68 111.34 3d8t s LEU 152 Ca 0.51 -1.51 -0.15 0.00 -1.03 0.00 0.00 54.13 51.95 3d8t s LEU 152 Cb -0.28 -0.74 0.06 0.00 0.03 0.00 0.00 46.19 45.26 3d8t s LEU 152 CO 0.35 -0.41 0.50 0.00 0.23 0.00 0.00 176.35 177.01 3d8t s MET 153 N 1.74 0.54 0.31 1.70 0.23 -1.26 -1.17 119.30 121.39 3d8t s MET 153 Ca 0.09 0.80 0.16 0.00 -1.03 0.00 0.00 55.69 55.70 3d8t s MET 153 Cb -0.17 0.17 0.39 0.00 -1.53 0.00 0.00 34.83 33.68 3d8t s MET 153 CO -0.27 -0.11 1.59 -1.00 -2.03 0.00 0.00 175.02 173.21 3d8t h PRO 154 N 6.13 0.00 -4.80 3.16 0.13 -1.92 -3.44 132.00 131.25 3d8t h PRO 154 Ca -0.31 0.00 -0.29 0.00 -0.87 0.00 0.00 66.00 64.53 3d8t h PRO 154 Cb 1.18 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 32.13 3d8t h PRO 154 CO 0.22 0.51 -0.73 0.71 -0.23 0.00 0.00 178.00 178.47 3d8t s TYR 155 N -3.34 0.90 -0.03 1.56 1.51 -1.26 -0.44 117.35 116.25 3d8t s TYR 155 Ca 0.01 -0.63 0.04 0.00 -1.01 0.00 0.00 57.07 55.48 3d8t s TYR 155 Cb 0.10 -0.51 -0.00 0.00 -0.11 0.00 0.00 41.96 41.43 3d8t s TYR 155 CO 0.72 -0.05 -0.15 0.50 -1.11 0.00 0.00 175.55 175.47 3d8t s ARG 156 N -2.43 1.40 -0.15 -0.62 3.52 -0.33 -4.00 118.95 116.34 3d8t s ARG 156 Ca 0.00 -0.51 -0.03 0.00 -0.13 0.00 0.00 55.73 55.06 3d8t s ARG 156 Cb -0.05 -1.27 -0.03 0.00 -1.56 0.00 0.00 34.95 32.04 3d8t s ARG 156 CO -0.00 0.24 -0.04 -1.01 -0.81 0.00 0.00 175.30 173.67 3d8t s HIS 157 N -0.06 3.01 0.05 5.12 3.76 -0.46 -2.22 115.29 124.51 3d8t s HIS 157 Ca -0.00 -0.28 0.04 0.00 -0.15 0.00 0.00 55.06 54.67 3d8t s HIS 157 Cb -0.09 -1.93 -0.04 0.00 1.11 0.00 0.00 32.58 31.63 3d8t s HIS 157 CO 0.01 -0.01 -0.03 -0.51 -0.85 0.00 0.00 174.74 173.35 3d8t s LEU 158 N 0.26 3.33 0.71 0.89 1.43 -1.25 -4.64 118.68 119.41 3d8t s LEU 158 Ca -0.03 -0.17 -0.09 0.00 -1.03 0.00 0.00 54.13 52.80 3d8t s LEU 158 Cb -0.14 -2.01 0.04 0.00 0.03 0.00 0.00 46.19 44.12 3d8t s LEU 158 CO 0.03 0.22 1.05 -2.16 0.23 0.00 0.00 176.35 175.73 3d8t s PRO 159 N -1.93 2.45 -0.69 1.29 0.04 -1.26 -1.03 135.00 133.88 3d8t s PRO 159 Ca 0.22 0.07 -0.10 0.00 0.04 0.00 0.00 61.00 61.23 3d8t s PRO 159 Cb -0.11 -2.10 0.18 0.00 0.04 0.00 0.00 34.50 32.51 3d8t s PRO 159 CO 0.13 -1.17 0.58 0.34 0.04 0.00 0.00 177.00 176.92 3d8t s ASP 160 N -4.45 6.07 0.14 6.66 -1.08 0.95 -4.02 116.67 120.93 3d8t s ASP 160 Ca 0.59 -2.55 -0.16 0.00 -0.52 0.00 0.00 52.55 49.91 3d8t s ASP 160 Cb -0.11 -2.06 0.00 0.00 -1.46 0.00 0.00 42.92 39.29 3d8t s ASP 160 CO 0.48 -0.55 1.70 -0.65 0.52 0.00 0.00 175.17 176.67 3d8t h PRO 161 N 7.73 0.61 -0.53 4.34 0.11 -1.94 0.34 132.00 142.66 3d8t h PRO 161 Ca -0.01 -0.10 -0.10 0.00 0.11 0.00 0.00 66.00 65.89 3d8t h PRO 161 Cb 1.02 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 32.01 3d8t h PRO 161 CO 0.78 0.55 -0.08 0.93 -0.21 0.00 0.00 178.00 179.97 3d8t h GLU 162 N 0.53 0.97 -0.62 1.05 3.07 -1.97 -2.10 114.58 115.52 3d8t h GLU 162 Ca 0.14 -0.34 -0.03 0.00 -0.50 0.00 0.00 59.36 58.63 3d8t h GLU 162 Cb 0.15 -0.07 -0.03 0.00 -0.84 0.00 0.00 28.75 27.96 3d8t h GLU 162 CO -0.02 1.01 0.26 0.78 -1.40 0.00 0.00 179.01 179.64 3d8t h GLY 163 N 0.97 0.98 0.90 -3.84 0.00 -1.65 -0.73 103.07 99.70 3d8t h GLY 163 Ca 0.14 -0.52 0.02 0.00 0.00 0.00 0.00 47.33 46.97 3d8t h GLY 163 CO 0.04 0.50 0.33 -2.22 0.00 0.00 0.00 176.54 175.19 3d8t h ILE 164 N 0.85 1.07 -0.92 2.60 2.04 -0.07 -0.79 117.51 122.30 3d8t h ILE 164 Ca 0.21 -0.23 0.00 0.00 1.00 0.00 0.00 64.86 65.84 3d8t h ILE 164 Cb 0.19 0.35 -0.05 0.00 -0.74 0.00 0.00 36.82 36.58 3d8t h ILE 164 CO -0.02 0.12 0.59 -0.07 0.00 0.00 0.00 178.15 178.77 3d8t h LEU 165 N 0.66 1.08 -0.61 1.44 3.38 -0.89 -0.20 115.31 120.16 3d8t h LEU 165 Ca 0.21 -0.04 -0.08 0.00 0.09 0.00 0.00 57.88 58.06 3d8t h LEU 165 Cb 0.00 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.46 3d8t h LEU 165 CO -0.09 0.80 0.07 0.03 0.09 0.00 0.00 178.44 179.35 3d8t h ARG 166 N 1.26 1.04 -0.24 1.13 3.08 -0.74 -0.44 114.38 119.46 3d8t h ARG 166 Ca 0.33 -0.29 -0.06 0.00 0.07 0.00 0.00 59.98 60.03 3d8t h ARG 166 Cb -0.11 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 29.82 3d8t h ARG 166 CO -0.07 0.98 -0.09 1.25 -1.07 0.00 0.00 179.97 180.97 3d8t h LEU 167 N 0.94 0.50 -0.36 3.04 5.85 -0.83 -1.18 115.31 123.27 3d8t h LEU 167 Ca 0.18 -0.39 0.04 0.00 0.84 0.00 0.00 57.88 58.55 3d8t h LEU 167 Cb 0.47 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 41.32 3d8t h LEU 167 CO 0.02 0.78 0.13 -0.08 -0.34 0.00 0.00 178.44 178.95 3d8t h GLU 168 N 0.22 0.27 -0.35 1.25 4.81 -0.91 -0.02 114.58 119.85 3d8t h GLU 168 Ca 0.06 -0.02 0.02 0.00 -0.13 0.00 0.00 59.36 59.29 3d8t h GLU 168 Cb 0.58 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.87 3d8t h GLU 168 CO 0.03 0.18 0.18 0.93 -0.73 0.00 0.00 179.01 179.60 3d8t h GLU 169 N 0.28 0.36 -0.69 1.92 5.08 -0.96 -0.82 114.58 119.76 3d8t h GLU 169 Ca 0.16 -0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.47 3d8t h GLU 169 Cb 0.14 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.27 3d8t h GLU 169 CO -0.17 0.24 0.32 0.00 -1.00 0.00 0.00 179.01 178.40 3d8t h ALA 170 N 1.17 0.89 -0.06 3.43 0.00 -0.70 -0.57 119.26 123.42 3d8t h ALA 170 Ca 0.14 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 3d8t h ALA 170 Cb 0.04 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.56 3d8t h ALA 170 CO -0.09 0.46 0.03 0.28 0.00 0.00 0.00 179.25 179.93 3d8t h VAL 171 N 0.96 1.08 0.00 0.00 2.07 -0.76 -0.91 116.25 118.69 3d8t h VAL 171 Ca 0.23 -0.22 0.00 0.00 0.82 0.00 0.00 66.70 67.53 3d8t h VAL 171 Cb 0.13 1.12 0.00 0.00 -1.52 0.00 0.00 31.29 31.02 3d8t h VAL 171 CO -0.03 0.07 0.00 0.18 0.02 0.00 0.00 177.57 177.81 3d8t n LEU 172 N -5.00 0.00 -0.71 2.57 4.77 -0.33 -2.85 117.00 115.44 3d8t n LEU 172 Ca -0.06 0.12 0.06 0.00 -0.03 0.00 0.00 56.01 56.10 3d8t n LEU 172 Cb 0.07 -0.12 0.19 0.00 -2.33 0.00 0.00 43.42 41.22 3d8t n LEU 172 CO 0.33 -0.00 0.65 0.54 -1.33 0.00 0.00 177.39 177.58 3d8t n ARG 173 N -1.12 2.90 -1.09 3.23 1.74 -0.24 -5.00 116.66 117.07 3d8t n ARG 173 Ca 0.19 -2.30 -0.03 0.00 -0.77 0.00 0.00 57.85 54.94 3d8t n ARG 173 Cb 0.16 -1.45 -0.01 0.00 -1.02 0.00 0.00 32.46 30.14 3d8t n ARG 173 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3d8t n GLY 174 N 0.17 0.62 0.40 -0.13 0.00 -1.13 -4.91 105.19 100.21 3d8t n GLY 174 Ca 0.15 -0.50 0.13 0.00 0.00 0.00 0.00 46.02 45.80 3d8t n GLY 174 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3d8t n GLU 175 N -2.51 1.36 -4.21 1.61 1.02 -0.35 -4.82 120.64 112.73 3d8t n GLU 175 Ca -0.03 -0.81 -0.25 0.00 -0.02 0.00 0.00 57.16 56.05 3d8t n GLU 175 Cb 0.15 -1.48 -0.17 0.00 -0.02 0.00 0.00 31.44 29.92 3d8t n GLU 175 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3d8t s VAL 176 N -2.20 0.98 -0.13 2.62 1.01 -1.24 -4.93 120.40 116.52 3d8t s VAL 176 Ca 0.32 -0.33 0.15 0.00 0.00 0.00 0.00 61.98 62.12 3d8t s VAL 176 Cb 0.20 -0.96 -0.24 0.00 0.00 0.00 0.00 36.38 35.38 3d8t s VAL 176 CO 0.41 0.34 0.34 0.47 0.00 0.00 0.00 175.10 176.66 3d8t n ASP 177 N 4.37 0.46 -3.75 3.32 8.00 0.25 -4.68 116.55 124.53 3d8t n ASP 177 Ca -0.18 0.19 -0.13 0.00 0.71 0.00 0.00 54.79 55.38 3d8t n ASP 177 Cb 0.51 0.46 -0.08 0.00 -0.02 0.00 0.00 41.12 41.99 3d8t n ASP 177 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3d8t s ALA 178 N -2.54 -0.80 -0.09 2.24 0.00 -0.95 -1.91 121.76 117.71 3d8t s ALA 178 Ca -0.08 0.30 -0.01 0.00 0.00 0.00 0.00 51.96 52.16 3d8t s ALA 178 Cb 0.07 0.13 0.03 0.00 0.00 0.00 0.00 23.12 23.35 3d8t s ALA 178 CO 0.82 -0.30 -0.03 -1.17 0.00 0.00 0.00 175.76 175.09 3d8t s LEU 179 N -1.49 0.84 -0.29 0.00 2.96 0.12 -0.28 118.68 120.54 3d8t s LEU 179 Ca -0.12 -0.19 -0.11 0.00 -0.22 0.00 0.00 54.13 53.49 3d8t s LEU 179 Cb -0.04 -0.60 -0.05 0.00 0.50 0.00 0.00 46.19 46.00 3d8t s LEU 179 CO 0.03 -0.17 0.19 0.00 -1.32 0.00 0.00 176.35 175.09 3d8t s ALA 180 N 1.86 3.52 -0.12 5.97 0.00 0.41 -0.55 121.76 132.86 3d8t s ALA 180 Ca 0.05 -1.13 -0.06 0.00 0.00 0.00 0.00 51.96 50.82 3d8t s ALA 180 Cb -0.12 -2.50 -0.04 0.00 0.00 0.00 0.00 23.12 20.46 3d8t s ALA 180 CO -0.06 -0.60 0.11 -0.06 0.00 0.00 0.00 175.76 175.14 3d8t s PHE 181 N 1.75 3.49 -0.35 0.00 0.40 -0.12 -1.70 117.98 121.45 3d8t s PHE 181 Ca 0.07 0.43 0.03 0.00 -0.60 0.00 0.00 56.93 56.86 3d8t s PHE 181 Cb -0.16 -1.93 0.01 0.00 0.51 0.00 0.00 43.02 41.46 3d8t s PHE 181 CO 0.11 0.64 0.51 1.33 0.70 0.00 0.00 175.22 178.51 3d8t n VAL 182 N 2.16 0.00 -3.81 -0.44 0.24 -1.26 -1.06 118.33 114.15 3d8t n VAL 182 Ca -0.19 -0.49 -0.12 0.00 -2.04 0.00 0.00 64.34 61.50 3d8t n VAL 182 Cb 0.54 1.05 -0.11 0.00 -1.47 0.00 0.00 33.84 33.85 3d8t n VAL 182 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3d8t s ALA 183 N -0.46 -0.49 0.34 2.33 0.00 -1.26 -4.81 121.76 117.41 3d8t s ALA 183 Ca 0.03 0.43 0.09 0.00 0.00 0.00 0.00 51.96 52.52 3d8t s ALA 183 Cb 0.03 -0.23 0.82 0.00 0.00 0.00 0.00 23.12 23.74 3d8t s ALA 183 CO 0.06 -0.13 1.81 0.00 0.00 0.00 0.00 175.76 177.50 3d8t h ALA 184 N 5.43 1.82 0.00 0.00 0.00 -1.85 -1.79 119.26 122.87 3d8t h ALA 184 Ca -0.27 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.67 3d8t h ALA 184 Cb 1.19 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.89 3d8t h ALA 184 CO 0.38 -0.14 -0.10 0.97 0.00 0.00 0.00 179.25 180.36 3d8t h ILE 185 N 0.69 1.06 -0.08 0.00 6.09 -1.96 -1.45 117.51 121.86 3d8t h ILE 185 Ca 0.53 -0.33 -0.10 0.00 -1.37 0.00 0.00 64.86 63.59 3d8t h ILE 185 Cb 0.91 1.18 -0.01 0.00 0.47 0.00 0.00 36.82 39.37 3d8t h ILE 185 CO -0.29 0.09 -0.40 1.56 -3.07 0.00 0.00 178.15 176.04 3d8t h GLN 186 N 0.00 0.16 -0.09 2.19 4.20 -1.73 -1.26 115.11 118.58 3d8t h GLN 186 Ca -0.00 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 58.62 3d8t h GLN 186 Cb 0.17 -0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.94 3d8t h GLN 186 CO 0.01 0.54 0.00 0.28 -0.67 0.00 0.00 178.83 178.99 3d8t h VAL 187 N 0.14 1.25 -0.64 -0.54 2.07 -1.31 -1.78 116.25 115.43 3d8t h VAL 187 Ca 0.01 -0.78 -0.03 0.00 0.82 0.00 0.00 66.70 66.72 3d8t h VAL 187 Cb 0.76 1.59 -0.03 0.00 -1.52 0.00 0.00 31.29 32.10 3d8t h VAL 187 CO 0.06 0.22 0.27 -0.33 0.02 0.00 0.00 177.57 177.81 3d8t h GLU 188 N -0.11 0.95 -0.24 1.57 5.08 -1.39 -2.09 114.58 118.35 3d8t h GLU 188 Ca 0.03 -0.16 0.00 0.00 -1.00 0.00 0.00 59.36 58.22 3d8t h GLU 188 Cb 0.34 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 3d8t h GLU 188 CO 0.00 0.79 0.16 0.74 -1.00 0.00 0.00 179.01 179.70 3d8t h PHE 189 N 0.90 0.31 0.09 4.33 0.04 -1.20 -0.40 116.94 121.01 3d8t h PHE 189 Ca 0.22 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.99 3d8t h PHE 189 Cb 0.18 -0.10 -0.00 0.00 2.20 0.00 0.00 35.95 38.23 3d8t h PHE 189 CO 0.01 0.21 -0.06 1.25 -0.60 0.00 0.00 178.31 179.12 3d8t h LEU 190 N 0.32 -0.15 -0.70 1.54 5.85 -1.06 -0.91 115.31 120.21 3d8t h LEU 190 Ca 0.09 0.01 -0.14 0.00 0.84 0.00 0.00 57.88 58.68 3d8t h LEU 190 Cb -0.02 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 3d8t h LEU 190 CO -0.02 -0.10 -0.55 -0.26 -0.34 0.00 0.00 178.44 177.17 3d8t h PHE 191 N -0.15 0.35 0.00 1.25 -1.00 -1.26 -1.94 116.94 114.19 3d8t h PHE 191 Ca -0.01 -0.12 -0.09 0.00 2.81 0.00 0.00 57.97 60.56 3d8t h PHE 191 Cb 0.13 -0.07 -0.01 0.00 3.61 0.00 0.00 35.95 39.61 3d8t h PHE 191 CO -0.09 0.77 -0.44 0.93 -1.61 0.00 0.00 178.31 177.87 3d8t h GLU 192 N 0.21 0.00 -0.01 1.51 5.08 -0.92 -3.25 114.58 117.21 3d8t h GLU 192 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3d8t h GLU 192 Cb 1.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.29 3d8t h GLU 192 CO 0.09 0.44 -0.57 0.41 -1.00 0.00 0.00 179.01 178.38 3d8t n GLY 193 N 0.21 -0.58 3.77 -3.84 0.00 -0.36 -4.97 105.19 99.43 3d8t n GLY 193 Ca -0.01 -0.54 -0.38 0.00 0.00 0.00 0.00 46.02 45.10 3d8t n GLY 193 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d8t s ALA 194 N -2.70 3.16 0.17 4.61 0.00 -0.74 -4.65 121.76 121.61 3d8t s ALA 194 Ca 0.16 0.79 -0.10 0.00 0.00 0.00 0.00 51.96 52.81 3d8t s ALA 194 Cb 0.18 -3.30 0.04 0.00 0.00 0.00 0.00 23.12 20.03 3d8t s ALA 194 CO 0.66 -0.26 1.60 -0.22 0.00 0.00 0.00 175.76 177.54 3d8t h LYS 195 N 2.80 1.03 -2.32 0.00 3.64 -1.91 -3.38 116.57 116.43 3d8t h LYS 195 Ca -0.48 -0.38 -0.59 0.00 -1.27 0.00 0.00 60.65 57.94 3d8t h LYS 195 Cb 1.22 -0.07 -0.40 0.00 -0.41 0.00 0.00 32.23 32.57 3d8t h LYS 195 CO 0.63 1.07 -0.85 -3.47 -2.27 0.00 0.00 179.45 174.56 3d8t n ASP 196 N -4.16 1.46 0.07 4.20 -0.08 -1.26 -4.97 116.55 111.81 3d8t n ASP 196 Ca 0.02 -2.91 0.05 0.00 -1.51 0.00 0.00 54.79 50.44 3d8t n ASP 196 Cb 0.40 -0.65 0.48 0.00 2.34 0.00 0.00 41.12 43.69 3d8t n ASP 196 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 3d8t h PRO 197 N 4.65 0.39 -0.01 -0.67 0.13 -1.85 -1.03 132.00 133.59 3d8t h PRO 197 Ca 0.16 -0.02 0.01 0.00 -0.87 0.00 0.00 66.00 65.28 3d8t h PRO 197 Cb 0.81 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 31.84 3d8t h PRO 197 CO 0.58 0.26 -0.04 -0.22 -0.23 0.00 0.00 178.00 178.35 3d8t h LYS 198 N 0.40 -0.06 -0.59 0.86 3.64 -1.96 0.18 116.57 119.04 3d8t h LYS 198 Ca 0.11 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.43 3d8t h LYS 198 Cb -0.04 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 31.77 3d8t h LYS 198 CO -0.02 -0.04 0.13 0.00 -2.27 0.00 0.00 179.45 177.25 3d8t h ALA 199 N 0.95 1.12 -0.23 5.00 0.00 -1.84 -1.50 119.26 122.76 3d8t h ALA 199 Ca 0.02 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 3d8t h ALA 199 Cb 0.09 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 3d8t h ALA 199 CO -0.05 0.59 0.09 1.25 0.00 0.00 0.00 179.25 181.13 3d8t h LEU 200 N 0.89 0.32 -0.37 0.00 5.85 -0.97 -0.50 115.31 120.53 3d8t h LEU 200 Ca 0.19 -0.16 0.03 0.00 0.84 0.00 0.00 57.88 58.78 3d8t h LEU 200 Cb 0.34 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.25 3d8t h LEU 200 CO 0.00 0.39 0.17 -0.09 -0.34 0.00 0.00 178.44 178.58 3d8t h ARG 201 N 0.22 0.35 -0.25 1.25 2.43 -0.45 -1.48 114.38 116.46 3d8t h ARG 201 Ca 0.08 -0.02 0.04 0.00 -0.81 0.00 0.00 59.98 59.27 3d8t h ARG 201 Cb 0.17 -0.08 -0.04 0.00 -0.42 0.00 0.00 29.97 29.61 3d8t h ARG 201 CO -0.01 0.23 0.02 1.49 -1.51 0.00 0.00 179.97 180.19 3d8t h GLU 202 N 0.36 0.10 -0.95 0.20 4.22 -1.06 -1.91 114.58 115.53 3d8t h GLU 202 Ca 0.16 -0.01 0.07 0.00 0.08 0.00 0.00 59.36 59.66 3d8t h GLU 202 Cb 0.08 -0.02 -0.07 0.00 0.50 0.00 0.00 28.75 29.24 3d8t h GLU 202 CO -0.12 0.07 0.60 0.00 -2.18 0.00 0.00 179.01 177.38 3d8t h ALA 203 N 1.20 1.32 0.00 2.92 0.00 -0.75 -1.70 119.26 122.25 3d8t h ALA 203 Ca 0.12 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3d8t h ALA 203 Cb 0.14 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.65 3d8t h ALA 203 CO -0.18 0.38 0.00 1.28 0.00 0.00 0.00 179.25 180.73 3d8t n LEU 204 N -4.55 0.00 -0.50 0.00 4.77 -0.59 -0.78 117.00 115.36 3d8t n LEU 204 Ca 0.14 0.34 0.10 0.00 -0.03 0.00 0.00 56.01 56.56 3d8t n LEU 204 Cb 0.19 -0.34 0.01 0.00 -2.33 0.00 0.00 43.42 40.95 3d8t n LEU 204 CO 0.32 -0.04 0.33 0.59 -1.33 0.00 0.00 177.39 177.26 3d8t n ASN 205 N -1.34 1.97 0.00 -1.43 3.02 -0.68 -4.14 115.26 112.67 3d8t n ASN 205 Ca 0.11 -1.49 0.00 0.00 -0.03 0.00 0.00 54.58 53.18 3d8t n ASN 205 Cb 0.24 0.39 0.00 0.00 -0.61 0.00 0.00 39.78 39.80 3d8t n ASN 205 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 3d8t n THR 206 N 0.14 0.00 0.22 3.41 -2.24 -0.89 -4.97 114.28 109.94 3d8t n THR 206 Ca 0.09 0.00 0.07 0.00 -2.27 0.00 0.00 64.05 61.94 3d8t n THR 206 Cb 0.42 -0.01 0.52 0.00 -2.10 0.00 0.00 70.33 69.16 3d8t n THR 206 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 3d8t h ARG 207 N 0.00 0.00 -5.04 -0.78 2.43 -1.48 -3.40 114.38 106.10 3d8t h ARG 207 Ca 0.00 0.00 -0.67 0.00 -0.81 0.00 0.00 59.98 58.50 3d8t h ARG 207 Cb 0.00 0.00 -0.35 0.00 -0.42 0.00 0.00 29.97 29.20 3d8t h ARG 207 CO 0.00 0.23 -0.85 0.08 -1.51 0.00 0.00 179.97 177.92 3d8t s VAL 208 N -4.27 2.09 -0.21 0.20 1.01 0.04 -4.83 120.40 114.43 3d8t s VAL 208 Ca -0.03 -1.00 -0.29 0.00 0.00 0.00 0.00 61.98 60.66 3d8t s VAL 208 Cb 0.14 -1.91 -0.01 0.00 0.00 0.00 0.00 36.38 34.60 3d8t s VAL 208 CO 0.67 0.49 1.28 -0.54 0.00 0.00 0.00 175.10 177.00 3d8t s LYS 209 N 1.28 4.12 -0.05 2.72 1.02 -0.80 -4.18 119.74 123.84 3d8t s LYS 209 Ca 0.04 1.53 -0.25 0.00 0.02 0.00 0.00 55.97 57.30 3d8t s LYS 209 Cb -0.14 -3.81 -0.03 0.00 -0.52 0.00 0.00 37.83 33.33 3d8t s LYS 209 CO -0.12 -0.85 0.79 0.00 -0.92 0.00 0.00 175.35 174.24 3d8t s ALA 210 N 3.82 3.29 -0.07 5.17 0.00 -1.26 -0.71 121.76 132.01 3d8t s ALA 210 Ca 0.56 0.25 0.03 0.00 0.00 0.00 0.00 51.96 52.80 3d8t s ALA 210 Cb -0.20 -3.08 -0.02 0.00 0.00 0.00 0.00 23.12 19.82 3d8t s ALA 210 CO 0.18 -0.16 -0.17 -0.51 0.00 0.00 0.00 175.76 175.10 3d8t s LEU 211 N 0.91 2.56 -0.10 0.00 1.43 0.29 0.08 118.68 123.84 3d8t s LEU 211 Ca 0.42 -0.31 0.02 0.00 -1.03 0.00 0.00 54.13 53.23 3d8t s LEU 211 Cb -0.19 -1.52 0.01 0.00 0.03 0.00 0.00 46.19 44.52 3d8t s LEU 211 CO 0.21 0.28 -0.17 0.00 0.23 0.00 0.00 176.35 176.90 3d8t s ALA 212 N -0.33 1.76 -0.37 4.21 0.00 -0.78 -0.94 121.76 125.32 3d8t s ALA 212 Ca 0.03 -0.76 -0.18 0.00 0.00 0.00 0.00 51.96 51.05 3d8t s ALA 212 Cb -0.13 -0.80 0.00 0.00 0.00 0.00 0.00 23.12 22.19 3d8t s ALA 212 CO 0.02 0.02 0.50 0.08 0.00 0.00 0.00 175.76 176.39 3d8t s VAL 213 N 0.80 5.02 0.00 0.00 1.01 -0.23 -0.37 120.40 126.64 3d8t s VAL 213 Ca -0.10 0.20 0.00 0.00 0.00 0.00 0.00 61.98 62.08 3d8t s VAL 213 Cb -0.16 -3.98 0.00 0.00 0.00 0.00 0.00 36.38 32.24 3d8t s VAL 213 CO 0.01 -0.27 0.00 0.61 0.00 0.00 0.00 175.10 175.45 3d8t n GLY 214 N 4.88 2.72 0.36 4.51 0.00 0.17 -4.45 105.19 113.38 3d8t n GLY 214 Ca -0.05 -1.28 0.09 0.00 0.00 0.00 0.00 46.02 44.78 3d8t n GLY 214 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3d8t h ARG 215 N 0.00 0.71 -0.04 1.61 0.11 -1.85 -1.61 114.38 113.31 3d8t h ARG 215 Ca 0.00 -0.04 -0.15 0.00 0.10 0.00 0.00 59.98 59.88 3d8t h ARG 215 Cb 0.00 -0.16 -0.01 0.00 1.11 0.00 0.00 29.97 30.91 3d8t h ARG 215 CO 0.00 0.47 -0.67 0.28 0.10 0.00 0.00 179.97 180.15 3d8t h VAL 216 N 0.73 1.43 -0.46 0.08 2.07 -1.97 -0.91 116.25 117.22 3d8t h VAL 216 Ca 0.38 -2.16 0.00 0.00 0.82 0.00 0.00 66.70 65.74 3d8t h VAL 216 Cb 0.50 2.14 -0.02 0.00 -1.52 0.00 0.00 31.29 32.39 3d8t h VAL 216 CO -0.15 0.63 0.29 0.74 0.02 0.00 0.00 177.57 179.10 3d8t h THR 217 N 0.12 1.13 -0.51 2.57 2.02 -1.64 -1.42 112.91 115.18 3d8t h THR 217 Ca -0.01 -0.26 0.00 0.00 0.77 0.00 0.00 66.41 66.91 3d8t h THR 217 Cb 1.19 0.48 -0.03 0.00 -1.74 0.00 0.00 68.15 68.06 3d8t h THR 217 CO 0.10 0.13 0.34 0.00 0.37 0.00 0.00 175.52 176.45 3d8t h ALA 218 N 1.15 0.65 -0.88 6.16 0.00 -1.01 -2.00 119.26 123.33 3d8t h ALA 218 Ca 0.17 -0.04 0.11 0.00 0.00 0.00 0.00 54.91 55.14 3d8t h ALA 218 Cb -0.04 -0.21 -0.08 0.00 0.00 0.00 0.00 17.79 17.46 3d8t h ALA 218 CO -0.03 0.10 0.52 -0.44 0.00 0.00 0.00 179.25 179.39 3d8t h ASP 219 N 0.69 0.74 -0.58 0.00 3.32 -0.94 -1.98 116.42 117.68 3d8t h ASP 219 Ca 0.19 0.05 -0.07 0.00 0.02 0.00 0.00 57.03 57.22 3d8t h ASP 219 Cb -0.08 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.36 3d8t h ASP 219 CO -0.04 0.41 0.09 0.00 -1.72 0.00 0.00 179.24 177.97 3d8t h ALA 220 N 1.49 0.77 0.16 3.45 0.00 -0.77 -0.37 119.26 123.98 3d8t h ALA 220 Ca 0.43 -0.26 0.01 0.00 0.00 0.00 0.00 54.91 55.10 3d8t h ALA 220 Cb 0.42 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 3d8t h ALA 220 CO -0.26 0.53 -0.21 -0.07 0.00 0.00 0.00 179.25 179.23 3d8t h LEU 221 N 0.86 -0.59 -0.95 0.00 3.38 -1.03 -1.49 115.31 115.49 3d8t h LEU 221 Ca 0.17 0.06 0.06 0.00 0.09 0.00 0.00 57.88 58.27 3d8t h LEU 221 Cb 0.43 0.22 -0.06 0.00 0.09 0.00 0.00 40.66 41.33 3d8t h LEU 221 CO 0.01 -0.31 0.61 0.03 0.09 0.00 0.00 178.44 178.88 3d8t h ARG 222 N -0.43 1.09 -1.00 1.13 3.08 -1.06 -0.19 114.38 117.01 3d8t h ARG 222 Ca 0.01 -0.07 0.11 0.00 0.07 0.00 0.00 59.98 60.11 3d8t h ARG 222 Cb 0.43 -0.25 -0.08 0.00 0.08 0.00 0.00 29.97 30.15 3d8t h ARG 222 CO -0.09 0.72 0.63 1.49 -1.07 0.00 0.00 179.97 181.65 3d8t h GLU 223 N 1.12 1.00 -0.65 0.04 4.81 -0.72 -0.08 114.58 120.10 3d8t h GLU 223 Ca 0.41 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.58 3d8t h GLU 223 Cb 0.15 -0.23 0.00 0.00 0.63 0.00 0.00 28.75 29.30 3d8t h GLU 223 CO -0.17 0.66 0.00 0.91 -0.73 0.00 0.00 179.01 179.69 3d8t n TRP 224 N -4.60 1.04 -1.05 0.92 7.02 -0.24 -4.91 117.44 115.62 3d8t n TRP 224 Ca 0.18 -0.39 -0.02 0.00 -1.02 0.00 0.00 57.50 56.25 3d8t n TRP 224 Cb 0.31 -0.23 -0.01 0.00 -2.42 0.00 0.00 31.31 28.96 3d8t n TRP 224 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3d8t n GLY 225 N 0.65 0.52 3.49 6.99 0.00 -0.04 -4.98 105.19 111.82 3d8t n GLY 225 Ca 0.16 -0.98 -0.34 0.00 0.00 0.00 0.00 46.02 44.86 3d8t n GLY 225 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3d8t s VAL 226 N -2.06 3.94 -0.46 1.61 1.01 -0.26 -4.97 120.40 119.21 3d8t s VAL 226 Ca 0.00 -0.33 -0.26 0.00 0.00 0.00 0.00 61.98 61.38 3d8t s VAL 226 Cb 0.00 -2.74 0.03 0.00 0.00 0.00 0.00 36.38 33.66 3d8t s VAL 226 CO 0.00 0.47 0.97 -0.75 0.00 0.00 0.00 175.10 175.80 3d8t s LYS 227 N 0.54 3.59 0.29 2.72 2.20 -1.26 -2.50 119.74 125.33 3d8t s LYS 227 Ca -0.02 0.28 -0.30 0.00 -0.36 0.00 0.00 55.97 55.57 3d8t s LYS 227 Cb -0.14 -3.91 -0.12 0.00 -1.51 0.00 0.00 37.83 32.14 3d8t s LYS 227 CO 0.02 -1.24 1.44 -2.30 -0.36 0.00 0.00 175.35 172.91 3d8t n PRO 228 N 7.29 2.31 -0.00 4.03 -0.02 -1.26 -4.66 135.00 142.68 3d8t n PRO 228 Ca 0.07 0.82 -0.17 0.00 -2.02 0.00 0.00 63.50 62.20 3d8t n PRO 228 Cb 0.49 -2.50 -0.11 0.00 -0.02 0.00 0.00 33.50 31.36 3d8t n PRO 228 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 3d8t h PHE 229 N 3.83 0.59 -3.78 6.00 3.57 -0.70 -3.46 116.94 122.99 3d8t h PHE 229 Ca -0.46 -0.31 -0.25 0.00 3.53 0.00 0.00 57.97 60.48 3d8t h PHE 229 Cb 1.26 -0.07 -0.28 0.00 2.79 0.00 0.00 35.95 39.65 3d8t h PHE 229 CO 0.55 1.12 -0.73 -0.47 -2.23 0.00 0.00 178.31 176.55 3d8t s TYR 230 N -3.29 0.13 -0.11 0.41 5.04 -1.20 -5.04 117.35 113.28 3d8t s TYR 230 Ca -0.13 -0.05 0.03 0.00 -2.44 0.00 0.00 57.07 54.48 3d8t s TYR 230 Cb 0.04 -0.08 0.01 0.00 0.35 0.00 0.00 41.96 42.27 3d8t s TYR 230 CO 0.81 -0.01 -0.21 0.08 -1.34 0.00 0.00 175.55 174.88 3d8t s VAL 231 N -0.10 1.94 -0.27 3.14 1.01 -1.26 -1.86 120.40 123.00 3d8t s VAL 231 Ca -0.00 -0.93 -0.11 0.00 0.00 0.00 0.00 61.98 60.94 3d8t s VAL 231 Cb -0.01 -1.70 -0.05 0.00 0.00 0.00 0.00 36.38 34.62 3d8t s VAL 231 CO -0.00 0.53 0.19 -0.62 0.00 0.00 0.00 175.10 175.20 3d8t s ASP 232 N 0.62 6.07 0.00 3.32 2.15 0.50 -4.96 116.67 124.36 3d8t s ASP 232 Ca -0.13 0.05 0.21 0.00 0.43 0.00 0.00 52.55 53.11 3d8t s ASP 232 Cb -0.17 -2.12 -0.04 0.00 -0.30 0.00 0.00 42.92 40.30 3d8t s ASP 232 CO 0.03 -0.02 0.99 -0.62 -0.17 0.00 0.00 175.17 175.39 3d8t n GLU 233 N 4.81 1.24 0.11 4.34 1.02 -1.26 0.45 120.64 131.35 3d8t n GLU 233 Ca -0.14 -0.81 0.12 0.00 -0.02 0.00 0.00 57.16 56.31 3d8t n GLU 233 Cb 0.52 -1.42 0.45 0.00 -0.02 0.00 0.00 31.44 30.97 3d8t n GLU 233 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 3d8t n THR 234 N -0.25 0.69 -3.15 2.62 -2.24 -1.26 -4.74 114.28 105.95 3d8t n THR 234 Ca 0.08 0.00 -0.22 0.00 -2.27 0.00 0.00 64.05 61.64 3d8t n THR 234 Cb 0.41 -0.88 0.05 0.00 -2.10 0.00 0.00 70.33 67.81 3d8t n THR 234 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3d8t n GLU 235 N -2.17 -5.62 -4.15 -0.78 -0.58 -1.26 -5.01 120.64 101.06 3d8t n GLU 235 Ca 0.04 0.88 -0.28 0.00 -0.42 0.00 0.00 57.16 57.38 3d8t n GLU 235 Cb 0.32 -5.75 -0.17 0.00 -0.57 0.00 0.00 31.44 25.27 3d8t n GLU 235 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 3d8t s ARG 236 N -5.84 1.95 0.32 3.49 0.52 -1.26 -5.03 118.95 113.09 3d8t s ARG 236 Ca 0.37 -0.44 0.02 0.00 -0.52 0.00 0.00 55.73 55.17 3d8t s ARG 236 Cb -0.16 -1.80 0.59 0.00 0.52 0.00 0.00 34.95 34.10 3d8t s ARG 236 CO 0.46 -0.17 1.91 1.25 0.02 0.00 0.00 175.30 178.77 3d8t h LEU 237 N 7.82 0.84 -0.95 2.53 5.85 -2.00 -1.73 115.31 127.67 3d8t h LEU 237 Ca -0.33 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.40 3d8t h LEU 237 Cb 1.15 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 41.96 3d8t h LEU 237 CO 0.47 0.53 0.60 1.23 -0.34 0.00 0.00 178.44 180.93 3d8t h GLY 238 N 0.95 1.36 1.46 3.75 0.00 -1.96 -1.55 103.07 107.09 3d8t h GLY 238 Ca 0.38 -0.54 -0.19 0.00 0.00 0.00 0.00 47.33 46.98 3d8t h GLY 238 CO -0.15 0.53 -0.74 0.23 0.00 0.00 0.00 176.54 176.42 3d8t h SER 239 N 1.30 0.63 0.14 0.19 0.87 -1.77 -1.84 113.55 113.06 3d8t h SER 239 Ca 0.34 -0.41 0.01 0.00 -1.23 0.00 0.00 61.79 60.51 3d8t h SER 239 Cb -0.10 -0.18 -0.03 0.00 -0.44 0.00 0.00 62.40 61.65 3d8t h SER 239 CO -0.07 1.16 -0.22 0.25 -0.53 0.00 0.00 176.83 177.43 3d8t h LEU 240 N 0.36 -0.60 -0.69 2.23 5.85 -1.11 0.56 115.31 121.92 3d8t h LEU 240 Ca -0.04 0.07 -0.12 0.00 0.84 0.00 0.00 57.88 58.63 3d8t h LEU 240 Cb 1.33 0.22 -0.01 0.00 0.37 0.00 0.00 40.66 42.57 3d8t h LEU 240 CO 0.13 -0.31 -0.24 -0.07 -0.34 0.00 0.00 178.44 177.62 3d8t h LEU 241 N -0.42 0.77 -0.33 2.25 3.38 -1.31 0.42 115.31 120.06 3d8t h LEU 241 Ca 0.02 -0.28 -0.07 0.00 0.09 0.00 0.00 57.88 57.64 3d8t h LEU 241 Cb 0.43 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 3d8t h LEU 241 CO -0.11 0.98 -0.07 1.56 0.09 0.00 0.00 178.44 180.89 3d8t h GLN 242 N 0.65 0.63 0.03 1.13 4.20 -1.27 -0.76 115.11 119.72 3d8t h GLN 242 Ca 0.09 -0.24 0.00 0.00 0.06 0.00 0.00 58.65 58.56 3d8t h GLN 242 Cb 0.75 -0.04 -0.00 0.00 0.30 0.00 0.00 27.48 28.49 3d8t h GLN 242 CO 0.06 0.80 -0.03 0.78 -0.67 0.00 0.00 178.83 179.78 3d8t h GLY 243 N 0.42 -0.05 0.55 3.46 0.00 0.43 -1.32 103.07 106.56 3d8t h GLY 243 Ca 0.08 0.03 0.09 0.00 0.00 0.00 0.00 47.33 47.53 3d8t h GLY 243 CO 0.03 -0.03 0.46 -2.75 0.00 0.00 0.00 176.54 174.25 3d8t h PHE 244 N -0.06 0.83 -0.59 5.60 3.57 -0.19 -1.28 116.94 124.81 3d8t h PHE 244 Ca 0.00 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.47 3d8t h PHE 244 Cb 0.06 -0.25 -0.02 0.00 2.79 0.00 0.00 35.95 38.52 3d8t h PHE 244 CO -0.09 0.35 0.13 -0.22 -2.23 0.00 0.00 178.31 176.25 3d8t h LYS 245 N 0.78 0.95 -0.67 1.11 3.64 -0.86 -2.10 116.57 119.42 3d8t h LYS 245 Ca 0.38 -0.24 -0.05 0.00 -1.27 0.00 0.00 60.65 59.48 3d8t h LYS 245 Cb 0.33 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 32.00 3d8t h LYS 245 CO -0.24 0.89 0.23 0.00 -2.27 0.00 0.00 179.45 178.06 3d8t h ARG 246 N 0.86 1.01 -0.65 1.90 3.08 -0.84 -2.17 114.38 117.58 3d8t h ARG 246 Ca 0.18 -0.19 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3d8t h ARG 246 Cb 0.37 -0.16 -0.03 0.00 0.08 0.00 0.00 29.97 30.23 3d8t h ARG 246 CO 0.00 0.85 0.42 0.00 -1.07 0.00 0.00 179.97 180.17 3d8t h ALA 247 N 1.27 1.52 0.00 0.04 0.00 -1.00 -3.52 119.26 117.58 3d8t h ALA 247 Ca 0.22 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.08 3d8t h ALA 247 Cb 0.24 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.77 3d8t h ALA 247 CO -0.01 0.44 0.00 1.28 0.00 0.00 0.00 179.25 180.95