#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pll n ARG 6 N 0.00 2.86 -1.24 -1.46 1.85 -1.26 -5.14 116.66 112.27 2pll n ARG 6 Ca 0.00 -0.00 0.02 0.00 -1.00 0.00 0.00 57.85 56.87 2pll n ARG 6 Cb 0.00 -1.03 -0.01 0.00 -1.05 0.00 0.00 32.46 30.37 2pll n ARG 6 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 177.63 180.03 2pll n THR 7 N -1.91 -1.29 -4.87 8.89 -1.04 -1.26 -3.59 114.28 109.20 2pll n THR 7 Ca -0.01 0.70 -0.26 0.00 -2.04 0.00 0.00 64.05 62.43 2pll n THR 7 Cb 0.41 -1.15 -0.15 0.00 -1.82 0.00 0.00 70.33 67.62 2pll n THR 7 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 2pll s ILE 8 N -4.73 1.61 -0.33 12.58 1.09 -0.22 -0.70 121.20 130.51 2pll s ILE 8 Ca 0.00 -0.97 0.03 0.00 -1.10 0.00 0.00 60.65 58.61 2pll s ILE 8 Cb 0.00 -1.36 0.10 0.00 -1.06 0.00 0.00 42.46 40.14 2pll s ILE 8 CO 0.00 0.37 0.05 -0.83 -0.10 0.00 0.00 174.94 174.43 2pll s GLY 9 N -0.70 1.74 0.04 6.18 0.00 0.50 -1.58 107.32 113.50 2pll s GLY 9 Ca 0.08 -2.32 -0.30 0.00 0.00 0.00 0.00 44.72 42.17 2pll s GLY 9 CO 0.00 1.07 1.18 -0.42 0.00 0.00 0.00 173.10 174.94 2pll s ILE 10 N 1.06 4.13 -0.23 0.90 -1.09 -0.34 -1.36 121.20 124.27 2pll s ILE 10 Ca 0.10 1.52 -0.00 0.00 -2.23 0.00 0.00 60.65 60.04 2pll s ILE 10 Cb -0.19 -3.97 0.06 0.00 -1.58 0.00 0.00 42.46 36.78 2pll s ILE 10 CO -0.11 0.10 -0.02 -0.63 -1.23 0.00 0.00 174.94 173.05 2pll s ILE 11 N 1.21 1.26 -0.02 2.92 1.01 0.40 -0.66 121.20 127.30 2pll s ILE 11 Ca 0.58 -1.09 -0.30 0.00 0.00 0.00 0.00 60.65 59.84 2pll s ILE 11 Cb -0.28 -1.62 -0.03 0.00 0.01 0.00 0.00 42.46 40.54 2pll s ILE 11 CO 0.28 -0.18 0.98 -0.83 0.00 0.00 0.00 174.94 175.20 2pll s GLY 12 N 1.51 2.78 -0.54 6.18 0.00 -0.27 -0.87 107.32 116.12 2pll s GLY 12 Ca -0.03 0.50 0.07 0.00 0.00 0.00 0.00 44.72 45.26 2pll s GLY 12 CO -0.08 1.74 0.67 0.00 0.00 0.00 0.00 173.10 175.43 2pll n ALA 13 N 4.15 3.43 -1.75 3.20 0.00 0.90 -0.60 120.51 129.84 2pll n ALA 13 Ca 0.07 -4.22 -0.30 0.00 0.00 0.00 0.00 53.44 48.98 2pll n ALA 13 Cb 0.50 -0.86 -0.07 0.00 0.00 0.00 0.00 19.45 19.02 2pll n ALA 13 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2pll n PRO 14 N 1.01 1.33 -4.52 0.00 -0.04 -1.26 -1.91 135.00 129.61 2pll n PRO 14 Ca 0.27 -2.18 -0.22 0.00 -0.04 0.00 0.00 63.50 61.32 2pll n PRO 14 Cb 0.46 -3.53 -0.14 0.00 -0.04 0.00 0.00 33.50 30.25 2pll n PRO 14 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 2pll s PHE 15 N 10.39 1.30 0.00 0.54 5.36 -1.26 -4.84 117.98 129.46 2pll s PHE 15 Ca 0.68 -0.30 0.00 0.00 -0.96 0.00 0.00 56.93 56.35 2pll s PHE 15 Cb 0.03 -0.80 0.00 0.00 -0.34 0.00 0.00 43.02 41.91 2pll s PHE 15 CO 0.15 0.01 0.03 -1.13 -1.46 0.00 0.00 175.22 172.82 2pll n SER 16 N 2.28 0.06 0.00 6.13 3.41 -1.26 -0.99 113.62 123.25 2pll n SER 16 Ca -0.16 -0.40 0.01 0.00 -0.26 0.00 0.00 58.87 58.05 2pll n SER 16 Cb 0.55 0.11 0.03 0.00 -0.26 0.00 0.00 64.21 64.64 2pll n SER 16 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2pll n LYS 17 N -0.11 0.37 0.00 4.33 4.76 -1.26 -1.81 118.16 124.45 2pll n LYS 17 Ca 0.00 0.00 0.12 0.00 -2.87 0.00 0.00 58.31 55.56 2pll n LYS 17 Cb 0.07 -1.05 0.30 0.00 -1.84 0.00 0.00 35.03 32.52 2pll n LYS 17 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2pll n GLY 18 N -0.14 -1.30 3.70 0.72 0.00 -1.26 -4.69 105.19 102.22 2pll n GLY 18 Ca 0.01 -0.30 -0.10 0.00 0.00 0.00 0.00 46.02 45.63 2pll n GLY 18 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2pll s GLN 19 N -3.01 1.91 0.08 1.61 1.03 -0.75 -0.87 119.66 119.67 2pll s GLN 19 Ca 0.11 -1.37 -0.29 0.00 0.04 0.00 0.00 55.36 53.86 2pll s GLN 19 Cb 0.17 0.55 -0.15 0.00 0.03 0.00 0.00 33.01 33.61 2pll s GLN 19 CO 0.68 -0.85 1.66 -1.35 -2.54 0.00 0.00 175.29 172.88 2pll h PRO 20 N 2.08 -0.56 -6.59 9.60 0.11 -1.92 -3.45 132.00 131.27 2pll h PRO 20 Ca -0.27 0.04 -0.53 0.00 0.11 0.00 0.00 66.00 65.35 2pll h PRO 20 Cb 1.25 0.13 0.03 0.00 0.11 0.00 0.00 31.00 32.51 2pll h PRO 20 CO 0.35 -0.37 0.71 1.03 -0.21 0.00 0.00 178.00 179.50 2pll s ARG 21 N -6.09 4.34 0.15 1.05 0.52 -1.26 -4.96 118.95 112.69 2pll s ARG 21 Ca -0.16 2.08 0.24 0.00 -0.52 0.00 0.00 55.73 57.37 2pll s ARG 21 Cb 0.05 -3.23 0.39 0.00 0.52 0.00 0.00 34.95 32.68 2pll s ARG 21 CO 0.64 -0.39 1.38 0.78 0.02 0.00 0.00 175.30 177.73 2pll h GLY 22 N 6.37 0.00 2.00 -3.53 0.00 -1.89 -3.37 103.07 102.66 2pll h GLY 22 Ca -0.43 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.90 2pll h GLY 22 CO 0.84 0.00 0.00 -1.33 0.00 0.00 0.00 176.54 176.05 2pll h GLY 23 N 4.46 0.00 2.00 4.60 0.00 -1.96 -2.11 103.07 110.07 2pll h GLY 23 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2pll h GLY 23 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 176.54 176.15 2pll h VAL 24 N 0.00 0.00 0.00 4.60 -1.51 -1.79 -1.72 116.25 115.83 2pll h VAL 24 Ca 0.00 -0.11 -0.00 0.00 -1.23 0.00 0.00 66.70 65.36 2pll h VAL 24 Cb 0.05 0.96 -0.00 0.00 -2.13 0.00 0.00 31.29 30.17 2pll h VAL 24 CO 0.00 0.00 -0.01 -0.33 -1.23 0.00 0.00 177.57 176.00 2pll h GLU 25 N 0.00 0.00 -0.00 5.19 5.08 -1.59 -2.25 114.58 121.01 2pll h GLU 25 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2pll h GLU 25 Cb 0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.37 2pll h GLU 25 CO 0.00 0.01 -0.11 0.39 -1.00 0.00 0.00 179.01 178.30 2pll n GLU 26 N -3.13 0.74 -0.19 2.33 -0.58 -0.65 -4.38 120.64 114.78 2pll n GLU 26 Ca -0.01 -0.26 -0.12 0.00 -0.42 0.00 0.00 57.16 56.34 2pll n GLU 26 Cb 0.19 -1.49 -0.09 0.00 -0.57 0.00 0.00 31.44 29.48 2pll n GLU 26 CO 0.00 0.00 0.00 0.78 -0.48 0.00 0.00 177.13 177.43 2pll h GLY 27 N 4.96 -1.09 0.26 0.62 0.00 -1.54 -1.07 103.07 105.20 2pll h GLY 27 Ca 0.00 0.76 0.17 0.00 0.00 0.00 0.00 47.33 48.26 2pll h GLY 27 CO 0.00 -0.15 0.62 -2.55 0.00 0.00 0.00 176.54 174.46 2pll h PRO 28 N -0.27 0.79 0.76 4.80 0.11 -1.76 -1.82 132.00 134.60 2pll h PRO 28 Ca 0.08 -0.05 -0.04 0.00 0.11 0.00 0.00 66.00 66.11 2pll h PRO 28 Cb 0.50 -0.18 0.01 0.00 0.11 0.00 0.00 31.00 31.43 2pll h PRO 28 CO -0.61 0.53 -0.36 1.15 -0.21 0.00 0.00 178.00 178.49 2pll h THR 29 N 0.82 0.03 -0.02 -1.15 2.02 -1.52 -1.21 112.91 111.87 2pll h THR 29 Ca 0.55 -0.25 -0.04 0.00 0.77 0.00 0.00 66.41 67.43 2pll h THR 29 Cb 0.78 0.03 -0.01 0.00 -1.74 0.00 0.00 68.15 67.22 2pll h THR 29 CO -0.33 0.00 -0.19 0.58 0.37 0.00 0.00 175.52 175.95 2pll h VAL 30 N -1.26 1.15 -0.26 3.16 2.07 -1.24 0.11 116.25 119.98 2pll h VAL 30 Ca -0.10 -0.70 -0.08 0.00 0.82 0.00 0.00 66.70 66.64 2pll h VAL 30 Cb 0.78 1.35 -0.01 0.00 -1.52 0.00 0.00 31.29 31.90 2pll h VAL 30 CO 0.17 0.20 -0.15 -0.07 0.02 0.00 0.00 177.57 177.74 2pll h LEU 31 N 0.03 0.58 -0.67 2.57 3.38 -1.34 -1.74 115.31 118.11 2pll h LEU 31 Ca 0.00 -0.42 -0.08 0.00 0.09 0.00 0.00 57.88 57.47 2pll h LEU 31 Cb 0.36 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.92 2pll h LEU 31 CO 0.03 0.88 0.10 0.03 0.09 0.00 0.00 178.44 179.56 2pll h ARG 32 N 0.28 1.12 0.00 1.13 3.08 -0.68 -2.25 114.38 117.07 2pll h ARG 32 Ca 0.05 -0.31 0.00 0.00 0.07 0.00 0.00 59.98 59.80 2pll h ARG 32 Cb 0.67 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.59 2pll h ARG 32 CO 0.04 1.03 0.00 0.87 -1.07 0.00 0.00 179.97 180.84 2pll h LYS 33 N 1.04 0.00 0.00 0.04 1.57 -0.67 -1.07 116.57 117.48 2pll h LYS 33 Ca 0.20 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.98 2pll h LYS 33 Cb 0.46 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.77 2pll h LYS 33 CO 0.02 0.00 -0.00 0.00 -0.57 0.00 0.00 179.45 178.89 2pll n ALA 34 N -1.88 2.32 -0.23 3.86 0.00 -0.67 -4.91 120.51 119.01 2pll n ALA 34 Ca 0.01 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.37 2pll n ALA 34 Cb 0.22 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 18.20 2pll n ALA 34 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2pll n GLY 35 N 1.46 0.98 0.22 0.00 0.00 -0.40 -4.98 105.19 102.46 2pll n GLY 35 Ca 0.07 -0.21 -0.04 0.00 0.00 0.00 0.00 46.02 45.83 2pll n GLY 35 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2pll h LEU 36 N 0.00 -0.57 -1.03 0.99 5.85 -1.66 0.24 115.31 119.13 2pll h LEU 36 Ca 0.00 0.15 -0.05 0.00 0.84 0.00 0.00 57.88 58.82 2pll h LEU 36 Cb 0.03 0.34 -0.02 0.00 0.37 0.00 0.00 40.66 41.37 2pll h LEU 36 CO 0.00 -0.20 0.11 -0.07 -0.34 0.00 0.00 178.44 177.94 2pll h LEU 37 N -0.06 0.75 -0.04 2.25 3.38 -1.88 -1.34 115.31 118.36 2pll h LEU 37 Ca 0.22 -0.14 -0.04 0.00 0.09 0.00 0.00 57.88 58.01 2pll h LEU 37 Cb 0.40 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.95 2pll h LEU 37 CO -0.50 0.76 -0.11 -0.33 0.09 0.00 0.00 178.44 178.34 2pll h GLU 38 N 0.77 0.15 0.00 1.13 3.07 -1.70 -2.32 114.58 115.69 2pll h GLU 38 Ca 0.17 -0.11 -0.03 0.00 -0.50 0.00 0.00 59.36 58.89 2pll h GLU 38 Cb 0.31 0.02 -0.00 0.00 -0.84 0.00 0.00 28.75 28.24 2pll h GLU 38 CO 0.00 0.71 -0.13 0.87 -1.40 0.00 0.00 179.01 179.07 2pll h LYS 39 N -0.38 0.00 -0.15 2.33 1.57 -0.49 0.11 116.57 119.56 2pll h LYS 39 Ca -0.00 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.66 2pll h LYS 39 Cb 0.72 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.03 2pll h LYS 39 CO 0.02 0.13 -0.35 -0.07 -0.57 0.00 0.00 179.45 178.61 2pll h LEU 40 N 0.00 0.56 -1.32 2.94 3.38 -1.21 -3.04 115.31 116.62 2pll h LEU 40 Ca -0.00 -0.57 -0.07 0.00 0.09 0.00 0.00 57.88 57.33 2pll h LEU 40 Cb 0.24 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 2pll h LEU 40 CO 0.02 1.04 -0.31 0.11 0.09 0.00 0.00 178.44 179.38 2pll h LYS 41 N 0.12 0.00 0.00 1.13 1.57 -0.91 -1.18 116.57 117.31 2pll h LYS 41 Ca -0.00 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2pll h LYS 41 Cb 0.96 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.27 2pll h LYS 41 CO 0.08 0.31 -0.01 0.93 -0.57 0.00 0.00 179.45 180.19 2pll h GLU 42 N 0.00 0.00 0.00 3.15 5.08 -0.88 -3.42 114.58 118.51 2pll h GLU 42 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2pll h GLU 42 Cb 0.65 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.90 2pll h GLU 42 CO 0.04 0.01 0.00 1.04 -1.00 0.00 0.00 179.01 179.10 2pll n GLN 43 N -3.12 1.06 -0.43 2.33 6.02 -0.44 -4.95 117.38 117.84 2pll n GLN 43 Ca -0.02 0.00 -0.08 0.00 -0.01 0.00 0.00 57.00 56.89 2pll n GLN 43 Cb 0.17 0.00 0.06 0.00 1.02 0.00 0.00 30.24 31.48 2pll n GLN 43 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 177.06 175.20 2pll n GLU 44 N -0.67 1.43 -4.12 -1.09 -0.00 -1.26 -4.92 120.64 110.01 2pll n GLU 44 Ca 0.00 -1.02 -0.34 0.00 -0.00 0.00 0.00 57.16 55.80 2pll n GLU 44 Cb 0.00 -1.40 -0.07 0.00 -0.00 0.00 0.00 31.44 29.97 2pll n GLU 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2pll s ASP 46 N -1.51 5.69 -0.12 0.00 1.01 -1.26 -4.45 116.67 116.03 2pll s ASP 46 Ca 0.20 -1.67 -0.08 0.00 0.71 0.00 0.00 52.55 51.72 2pll s ASP 46 Cb -0.12 -2.01 -0.04 0.00 1.01 0.00 0.00 42.92 41.76 2pll s ASP 46 CO 0.11 -0.61 0.16 -0.69 0.21 0.00 0.00 175.17 174.35 2pll s VAL 47 N 1.41 5.47 -0.12 -1.27 1.01 -1.26 -1.05 120.40 124.58 2pll s VAL 47 Ca 0.04 0.26 -0.02 0.00 0.00 0.00 0.00 61.98 62.26 2pll s VAL 47 Cb -0.24 -3.43 0.04 0.00 0.00 0.00 0.00 36.38 32.75 2pll s VAL 47 CO 0.01 0.60 0.00 -0.54 0.00 0.00 0.00 175.10 175.18 2pll s LYS 48 N -0.94 0.74 -0.23 2.72 -0.14 -0.61 -4.97 119.74 116.31 2pll s LYS 48 Ca 0.15 -0.14 -0.22 0.00 -1.36 0.00 0.00 55.97 54.40 2pll s LYS 48 Cb -0.12 -1.49 -0.02 0.00 -1.68 0.00 0.00 37.83 34.52 2pll s LYS 48 CO 0.04 -0.43 0.71 0.34 -0.76 0.00 0.00 175.35 175.26 2pll s ASP 49 N 1.89 6.72 -0.01 2.83 -1.08 -1.26 -1.20 116.67 124.55 2pll s ASP 49 Ca 0.03 0.88 0.14 0.00 -0.52 0.00 0.00 52.55 53.08 2pll s ASP 49 Cb -0.14 -2.38 0.44 0.00 -1.46 0.00 0.00 42.92 39.37 2pll s ASP 49 CO -0.07 -0.40 1.35 -1.22 0.52 0.00 0.00 175.17 175.35 2pll n TYR 50 N 5.64 0.71 -2.41 -5.34 4.02 0.16 -4.93 117.16 115.02 2pll n TYR 50 Ca 0.02 -0.34 0.01 0.00 -0.01 0.00 0.00 57.90 57.58 2pll n TYR 50 Cb 0.49 -0.03 -0.00 0.00 -0.02 0.00 0.00 39.34 39.77 2pll n TYR 50 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2pll n GLY 51 N 1.19 -2.11 3.65 2.72 0.00 -1.26 -4.84 105.19 104.54 2pll n GLY 51 Ca 0.16 -1.44 -0.36 0.00 0.00 0.00 0.00 46.02 44.37 2pll n GLY 51 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2pll s ASP 52 N -3.32 6.06 0.22 1.61 1.01 -1.26 -1.12 116.67 119.86 2pll s ASP 52 Ca 0.00 0.10 -0.31 0.00 0.71 0.00 0.00 52.55 53.05 2pll s ASP 52 Cb 0.00 -2.09 -0.11 0.00 1.01 0.00 0.00 42.92 41.73 2pll s ASP 52 CO 0.00 0.07 1.60 -0.76 0.21 0.00 0.00 175.17 176.29 2pll s LEU 53 N 1.05 4.37 -0.72 1.23 1.43 0.23 -4.94 118.68 121.32 2pll s LEU 53 Ca 0.07 2.78 -0.22 0.00 -1.03 0.00 0.00 54.13 55.74 2pll s LEU 53 Cb -0.14 -3.61 0.08 0.00 0.03 0.00 0.00 46.19 42.56 2pll s LEU 53 CO 0.04 -0.87 1.00 -2.16 0.23 0.00 0.00 176.35 174.59 2pll s PRO 54 N 0.54 3.21 -0.50 1.29 0.04 -1.26 -4.64 135.00 133.68 2pll s PRO 54 Ca 0.68 -1.03 -0.24 0.00 0.04 0.00 0.00 61.00 60.46 2pll s PRO 54 Cb -0.46 -4.39 0.03 0.00 0.04 0.00 0.00 34.50 29.72 2pll s PRO 54 CO 0.37 -1.82 0.89 -0.06 0.04 0.00 0.00 177.00 176.43 2pll s PHE 55 N 3.80 2.89 0.78 0.56 0.08 -1.26 -5.02 117.98 119.81 2pll s PHE 55 Ca 0.24 0.14 -0.15 0.00 0.12 0.00 0.00 56.93 57.29 2pll s PHE 55 Cb -0.14 -3.93 0.04 0.00 -0.57 0.00 0.00 43.02 38.42 2pll s PHE 55 CO 0.06 -1.18 1.00 0.00 -0.10 0.00 0.00 175.22 175.00 2pll n ALA 56 N 7.16 -0.42 -2.71 5.36 0.00 -1.26 -4.95 120.51 123.69 2pll n ALA 56 Ca 0.03 -0.29 -0.41 0.00 0.00 0.00 0.00 53.44 52.77 2pll n ALA 56 Cb 0.48 -2.13 -0.04 0.00 0.00 0.00 0.00 19.45 17.76 2pll n ALA 56 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2pll s ASP 57 N -1.87 7.11 -0.56 0.00 3.68 -1.26 -5.02 116.67 118.75 2pll s ASP 57 Ca 0.71 1.34 -0.04 0.00 2.13 0.00 0.00 52.55 56.69 2pll s ASP 57 Cb -0.31 -2.47 0.15 0.00 -1.45 0.00 0.00 42.92 38.83 2pll s ASP 57 CO 0.52 -0.22 0.39 -0.63 0.13 0.00 0.00 175.17 175.36 2pll s ILE 58 N 1.14 3.78 0.17 4.11 1.09 -1.26 -4.94 121.20 125.28 2pll s ILE 58 Ca 0.42 -2.55 -0.12 0.00 -1.10 0.00 0.00 60.65 57.30 2pll s ILE 58 Cb -0.19 -3.49 0.07 0.00 -1.06 0.00 0.00 42.46 37.80 2pll s ILE 58 CO 0.20 -0.83 1.73 -0.65 -0.10 0.00 0.00 174.94 175.29 2pll h PRO 59 N 7.52 0.86 -4.67 2.79 0.11 -2.04 -3.36 132.00 133.20 2pll h PRO 59 Ca -0.06 -0.15 -0.71 0.00 0.11 0.00 0.00 66.00 65.18 2pll h PRO 59 Cb 1.00 -0.14 -0.20 0.00 0.11 0.00 0.00 31.00 31.77 2pll h PRO 59 CO 0.73 0.74 0.43 -0.80 -0.21 0.00 0.00 178.00 178.88 2pll s ASN 60 N -6.07 6.50 -0.41 -2.05 0.01 -1.26 -4.83 114.94 106.83 2pll s ASN 60 Ca -0.13 -1.94 0.10 0.00 -0.71 0.00 0.00 52.86 50.18 2pll s ASN 60 Cb 0.13 -2.33 0.34 0.00 0.41 0.00 0.00 41.25 39.80 2pll s ASN 60 CO 0.79 -0.99 0.89 -0.67 -1.51 0.00 0.00 177.10 175.61 2pll n ASP 61 N 5.96 -0.46 -4.76 -1.22 2.03 -1.26 -4.99 116.55 111.85 2pll n ASP 61 Ca 0.10 -3.29 -0.35 0.00 0.52 0.00 0.00 54.79 51.77 2pll n ASP 61 Cb 0.46 0.42 0.03 0.00 -0.72 0.00 0.00 41.12 41.31 2pll n ASP 61 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 2pll s SER 62 N -1.96 5.34 0.68 1.67 0.01 -1.26 -4.11 113.70 114.07 2pll s SER 62 Ca 0.33 2.21 -0.17 0.00 1.31 0.00 0.00 55.95 59.63 2pll s SER 62 Cb 0.33 -2.58 -0.04 0.00 0.21 0.00 0.00 66.02 63.94 2pll s SER 62 CO -0.07 -1.48 0.68 -2.65 0.41 0.00 0.00 173.24 170.13 2pll n PRO 63 N -1.71 0.46 -3.60 12.44 -0.02 -1.26 -4.70 135.00 136.62 2pll n PRO 63 Ca 0.12 0.20 -0.40 0.00 -2.02 0.00 0.00 63.50 61.40 2pll n PRO 63 Cb 0.51 -1.94 -0.09 0.00 -0.02 0.00 0.00 33.50 31.96 2pll n PRO 63 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 2pll s PHE 64 N -1.80 3.39 0.00 6.00 5.36 0.15 -4.92 117.98 126.16 2pll s PHE 64 Ca 0.69 -1.72 0.00 0.00 -0.96 0.00 0.00 56.93 54.95 2pll s PHE 64 Cb -0.37 -3.18 0.00 0.00 -0.34 0.00 0.00 43.02 39.13 2pll s PHE 64 CO 0.54 -0.91 0.00 1.04 -1.46 0.00 0.00 175.22 174.43 2pll n GLN 65 N 4.89 0.00 0.01 10.12 6.02 -1.26 -0.06 117.38 137.11 2pll n GLN 65 Ca -0.09 0.00 0.11 0.00 -0.01 0.00 0.00 57.00 57.01 2pll n GLN 65 Cb 0.42 0.00 -0.03 0.00 1.02 0.00 0.00 30.24 31.65 2pll n GLN 65 CO 0.00 0.00 0.00 1.51 -1.01 0.00 0.00 177.06 177.56 2pll n ILE 66 N 0.00 0.09 -2.08 5.09 3.06 -1.26 -4.92 119.36 119.34 2pll n ILE 66 Ca 0.00 -0.21 -0.42 0.00 -2.50 0.00 0.00 62.75 59.62 2pll n ILE 66 Cb 0.00 0.38 -0.03 0.00 0.54 0.00 0.00 39.64 40.53 2pll n ILE 66 CO 0.00 0.00 0.00 -0.69 -2.50 0.00 0.00 176.55 173.36 2pll s VAL 67 N -3.19 3.50 0.07 9.51 1.01 0.92 -4.32 120.40 127.91 2pll s VAL 67 Ca 0.03 0.82 -0.05 0.00 0.00 0.00 0.00 61.98 62.79 2pll s VAL 67 Cb 0.15 -3.53 -0.05 0.00 0.00 0.00 0.00 36.38 32.95 2pll s VAL 67 CO 0.83 -0.03 0.30 -0.54 0.00 0.00 0.00 175.10 175.66 2pll s LYS 68 N 3.04 3.57 -1.56 2.72 1.02 -0.62 0.31 119.74 128.21 2pll s LYS 68 Ca 0.69 -0.15 -0.05 0.00 0.02 0.00 0.00 55.97 56.48 2pll s LYS 68 Cb -0.34 -2.98 0.05 0.00 -0.52 0.00 0.00 37.83 34.04 2pll s LYS 68 CO 0.28 0.57 0.32 0.09 -0.92 0.00 0.00 175.35 175.69 2pll n ASN 69 N 0.52 -0.40 -0.13 2.83 3.02 -1.26 -4.62 115.26 115.23 2pll n ASN 69 Ca -0.06 -1.15 -0.08 0.00 -0.03 0.00 0.00 54.58 53.26 2pll n ASN 69 Cb 0.52 -2.25 0.00 0.00 -0.61 0.00 0.00 39.78 37.44 2pll n ASN 69 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 2pll h PRO 70 N -1.66 0.53 -0.49 3.52 0.13 -1.82 -2.05 132.00 130.17 2pll h PRO 70 Ca -0.63 -0.04 -0.09 0.00 -0.87 0.00 0.00 66.00 64.36 2pll h PRO 70 Cb 1.39 -0.12 -0.02 0.00 0.13 0.00 0.00 31.00 32.38 2pll h PRO 70 CO 0.71 0.37 -0.08 0.00 -0.23 0.00 0.00 178.00 178.78 2pll h ARG 71 N 0.54 0.87 -0.15 0.86 3.08 -1.88 0.16 114.38 117.86 2pll h ARG 71 Ca 0.15 -0.28 -0.03 0.00 0.07 0.00 0.00 59.98 59.88 2pll h ARG 71 Cb -0.04 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 29.93 2pll h ARG 71 CO -0.03 0.92 -0.02 0.77 -1.07 0.00 0.00 179.97 180.53 2pll h SER 72 N 0.79 0.28 -0.25 7.04 0.02 -1.87 0.02 113.55 119.57 2pll h SER 72 Ca 0.13 -0.35 -0.12 0.00 -0.84 0.00 0.00 61.79 60.62 2pll h SER 72 Cb 0.58 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 63.03 2pll h SER 72 CO 0.04 0.56 -0.27 0.58 -1.14 0.00 0.00 176.83 176.60 2pll h VAL 73 N -0.01 1.28 -0.45 2.27 2.07 -1.33 -1.30 116.25 118.78 2pll h VAL 73 Ca 0.04 -1.39 -0.06 0.00 0.82 0.00 0.00 66.70 66.11 2pll h VAL 73 Cb 0.43 1.29 -0.02 0.00 -1.52 0.00 0.00 31.29 31.47 2pll h VAL 73 CO 0.01 0.46 0.06 1.23 0.02 0.00 0.00 177.57 179.35 2pll h GLY 74 N 0.97 0.80 1.34 2.17 0.00 -0.55 -2.21 103.07 105.59 2pll h GLY 74 Ca 0.08 -0.54 -0.16 0.00 0.00 0.00 0.00 47.33 46.70 2pll h GLY 74 CO 0.06 0.50 -0.50 1.70 0.00 0.00 0.00 176.54 178.31 2pll h LYS 75 N 0.61 0.70 -0.90 4.80 1.63 -0.94 -1.86 116.57 120.60 2pll h LYS 75 Ca 0.13 -0.41 -0.02 0.00 -0.85 0.00 0.00 60.65 59.50 2pll h LYS 75 Cb 0.40 0.04 -0.04 0.00 -0.60 0.00 0.00 32.23 32.02 2pll h LYS 75 CO 0.01 1.03 0.50 0.00 -3.45 0.00 0.00 179.45 177.55 2pll h ALA 76 N 0.89 1.19 0.04 5.00 0.00 -1.09 0.20 119.26 125.49 2pll h ALA 76 Ca 0.02 -0.13 -0.25 0.00 0.00 0.00 0.00 54.91 54.56 2pll h ALA 76 Cb 1.06 -0.36 0.01 0.00 0.00 0.00 0.00 17.79 18.50 2pll h ALA 76 CO 0.10 0.66 -1.05 0.77 0.00 0.00 0.00 179.25 179.73 2pll h SER 77 N 1.26 0.65 -0.82 0.00 0.02 -1.37 -1.50 113.55 111.79 2pll h SER 77 Ca 0.32 -0.55 -0.01 0.00 -0.84 0.00 0.00 61.79 60.70 2pll h SER 77 Cb 0.01 -0.20 -0.04 0.00 0.14 0.00 0.00 62.40 62.31 2pll h SER 77 CO -0.05 1.37 0.46 -0.08 -1.14 0.00 0.00 176.83 177.38 2pll h GLU 78 N 0.25 1.13 -0.19 3.45 4.81 -1.07 0.13 114.58 123.10 2pll h GLU 78 Ca -0.11 -0.13 -0.02 0.00 -0.13 0.00 0.00 59.36 58.97 2pll h GLU 78 Cb 1.71 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 30.86 2pll h GLU 78 CO 0.19 0.83 0.03 0.37 -0.73 0.00 0.00 179.01 179.70 2pll h GLN 79 N 1.13 0.31 -0.75 1.92 4.15 -0.92 -2.96 115.11 117.99 2pll h GLN 79 Ca 0.29 -0.08 -0.04 0.00 0.77 0.00 0.00 58.65 59.58 2pll h GLN 79 Cb 0.02 -0.04 -0.03 0.00 0.21 0.00 0.00 27.48 27.64 2pll h GLN 79 CO -0.05 0.48 0.30 1.25 -1.93 0.00 0.00 178.83 178.87 2pll h LEU 80 N 0.10 1.03 -0.62 -2.39 5.85 -0.91 -2.90 115.31 115.47 2pll h LEU 80 Ca 0.06 -0.16 0.04 0.00 0.84 0.00 0.00 57.88 58.66 2pll h LEU 80 Cb 0.32 -0.27 -0.05 0.00 0.37 0.00 0.00 40.66 41.04 2pll h LEU 80 CO 0.00 0.91 0.36 0.00 -0.34 0.00 0.00 178.44 179.37 2pll h ALA 81 N 1.23 0.81 -0.61 1.25 0.00 -0.65 -1.20 119.26 120.09 2pll h ALA 81 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.16 2pll h ALA 81 Cb 0.21 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 2pll h ALA 81 CO -0.02 0.06 0.38 0.78 0.00 0.00 0.00 179.25 180.45 2pll h GLY 82 N 0.68 0.87 0.83 0.00 0.00 -1.35 -1.79 103.07 102.31 2pll h GLY 82 Ca 0.26 -0.35 -0.02 0.00 0.00 0.00 0.00 47.33 47.23 2pll h GLY 82 CO -0.14 0.34 0.04 0.50 0.00 0.00 0.00 176.54 177.28 2pll h LYS 83 N 0.82 0.25 -0.55 4.80 1.79 -1.31 -2.55 116.57 119.82 2pll h LYS 83 Ca 0.22 -0.06 0.04 0.00 -2.18 0.00 0.00 60.65 58.67 2pll h LYS 83 Cb -0.05 -0.03 -0.04 0.00 -1.58 0.00 0.00 32.23 30.52 2pll h LYS 83 CO -0.04 0.40 0.30 0.28 -1.08 0.00 0.00 179.45 179.30 2pll h VAL 84 N 0.06 0.98 -0.47 0.50 2.07 -1.13 -1.63 116.25 116.63 2pll h VAL 84 Ca 0.05 -0.20 0.01 0.00 0.82 0.00 0.00 66.70 67.38 2pll h VAL 84 Cb 0.26 0.36 -0.03 0.00 -1.52 0.00 0.00 31.29 30.36 2pll h VAL 84 CO 0.00 0.11 0.30 0.00 0.02 0.00 0.00 177.57 177.99 2pll h ALA 85 N 1.28 0.59 0.16 1.67 0.00 -1.28 -1.06 119.26 120.62 2pll h ALA 85 Ca 0.24 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.14 2pll h ALA 85 Cb 0.12 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.70 2pll h ALA 85 CO -0.15 0.01 -0.34 1.49 0.00 0.00 0.00 179.25 180.26 2pll h GLU 86 N 0.60 -0.57 -0.54 0.00 4.57 -0.99 0.36 114.58 118.02 2pll h GLU 86 Ca 0.18 0.04 0.01 0.00 -1.18 0.00 0.00 59.36 58.40 2pll h GLU 86 Cb -0.04 0.13 -0.03 0.00 -0.16 0.00 0.00 28.75 28.66 2pll h GLU 86 CO -0.06 -0.38 0.36 -0.24 -1.18 0.00 0.00 179.01 177.51 2pll h VAL 87 N -0.59 1.13 -0.52 0.32 3.04 -1.18 -0.63 116.25 117.83 2pll h VAL 87 Ca 0.02 -0.25 -0.11 0.00 -1.01 0.00 0.00 66.70 65.35 2pll h VAL 87 Cb 0.60 0.35 -0.02 0.00 -2.01 0.00 0.00 31.29 30.21 2pll h VAL 87 CO -0.18 0.13 -0.11 0.11 -1.01 0.00 0.00 177.57 176.52 2pll h LYS 88 N 0.72 0.98 0.00 4.17 1.79 -0.47 -1.67 116.57 122.10 2pll h LYS 88 Ca 0.20 -0.37 -0.01 0.00 -2.18 0.00 0.00 60.65 58.29 2pll h LYS 88 Cb -0.07 -0.06 -0.00 0.00 -1.58 0.00 0.00 32.23 30.52 2pll h LYS 88 CO -0.04 1.04 -0.06 0.87 -1.08 0.00 0.00 179.45 180.18 2pll h LYS 89 N 0.85 0.00 -0.14 3.15 1.57 0.87 -1.09 116.57 121.78 2pll h LYS 89 Ca 0.13 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.91 2pll h LYS 89 Cb 0.67 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.98 2pll h LYS 89 CO 0.05 0.06 0.00 0.09 -0.57 0.00 0.00 179.45 179.07 2pll n ASN 90 N -3.32 1.07 -1.30 0.86 3.02 -0.36 -4.91 115.26 110.31 2pll n ASN 90 Ca -0.01 -1.72 -0.09 0.00 -0.03 0.00 0.00 54.58 52.73 2pll n ASN 90 Cb 0.22 -0.09 0.01 0.00 -0.61 0.00 0.00 39.78 39.32 2pll n ASN 90 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2pll n GLY 91 N 0.95 0.18 3.29 7.41 0.00 -0.41 -5.05 105.19 111.57 2pll n GLY 91 Ca 0.13 -0.43 -0.19 0.00 0.00 0.00 0.00 46.02 45.53 2pll n GLY 91 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2pll s ARG 92 N -4.92 1.18 -0.17 1.61 0.52 -1.01 -4.63 118.95 111.54 2pll s ARG 92 Ca 0.11 -1.40 -0.28 0.00 -0.52 0.00 0.00 55.73 53.63 2pll s ARG 92 Cb -0.05 -1.05 -0.00 0.00 0.52 0.00 0.00 34.95 34.37 2pll s ARG 92 CO 0.13 0.19 0.98 0.42 0.02 0.00 0.00 175.30 177.05 2pll s ILE 93 N -2.45 4.76 0.02 1.52 1.01 0.12 -4.19 121.20 122.00 2pll s ILE 93 Ca 0.15 1.95 -0.30 0.00 0.00 0.00 0.00 60.65 62.45 2pll s ILE 93 Cb -0.03 -4.27 -0.04 0.00 0.01 0.00 0.00 42.46 38.13 2pll s ILE 93 CO 0.05 -0.06 0.99 -0.94 0.00 0.00 0.00 174.94 174.97 2pll s SER 94 N 1.16 7.38 -0.29 3.58 1.04 -1.08 -0.37 113.70 125.11 2pll s SER 94 Ca 0.44 1.70 0.03 0.00 0.48 0.00 0.00 55.95 58.60 2pll s SER 94 Cb -0.17 -2.57 0.08 0.00 0.10 0.00 0.00 66.02 63.46 2pll s SER 94 CO 0.12 -0.24 -0.02 -0.22 0.98 0.00 0.00 173.24 173.86 2pll s LEU 95 N 0.82 3.70 -0.34 2.42 0.20 -0.46 -0.16 118.68 124.86 2pll s LEU 95 Ca 0.51 -1.67 -0.17 0.00 0.69 0.00 0.00 54.13 53.49 2pll s LEU 95 Cb -0.22 -1.45 -0.01 0.00 -0.43 0.00 0.00 46.19 44.08 2pll s LEU 95 CO 0.28 -0.29 0.46 -0.69 -0.29 0.00 0.00 176.35 175.83 2pll s VAL 96 N 1.12 5.07 -0.49 1.68 1.01 0.26 -0.45 120.40 128.60 2pll s VAL 96 Ca 0.01 0.31 -0.23 0.00 0.00 0.00 0.00 61.98 62.07 2pll s VAL 96 Cb -0.19 -3.90 0.04 0.00 0.00 0.00 0.00 36.38 32.33 2pll s VAL 96 CO -0.08 -0.14 0.80 -0.76 0.00 0.00 0.00 175.10 174.92 2pll s LEU 97 N 2.26 4.34 0.00 3.92 1.43 -0.04 -1.60 118.68 128.99 2pll s LEU 97 Ca 0.17 -0.34 0.07 0.00 -1.03 0.00 0.00 54.13 52.99 2pll s LEU 97 Cb -0.16 -2.82 0.07 0.00 0.03 0.00 0.00 46.19 43.32 2pll s LEU 97 CO 0.12 -1.01 0.59 0.61 0.23 0.00 0.00 176.35 176.89 2pll n GLY 98 N 5.07 2.01 0.00 -3.19 0.00 -0.63 -0.07 105.19 108.38 2pll n GLY 98 Ca 0.00 -2.21 0.00 0.00 0.00 0.00 0.00 46.02 43.82 2pll n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2pll n GLY 99 N -0.35 1.08 3.87 -0.02 0.00 -0.80 -4.22 105.19 104.74 2pll n GLY 99 Ca 0.12 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 2pll n GLY 99 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2pll s ASP 100 N -0.04 5.90 0.00 1.61 1.47 -0.16 -1.83 116.67 123.62 2pll s ASP 100 Ca 0.00 1.35 0.11 0.00 1.18 0.00 0.00 52.55 55.20 2pll s ASP 100 Cb 0.00 -2.31 0.59 0.00 -0.34 0.00 0.00 42.92 40.86 2pll s ASP 100 CO 0.00 -1.08 1.21 1.57 0.68 0.00 0.00 175.17 177.55 2pll n HIS 101 N -2.87 0.00 0.26 2.11 -0.00 -1.26 -2.99 115.22 110.47 2pll n HIS 101 Ca 0.06 0.00 0.13 0.00 -0.00 0.00 0.00 57.72 57.91 2pll n HIS 101 Cb 0.55 -0.20 0.67 0.00 -0.00 0.00 0.00 29.99 31.01 2pll n HIS 101 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.34 177.00 2pll h SER 102 N 0.00 0.00 0.13 0.26 4.64 -1.79 -2.27 113.55 114.52 2pll h SER 102 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2pll h SER 102 Cb 0.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 2pll h SER 102 CO 0.00 0.13 0.00 -0.07 -0.87 0.00 0.00 176.83 176.02 2pll h LEU 103 N 0.00 0.00 -2.23 5.97 3.38 -1.90 -1.83 115.31 118.69 2pll h LEU 103 Ca -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 2pll h LEU 103 Cb 0.46 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.21 2pll h LEU 103 CO 0.02 0.00 -0.04 0.00 0.09 0.00 0.00 178.44 178.50 2pll h ALA 104 N 2.02 1.52 -0.31 1.53 0.00 -1.68 -0.12 119.26 122.22 2pll h ALA 104 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2pll h ALA 104 Cb 0.07 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2pll h ALA 104 CO 0.00 0.05 0.20 0.82 0.00 0.00 0.00 179.25 180.32 2pll h ILE 105 N 0.00 1.09 0.02 0.00 2.04 -1.56 -0.02 117.51 119.07 2pll h ILE 105 Ca -0.00 -0.19 -0.23 0.00 1.00 0.00 0.00 64.86 65.44 2pll h ILE 105 Cb 0.11 0.66 0.00 0.00 -0.74 0.00 0.00 36.82 36.85 2pll h ILE 105 CO 0.01 0.09 -0.98 1.23 0.00 0.00 0.00 178.15 178.50 2pll h GLY 106 N 0.42 0.44 0.85 5.37 0.00 -1.43 -2.35 103.07 106.37 2pll h GLY 106 Ca 0.11 -0.80 -0.02 0.00 0.00 0.00 0.00 47.33 46.62 2pll h GLY 106 CO -0.02 0.71 0.05 0.23 0.00 0.00 0.00 176.54 177.50 2pll h SER 107 N 0.21 0.30 0.33 0.19 0.87 -0.89 -0.15 113.55 114.42 2pll h SER 107 Ca -0.09 -0.23 -0.20 0.00 -1.23 0.00 0.00 61.79 60.04 2pll h SER 107 Cb 1.62 -0.08 -0.00 0.00 -0.44 0.00 0.00 62.40 63.50 2pll h SER 107 CO 0.17 0.45 -0.83 0.40 -0.53 0.00 0.00 176.83 176.49 2pll h ILE 108 N 0.13 1.40 0.07 2.23 2.04 -1.10 -2.61 117.51 119.67 2pll h ILE 108 Ca 0.06 -2.32 -0.00 0.00 1.00 0.00 0.00 64.86 63.60 2pll h ILE 108 Cb 0.27 2.28 0.00 0.00 -0.74 0.00 0.00 36.82 38.63 2pll h ILE 108 CO 0.00 0.69 -0.03 0.28 0.00 0.00 0.00 178.15 179.09 2pll h SER 109 N 0.24 -0.08 -0.82 1.72 0.02 -1.35 -0.58 113.55 112.70 2pll h SER 109 Ca -0.05 -0.20 0.02 0.00 -0.84 0.00 0.00 61.79 60.71 2pll h SER 109 Cb 1.44 0.02 -0.04 0.00 0.14 0.00 0.00 62.40 63.95 2pll h SER 109 CO 0.14 0.16 0.53 1.23 -1.14 0.00 0.00 176.83 177.75 2pll h GLY 110 N -0.32 1.16 0.99 -3.77 0.00 -1.09 -2.29 103.07 97.75 2pll h GLY 110 Ca -0.01 -0.41 -0.00 0.00 0.00 0.00 0.00 47.33 46.91 2pll h GLY 110 CO 0.02 0.38 0.23 0.84 0.00 0.00 0.00 176.54 178.01 2pll h HIS 111 N 1.07 0.47 0.00 5.60 6.17 -1.35 -2.76 115.15 124.35 2pll h HIS 111 Ca 0.31 0.00 -0.04 0.00 0.71 0.00 0.00 60.37 61.36 2pll h HIS 111 Cb -0.07 -0.16 -0.01 0.00 2.52 0.00 0.00 27.41 29.70 2pll h HIS 111 CO -0.02 0.33 -0.17 0.00 0.71 0.00 0.00 177.93 178.77 2pll h ALA 112 N 1.11 1.39 -0.88 5.26 0.00 -0.79 -0.13 119.26 125.22 2pll h ALA 112 Ca 0.13 -0.16 0.05 0.00 0.00 0.00 0.00 54.91 54.93 2pll h ALA 112 Cb -0.02 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.69 2pll h ALA 112 CO -0.03 0.22 0.58 0.00 0.00 0.00 0.00 179.25 180.02 2pll h ARG 113 N 0.00 1.02 0.00 0.00 3.08 -1.11 0.72 114.38 118.10 2pll h ARG 113 Ca -0.00 -0.06 -0.19 0.00 0.07 0.00 0.00 59.98 59.80 2pll h ARG 113 Cb 0.39 -0.23 -0.03 0.00 0.08 0.00 0.00 29.97 30.18 2pll h ARG 113 CO 0.02 0.68 -1.69 0.28 -1.07 0.00 0.00 179.97 178.19 2pll n VAL 114 N -4.46 1.08 -3.25 2.04 0.31 -0.89 -4.63 118.33 108.53 2pll n VAL 114 Ca 0.12 -0.70 -0.25 0.00 -0.01 0.00 0.00 64.34 63.50 2pll n VAL 114 Cb 0.15 -0.60 -0.08 0.00 -0.91 0.00 0.00 33.84 32.41 2pll n VAL 114 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 2pll n HIS 115 N -2.78 -0.43 0.30 3.52 8.25 -0.11 -4.98 115.22 118.99 2pll n HIS 115 Ca -0.14 -3.51 0.15 0.00 -0.26 0.00 0.00 57.72 53.96 2pll n HIS 115 Cb 0.87 -0.21 0.81 0.00 1.12 0.00 0.00 29.99 32.59 2pll n HIS 115 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2pll h PRO 116 N 4.40 0.00 -0.55 -0.41 0.13 -1.11 -1.51 132.00 132.96 2pll h PRO 116 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 2pll h PRO 116 Cb 0.88 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.01 2pll h PRO 116 CO 0.45 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 177.82 2pll n ASP 117 N -2.76 2.86 -4.71 1.44 5.75 -1.26 -4.96 116.55 112.91 2pll n ASP 117 Ca -0.02 -2.19 -0.32 0.00 -0.01 0.00 0.00 54.79 52.25 2pll n ASP 117 Cb 0.29 -0.40 0.12 0.00 -1.03 0.00 0.00 41.12 40.10 2pll n ASP 117 CO 0.00 0.00 0.00 -1.48 -0.11 0.00 0.00 177.20 175.61 2pll s LEU 118 N -1.22 3.06 0.01 -2.12 0.05 -0.57 -4.53 118.68 113.36 2pll s LEU 118 Ca 0.30 2.15 0.08 0.00 0.05 0.00 0.00 54.13 56.71 2pll s LEU 118 Cb 0.19 -4.56 -0.02 0.00 -2.05 0.00 0.00 46.19 39.74 2pll s LEU 118 CO 0.16 -2.54 -0.24 -0.83 -0.55 0.00 0.00 176.35 172.36 2pll s GLY 119 N -2.62 1.19 -0.09 -3.48 0.00 -0.01 -4.95 107.32 97.36 2pll s GLY 119 Ca 0.68 -1.07 0.01 0.00 0.00 0.00 0.00 44.72 44.34 2pll s GLY 119 CO 0.53 -0.93 -0.11 0.14 0.00 0.00 0.00 173.10 172.72 2pll s VAL 120 N -0.65 3.27 -0.19 1.40 1.01 0.43 -0.04 120.40 125.62 2pll s VAL 120 Ca 0.09 -0.62 -0.01 0.00 0.00 0.00 0.00 61.98 61.44 2pll s VAL 120 Cb -0.09 -2.33 0.00 0.00 0.00 0.00 0.00 36.38 33.96 2pll s VAL 120 CO 0.00 0.56 -0.13 -0.63 0.00 0.00 0.00 175.10 174.90 2pll s ILE 121 N -0.33 2.68 -0.38 2.22 1.09 -0.46 -0.67 121.20 125.34 2pll s ILE 121 Ca 0.04 -0.74 -0.02 0.00 -1.10 0.00 0.00 60.65 58.82 2pll s ILE 121 Cb -0.13 -2.17 0.09 0.00 -1.06 0.00 0.00 42.46 39.20 2pll s ILE 121 CO 0.02 0.49 0.15 0.86 -0.10 0.00 0.00 174.94 176.36 2pll s TRP 122 N 1.24 3.52 -0.28 3.97 -0.11 0.26 -0.92 118.94 126.62 2pll s TRP 122 Ca 0.03 -2.30 -0.20 0.00 1.22 0.00 0.00 56.10 54.85 2pll s TRP 122 Cb -0.14 -2.93 -0.01 0.00 -1.50 0.00 0.00 33.47 28.88 2pll s TRP 122 CO -0.06 -0.93 0.62 0.08 -4.62 0.00 0.00 176.95 172.04 2pll s VAL 123 N 1.16 4.96 -0.15 5.86 1.01 -0.70 -1.41 120.40 131.13 2pll s VAL 123 Ca 0.05 0.96 -0.33 0.00 0.00 0.00 0.00 61.98 62.67 2pll s VAL 123 Cb -0.22 -3.96 0.13 0.00 0.00 0.00 0.00 36.38 32.33 2pll s VAL 123 CO -0.04 -0.06 1.12 -0.62 0.00 0.00 0.00 175.10 175.50 2pll s ASP 124 N 1.57 -0.21 0.07 3.32 -1.08 -0.75 -1.09 116.67 118.51 2pll s ASP 124 Ca 0.25 0.03 0.25 0.00 -0.52 0.00 0.00 52.55 52.57 2pll s ASP 124 Cb -0.15 0.21 0.59 0.00 -1.46 0.00 0.00 42.92 42.11 2pll s ASP 124 CO 0.10 -0.33 1.50 0.00 0.52 0.00 0.00 175.17 176.96 2pll n ALA 125 N -0.03 2.95 -2.43 3.66 0.00 -1.26 -2.07 120.51 121.33 2pll n ALA 125 Ca -0.03 -0.23 -0.22 0.00 0.00 0.00 0.00 53.44 52.96 2pll n ALA 125 Cb 0.59 -1.24 -0.11 0.00 0.00 0.00 0.00 19.45 18.70 2pll n ALA 125 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 2pll s HIS 126 N -3.08 1.92 -0.51 0.00 3.76 -1.26 -1.44 115.29 114.67 2pll s HIS 126 Ca 0.09 -0.46 0.24 0.00 -0.15 0.00 0.00 55.06 54.78 2pll s HIS 126 Cb 0.15 -0.92 0.22 0.00 1.11 0.00 0.00 32.58 33.15 2pll s HIS 126 CO 0.67 0.42 1.23 1.79 -0.85 0.00 0.00 174.74 178.00 2pll h THR 127 N 2.91 0.00 -6.73 1.30 1.35 -1.90 -3.47 112.91 106.37 2pll h THR 127 Ca -0.41 -0.66 -0.54 0.00 -0.55 0.00 0.00 66.41 64.25 2pll h THR 127 Cb 1.22 1.21 -0.26 0.00 -1.73 0.00 0.00 68.15 68.59 2pll h THR 127 CO 0.55 0.00 -0.80 0.47 -0.25 0.00 0.00 175.52 175.49 2pll n ASP 128 N -2.31 -2.66 -0.71 5.36 8.00 -1.26 -4.72 116.55 118.24 2pll n ASP 128 Ca 0.02 -0.97 0.08 0.00 0.71 0.00 0.00 54.79 54.63 2pll n ASP 128 Cb 0.48 -2.23 0.22 0.00 -0.02 0.00 0.00 41.12 39.56 2pll n ASP 128 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2pll n ILE 129 N -4.12 1.98 -2.18 0.53 3.06 -1.23 -1.15 119.36 116.25 2pll n ILE 129 Ca 0.09 -1.76 -0.36 0.00 -2.50 0.00 0.00 62.75 58.21 2pll n ILE 129 Cb 0.48 -0.11 0.01 0.00 0.54 0.00 0.00 39.64 40.56 2pll n ILE 129 CO 0.00 0.00 0.00 0.20 -2.50 0.00 0.00 176.55 174.25 2pll s ASN 130 N -1.88 5.80 0.48 9.51 0.01 -0.94 -4.37 114.94 123.56 2pll s ASN 130 Ca 0.36 2.32 0.08 0.00 -0.71 0.00 0.00 52.86 54.91 2pll s ASN 130 Cb 0.29 -2.60 0.04 0.00 0.41 0.00 0.00 41.25 39.38 2pll s ASN 130 CO 0.09 -1.17 0.66 0.42 -1.51 0.00 0.00 177.10 175.59 2pll s THR 131 N -1.60 2.71 -0.71 1.60 -4.23 -1.26 -4.25 115.64 107.90 2pll s THR 131 Ca 0.69 -0.96 0.13 0.00 -1.18 0.00 0.00 61.69 60.38 2pll s THR 131 Cb -0.28 -2.75 0.13 0.00 1.34 0.00 0.00 72.50 70.93 2pll s THR 131 CO 0.33 0.00 1.41 -2.65 -0.54 0.00 0.00 174.62 173.17 2pll n PRO 132 N -2.04 0.07 -0.00 3.99 -0.02 -1.26 -2.00 135.00 133.74 2pll n PRO 132 Ca 0.10 0.45 0.06 0.00 -2.02 0.00 0.00 63.50 62.09 2pll n PRO 132 Cb 0.60 -1.68 -0.08 0.00 -0.02 0.00 0.00 33.50 32.32 2pll n PRO 132 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2pll n LEU 133 N -1.82 0.35 -0.01 2.45 4.77 -1.26 -4.55 117.00 116.92 2pll n LEU 133 Ca 0.01 -0.32 0.10 0.00 -0.03 0.00 0.00 56.01 55.78 2pll n LEU 133 Cb 0.10 0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 41.03 2pll n LEU 133 CO 0.09 0.09 -0.66 0.35 -1.33 0.00 0.00 177.39 175.93 2pll n THR 134 N -1.51 0.00 -1.95 -5.08 -2.24 -0.94 -4.98 114.28 97.57 2pll n THR 134 Ca 0.01 -0.41 -0.39 0.00 -2.27 0.00 0.00 64.05 60.98 2pll n THR 134 Cb 0.23 0.15 0.01 0.00 -2.10 0.00 0.00 70.33 68.62 2pll n THR 134 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2pll s THR 135 N -3.35 2.42 -0.09 4.28 -1.32 -0.85 -4.85 115.64 111.89 2pll s THR 135 Ca -0.06 0.35 0.13 0.00 -1.21 0.00 0.00 61.69 60.91 2pll s THR 135 Cb 0.13 -3.20 -0.19 0.00 -1.51 0.00 0.00 72.50 67.73 2pll s THR 135 CO 0.84 0.04 0.16 0.35 -2.21 0.00 0.00 174.62 173.79 2pll n THR 136 N -0.25 0.54 0.03 5.08 -2.24 -1.26 -4.58 114.28 111.59 2pll n THR 136 Ca 0.06 -0.47 -0.15 0.00 -2.27 0.00 0.00 64.05 61.22 2pll n THR 136 Cb 0.44 -0.31 -0.14 0.00 -2.10 0.00 0.00 70.33 68.22 2pll n THR 136 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 2pll h SER 137 N 0.00 0.25 0.00 3.42 4.64 -1.94 -3.48 113.55 116.44 2pll h SER 137 Ca -0.22 -0.42 0.00 0.00 -0.47 0.00 0.00 61.79 60.68 2pll h SER 137 Cb 1.35 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 2pll h SER 137 CO 0.01 1.37 0.00 0.61 -0.87 0.00 0.00 176.83 177.95 2pll n GLY 138 N 1.68 1.03 3.63 -0.77 0.00 -1.26 -4.90 105.19 104.59 2pll n GLY 138 Ca -0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.41 2pll n GLY 138 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2pll s ASN 139 N -3.04 6.83 0.49 1.61 0.01 -1.26 -1.59 114.94 117.98 2pll s ASN 139 Ca 0.00 0.92 0.30 0.00 -0.71 0.00 0.00 52.86 53.37 2pll s ASN 139 Cb 0.00 -2.47 1.64 0.00 0.41 0.00 0.00 41.25 40.83 2pll s ASN 139 CO 0.00 -0.71 1.91 -0.07 -1.51 0.00 0.00 177.10 176.73 2pll h LEU 140 N 9.66 0.00 0.00 0.60 3.38 -1.58 -1.99 115.31 125.38 2pll h LEU 140 Ca -0.22 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.75 2pll h LEU 140 Cb 1.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.83 2pll h LEU 140 CO 0.95 0.00 0.00 0.00 0.09 0.00 0.00 178.44 179.48 2pll n HIS 141 N -2.60 0.00 -0.82 1.13 1.44 -0.05 -1.85 115.22 112.47 2pll n HIS 141 Ca -0.02 0.00 0.08 0.00 -2.01 0.00 0.00 57.72 55.77 2pll n HIS 141 Cb 0.11 -0.16 0.20 0.00 0.12 0.00 0.00 29.99 30.27 2pll n HIS 141 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2pll n GLY 142 N 0.15 3.94 0.00 -1.39 0.00 -0.75 -4.49 105.19 102.66 2pll n GLY 142 Ca 0.10 -0.89 0.00 0.00 0.00 0.00 0.00 46.02 45.23 2pll n GLY 142 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2pll n GLN 143 N -0.53 1.06 -0.32 1.61 6.02 -0.77 -2.20 117.38 122.25 2pll n GLN 143 Ca 0.17 -0.08 0.18 0.00 -0.01 0.00 0.00 57.00 57.26 2pll n GLN 143 Cb 0.73 -0.42 0.37 0.00 1.02 0.00 0.00 30.24 31.95 2pll n GLN 143 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.06 175.05 2pll h PRO 144 N 0.00 0.19 -0.36 -1.09 0.13 -1.53 -2.10 132.00 127.24 2pll h PRO 144 Ca 0.00 -0.01 -0.05 0.00 -0.87 0.00 0.00 66.00 65.07 2pll h PRO 144 Cb 0.16 -0.04 -0.02 0.00 0.13 0.00 0.00 31.00 31.23 2pll h PRO 144 CO 0.00 0.13 0.00 0.28 -0.23 0.00 0.00 178.00 178.18 2pll h VAL 145 N 0.20 1.21 -0.23 1.56 2.07 -1.42 -2.80 116.25 116.82 2pll h VAL 145 Ca 0.64 -0.82 -0.05 0.00 0.82 0.00 0.00 66.70 67.29 2pll h VAL 145 Cb 1.40 0.93 -0.01 0.00 -1.52 0.00 0.00 31.29 32.09 2pll h VAL 145 CO -0.69 0.28 -0.08 0.77 0.02 0.00 0.00 177.57 177.88 2pll h SER 146 N 0.54 0.34 0.67 0.57 4.64 -1.53 -2.09 113.55 116.70 2pll h SER 146 Ca 0.12 -0.07 -0.10 0.00 -0.47 0.00 0.00 61.79 61.27 2pll h SER 146 Cb 0.35 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 62.34 2pll h SER 146 CO 0.01 0.46 -0.49 -0.26 -0.87 0.00 0.00 176.83 175.68 2pll h PHE 147 N 0.34 0.00 0.00 4.77 -1.00 -1.56 -3.26 116.94 116.24 2pll h PHE 147 Ca 0.07 0.00 -0.13 0.00 2.81 0.00 0.00 57.97 60.72 2pll h PHE 147 Cb 0.36 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.89 2pll h PHE 147 CO 0.01 0.49 -1.19 -0.07 -1.61 0.00 0.00 178.31 175.93 2pll h LEU 148 N 0.00 0.00 -9.43 1.54 3.38 -1.38 -3.35 115.31 106.07 2pll h LEU 148 Ca -0.00 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.43 2pll h LEU 148 Cb 0.96 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.70 2pll h LEU 148 CO 0.06 0.48 0.53 -0.76 0.09 0.00 0.00 178.44 178.85 2pll s LEU 149 N -5.84 4.35 0.28 1.67 1.43 -0.83 -1.65 118.68 118.09 2pll s LEU 149 Ca -0.01 1.88 0.05 0.00 -1.03 0.00 0.00 54.13 55.01 2pll s LEU 149 Cb 0.09 -3.57 0.41 0.00 0.03 0.00 0.00 46.19 43.14 2pll s LEU 149 CO 0.80 -0.43 1.68 0.11 0.23 0.00 0.00 176.35 178.73 2pll h LYS 150 N 6.91 0.30 0.00 1.70 1.57 -1.51 -2.92 116.57 122.63 2pll h LYS 150 Ca -0.40 -0.15 -0.03 0.00 -1.87 0.00 0.00 60.65 58.20 2pll h LYS 150 Cb 1.21 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.51 2pll h LYS 150 CO 0.81 0.67 -0.15 0.93 -0.57 0.00 0.00 179.45 181.13 2pll h GLU 151 N 0.25 0.00 -0.26 3.15 3.07 -1.92 -2.18 114.58 116.70 2pll h GLU 151 Ca 0.02 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.88 2pll h GLU 151 Cb 0.83 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.74 2pll h GLU 151 CO 0.07 0.15 0.00 1.28 -1.40 0.00 0.00 179.01 179.11 2pll n LEU 152 N -3.63 1.76 -4.66 1.33 4.32 -1.10 -4.84 117.00 110.17 2pll n LEU 152 Ca -0.01 -0.81 -0.43 0.00 -0.02 0.00 0.00 56.01 54.74 2pll n LEU 152 Cb 0.28 -0.17 -0.02 0.00 -1.62 0.00 0.00 43.42 41.89 2pll n LEU 152 CO 0.31 0.41 1.19 -0.75 -1.22 0.00 0.00 177.39 177.33 2pll s LYS 153 N -1.66 4.16 0.00 3.23 2.20 -0.82 -1.85 119.74 124.99 2pll s LYS 153 Ca 0.28 1.78 0.00 0.00 -0.36 0.00 0.00 55.97 57.67 2pll s LYS 153 Cb 0.15 -3.86 0.00 0.00 -1.51 0.00 0.00 37.83 32.61 2pll s LYS 153 CO 0.21 -0.83 0.00 0.41 -0.36 0.00 0.00 175.35 174.78 2pll n GLY 154 N 3.90 2.22 0.00 5.54 0.00 -1.26 -4.88 105.19 110.72 2pll n GLY 154 Ca 0.15 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.26 2pll n GLY 154 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2pll n LYS 155 N -0.10 0.97 -3.30 1.61 4.76 -0.77 -4.86 118.16 116.47 2pll n LYS 155 Ca 0.00 -0.03 -0.42 0.00 -2.87 0.00 0.00 58.31 54.99 2pll n LYS 155 Cb 0.00 -1.36 -0.09 0.00 -1.84 0.00 0.00 35.03 31.74 2pll n LYS 155 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2pll s ILE 156 N -2.79 5.07 0.99 -0.18 -1.09 -1.18 -4.75 121.20 117.26 2pll s ILE 156 Ca 0.05 -0.17 -0.12 0.00 -2.23 0.00 0.00 60.65 58.18 2pll s ILE 156 Cb 0.13 -4.01 0.19 0.00 -1.58 0.00 0.00 42.46 37.19 2pll s ILE 156 CO 0.75 -0.37 1.09 -2.16 -1.23 0.00 0.00 174.94 173.02 2pll s PRO 157 N 2.21 0.46 -0.99 2.79 0.04 -1.26 -4.90 135.00 133.35 2pll s PRO 157 Ca 0.14 0.61 -0.23 0.00 0.04 0.00 0.00 61.00 61.55 2pll s PRO 157 Cb -0.16 -1.73 0.03 0.00 0.04 0.00 0.00 34.50 32.68 2pll s PRO 157 CO 0.14 -2.73 1.53 -0.51 0.04 0.00 0.00 177.00 175.46 2pll s ASP 158 N -3.36 6.27 -0.07 6.66 1.01 -1.26 -4.97 116.67 120.95 2pll s ASP 158 Ca 0.65 -1.30 -0.22 0.00 0.71 0.00 0.00 52.55 52.40 2pll s ASP 158 Cb -0.19 -2.57 -0.04 0.00 1.01 0.00 0.00 42.92 41.13 2pll s ASP 158 CO 0.58 -1.72 0.63 -0.69 0.21 0.00 0.00 175.17 174.18 2pll s VAL 159 N 5.84 5.05 0.22 -1.27 1.01 -1.26 -5.02 120.40 124.97 2pll s VAL 159 Ca 0.50 1.30 -0.32 0.00 0.00 0.00 0.00 61.98 63.46 2pll s VAL 159 Cb -0.01 -3.97 -0.14 0.00 0.00 0.00 0.00 36.38 32.26 2pll s VAL 159 CO -0.08 0.30 1.41 -2.65 0.00 0.00 0.00 175.10 174.09 2pll n PRO 160 N 3.55 1.97 -0.06 2.72 -0.02 -1.26 -1.92 135.00 139.98 2pll n PRO 160 Ca -0.04 0.70 0.00 0.00 -2.02 0.00 0.00 63.50 62.15 2pll n PRO 160 Cb 0.51 -2.37 0.00 0.00 -0.02 0.00 0.00 33.50 31.63 2pll n PRO 160 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2pll n GLY 161 N 2.33 0.71 0.13 -1.23 0.00 -1.26 -2.99 105.19 102.88 2pll n GLY 161 Ca 0.13 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.22 2pll n GLY 161 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2pll n PHE 162 N -2.00 0.08 0.27 1.61 3.01 -0.81 -3.98 117.46 115.65 2pll n PHE 162 Ca 0.00 -0.87 0.15 0.00 1.01 0.00 0.00 57.45 57.74 2pll n PHE 162 Cb 0.00 -0.14 0.71 0.00 -0.01 0.00 0.00 39.48 40.04 2pll n PHE 162 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 2pll h SER 163 N 0.19 0.00 1.36 4.37 4.64 -1.92 -2.39 113.55 119.80 2pll h SER 163 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 2pll h SER 163 Cb 0.92 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.01 2pll h SER 163 CO 0.02 0.08 -0.03 4.11 -0.87 0.00 0.00 176.83 180.13 2pll h TRP 164 N 0.00 0.00 -3.70 4.77 5.08 -1.97 -3.46 115.95 116.68 2pll h TRP 164 Ca -0.00 0.00 -0.53 0.00 1.08 0.00 0.00 58.89 59.44 2pll h TRP 164 Cb 0.47 0.00 0.07 0.00 -3.00 0.00 0.00 29.16 26.69 2pll h TRP 164 CO 0.00 0.03 0.70 0.08 -1.28 0.00 0.00 178.44 177.98 2pll s VAL 165 N -3.49 2.60 -0.17 0.12 1.01 -0.90 -5.03 120.40 114.53 2pll s VAL 165 Ca 0.03 0.56 -0.04 0.00 0.00 0.00 0.00 61.98 62.53 2pll s VAL 165 Cb 0.08 -3.36 0.06 0.00 0.00 0.00 0.00 36.38 33.16 2pll s VAL 165 CO 0.60 0.12 0.08 -0.89 0.00 0.00 0.00 175.10 175.01 2pll s THR 166 N -0.70 0.05 0.02 3.92 2.01 -1.26 -5.11 115.64 114.56 2pll s THR 166 Ca 0.53 -0.24 -0.37 0.00 0.31 0.00 0.00 61.69 61.92 2pll s THR 166 Cb -0.42 -0.67 -0.17 0.00 0.01 0.00 0.00 72.50 71.26 2pll s THR 166 CO 0.51 -0.26 1.41 -2.65 -0.69 0.00 0.00 174.62 172.94 2pll n PRO 167 N 5.23 1.13 -0.00 4.92 -0.02 -1.26 -4.87 135.00 140.13 2pll n PRO 167 Ca -0.07 0.41 0.03 0.00 -2.02 0.00 0.00 63.50 61.85 2pll n PRO 167 Cb 0.49 -2.06 -0.05 0.00 -0.02 0.00 0.00 33.50 31.86 2pll n PRO 167 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2pll s ILE 169 N -2.09 2.43 0.26 0.00 -4.36 -0.87 -4.97 121.20 111.60 2pll s ILE 169 Ca -0.00 -1.58 0.04 0.00 -0.26 0.00 0.00 60.65 58.85 2pll s ILE 169 Cb 0.05 -2.06 -0.03 0.00 1.25 0.00 0.00 42.46 41.66 2pll s ILE 169 CO 0.27 0.16 0.39 -0.44 0.24 0.00 0.00 174.94 175.57 2pll s SER 170 N -1.88 6.32 0.38 4.36 0.01 -1.26 -1.38 113.70 120.26 2pll s SER 170 Ca 0.15 0.13 0.18 0.00 1.31 0.00 0.00 55.95 57.72 2pll s SER 170 Cb -0.10 -1.89 1.10 0.00 0.21 0.00 0.00 66.02 65.34 2pll s SER 170 CO 0.06 -0.11 1.74 0.00 0.41 0.00 0.00 173.24 175.35 2pll h ALA 171 N 1.10 2.19 0.00 1.44 0.00 -1.97 0.12 119.26 122.14 2pll h ALA 171 Ca -0.52 0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2pll h ALA 171 Cb 1.23 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.07 2pll h ALA 171 CO 0.61 -0.64 0.00 0.36 0.00 0.00 0.00 179.25 179.58 2pll n LYS 172 N -4.71 0.05 -0.14 0.00 2.85 -1.26 -3.56 118.16 111.39 2pll n LYS 172 Ca 0.27 0.17 0.09 0.00 -1.05 0.00 0.00 58.31 57.79 2pll n LYS 172 Cb 0.92 -1.57 0.28 0.00 -0.65 0.00 0.00 35.03 34.01 2pll n LYS 172 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 2pll n ASP 173 N -1.66 1.96 -4.04 -5.58 8.00 0.41 -4.93 116.55 110.71 2pll n ASP 173 Ca 0.05 -1.85 -0.15 0.00 0.71 0.00 0.00 54.79 53.54 2pll n ASP 173 Cb 0.27 -0.18 -0.13 0.00 -0.02 0.00 0.00 41.12 41.06 2pll n ASP 173 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 2pll s ILE 174 N -1.64 0.61 -0.05 0.53 2.07 -1.23 -0.43 121.20 121.07 2pll s ILE 174 Ca 0.30 -0.77 0.03 0.00 -1.41 0.00 0.00 60.65 58.80 2pll s ILE 174 Cb 0.16 -0.60 0.01 0.00 0.13 0.00 0.00 42.46 42.16 2pll s ILE 174 CO 0.23 -0.13 -0.11 -0.69 -1.91 0.00 0.00 174.94 172.33 2pll s VAL 175 N -0.84 1.01 0.01 4.00 1.01 0.15 -4.02 120.40 121.72 2pll s VAL 175 Ca -0.04 -0.44 -0.07 0.00 0.00 0.00 0.00 61.98 61.43 2pll s VAL 175 Cb -0.07 -0.92 -0.05 0.00 0.00 0.00 0.00 36.38 35.35 2pll s VAL 175 CO 0.00 0.32 0.28 -0.31 0.00 0.00 0.00 175.10 175.39 2pll s TYR 176 N 0.46 3.59 -0.03 5.22 2.02 -0.89 -0.57 117.35 127.15 2pll s TYR 176 Ca -0.09 0.61 -0.01 0.00 -0.37 0.00 0.00 57.07 57.20 2pll s TYR 176 Cb -0.13 -2.02 0.03 0.00 -0.40 0.00 0.00 41.96 39.44 2pll s TYR 176 CO 0.02 0.61 0.04 0.42 -1.57 0.00 0.00 175.55 175.08 2pll s ILE 177 N -1.28 -0.06 0.00 2.71 -1.09 -0.50 -0.64 121.20 120.33 2pll s ILE 177 Ca 0.27 0.33 0.00 0.00 -2.23 0.00 0.00 60.65 59.02 2pll s ILE 177 Cb -0.13 -0.15 0.00 0.00 -1.58 0.00 0.00 42.46 40.60 2pll s ILE 177 CO 0.15 0.15 0.00 0.61 -1.23 0.00 0.00 174.94 174.62 2pll n GLY 178 N 4.86 0.59 3.65 6.18 0.00 -0.42 -1.80 105.19 118.25 2pll n GLY 178 Ca -0.13 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.45 2pll n GLY 178 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2pll n LEU 179 N 0.00 2.84 -0.11 0.99 4.77 -0.88 -4.18 117.00 120.43 2pll n LEU 179 Ca 0.00 1.17 0.00 0.00 -0.03 0.00 0.00 56.01 57.15 2pll n LEU 179 Cb 0.00 -1.40 0.00 0.00 -2.33 0.00 0.00 43.42 39.69 2pll n LEU 179 CO 0.00 -0.73 0.05 -2.11 -1.33 0.00 0.00 177.39 173.27 2pll n ARG 180 N 1.33 0.00 -2.86 3.23 1.85 -0.56 -0.90 116.66 118.75 2pll n ARG 180 Ca 0.09 0.00 -0.11 0.00 -1.00 0.00 0.00 57.85 56.83 2pll n ARG 180 Cb 0.32 0.00 0.02 0.00 -1.05 0.00 0.00 32.46 31.75 2pll n ARG 180 CO 0.00 0.00 0.00 -3.47 -0.01 0.00 0.00 177.63 174.15 2pll n ASP 181 N 0.00 -2.28 -4.47 2.89 2.03 -0.52 -5.04 116.55 109.16 2pll n ASP 181 Ca 0.00 -3.11 -0.34 0.00 0.52 0.00 0.00 54.79 51.86 2pll n ASP 181 Cb 0.43 1.26 -0.12 0.00 -0.72 0.00 0.00 41.12 41.96 2pll n ASP 181 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2pll s VAL 182 N 0.32 3.81 0.82 5.18 1.01 -1.26 -4.52 120.40 125.77 2pll s VAL 182 Ca 0.32 -0.38 -0.11 0.00 0.00 0.00 0.00 61.98 61.81 2pll s VAL 182 Cb 0.19 -2.68 0.08 0.00 0.00 0.00 0.00 36.38 33.97 2pll s VAL 182 CO -0.20 0.48 1.09 -1.81 0.00 0.00 0.00 175.10 174.66 2pll s ASP 183 N 0.52 4.13 0.15 3.32 1.01 -1.26 -4.82 116.67 119.72 2pll s ASP 183 Ca -0.03 1.60 -0.17 0.00 0.71 0.00 0.00 52.55 54.66 2pll s ASP 183 Cb -0.14 -2.31 0.02 0.00 1.01 0.00 0.00 42.92 41.49 2pll s ASP 183 CO 0.03 -2.24 1.78 -0.65 0.21 0.00 0.00 175.17 174.30 2pll h PRO 184 N -1.27 0.34 -0.75 8.23 0.11 -1.99 -0.71 132.00 135.96 2pll h PRO 184 Ca -0.46 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.58 2pll h PRO 184 Cb 1.26 -0.08 -0.03 0.00 0.11 0.00 0.00 31.00 32.26 2pll h PRO 184 CO 0.54 0.23 0.30 0.78 -0.21 0.00 0.00 178.00 179.63 2pll h GLY 185 N 0.35 1.21 1.15 -0.55 0.00 -1.93 -1.45 103.07 101.85 2pll h GLY 185 Ca 0.14 -0.65 -0.07 0.00 0.00 0.00 0.00 47.33 46.75 2pll h GLY 185 CO -0.09 0.61 0.12 0.83 0.00 0.00 0.00 176.54 178.02 2pll h GLU 186 N 1.10 1.04 -0.53 4.80 5.08 -1.82 -1.98 114.58 122.27 2pll h GLU 186 Ca 0.25 -0.26 -0.11 0.00 -1.00 0.00 0.00 59.36 58.25 2pll h GLU 186 Cb 0.21 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 2pll h GLU 186 CO -0.02 0.94 -0.08 1.25 -1.00 0.00 0.00 179.01 180.10 2pll h HIS 187 N 0.98 1.07 -0.39 4.33 2.76 -0.70 -1.35 115.15 121.86 2pll h HIS 187 Ca 0.20 -0.21 0.01 0.00 -2.20 0.00 0.00 60.37 58.17 2pll h HIS 187 Cb 0.39 -0.27 -0.02 0.00 1.55 0.00 0.00 27.41 29.06 2pll h HIS 187 CO 0.03 1.00 0.25 -0.92 -1.30 0.00 0.00 177.93 176.98 2pll h TYR 188 N 0.87 0.47 -0.38 5.26 3.20 -1.03 -1.76 116.97 123.61 2pll h TYR 188 Ca 0.14 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.03 2pll h TYR 188 Cb 0.63 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.72 2pll h TYR 188 CO 0.04 0.29 0.25 0.82 -1.64 0.00 0.00 178.16 177.92 2pll h ILE 189 N 0.51 1.10 -0.09 1.81 2.04 -1.12 0.17 117.51 121.93 2pll h ILE 189 Ca 0.14 -0.18 0.04 0.00 1.00 0.00 0.00 64.86 65.86 2pll h ILE 189 Cb -0.04 0.54 -0.06 0.00 -0.74 0.00 0.00 36.82 36.53 2pll h ILE 189 CO -0.04 0.10 -0.30 -0.07 0.00 0.00 0.00 178.15 177.83 2pll h LEU 190 N 0.51 -0.93 -0.64 1.44 3.38 -0.83 -0.29 115.31 117.95 2pll h LEU 190 Ca 0.14 0.13 -0.14 0.00 0.09 0.00 0.00 57.88 58.10 2pll h LEU 190 Cb -0.06 0.39 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 2pll h LEU 190 CO -0.03 -0.35 -0.44 0.11 0.09 0.00 0.00 178.44 177.82 2pll h LYS 191 N -0.40 0.56 -0.43 1.13 1.79 -1.21 -1.22 116.57 116.80 2pll h LYS 191 Ca 0.09 -0.30 -0.07 0.00 -2.18 0.00 0.00 60.65 58.18 2pll h LYS 191 Cb 0.53 0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 31.18 2pll h LYS 191 CO -0.31 0.89 -0.02 1.15 -1.08 0.00 0.00 179.45 180.07 2pll h THR 192 N 0.46 1.26 -0.01 -0.16 2.02 -0.34 -3.03 112.91 113.11 2pll h THR 192 Ca 0.03 -1.07 0.00 0.00 0.77 0.00 0.00 66.41 66.14 2pll h THR 192 Cb 0.94 1.10 0.00 0.00 -1.74 0.00 0.00 68.15 68.46 2pll h THR 192 CO 0.08 0.36 -0.06 0.18 0.37 0.00 0.00 175.52 176.46 2pll n LEU 193 N -4.39 1.29 -3.00 2.58 4.77 -0.15 -4.94 117.00 113.17 2pll n LEU 193 Ca -0.00 -0.40 -0.21 0.00 -0.03 0.00 0.00 56.01 55.36 2pll n LEU 193 Cb 0.31 -0.03 0.05 0.00 -2.33 0.00 0.00 43.42 41.41 2pll n LEU 193 CO 0.41 0.22 0.08 0.61 -1.33 0.00 0.00 177.39 177.39 2pll n GLY 194 N 1.21 -0.43 3.76 -0.72 0.00 -0.71 -4.83 105.19 103.47 2pll n GLY 194 Ca 0.17 0.11 -0.41 0.00 0.00 0.00 0.00 46.02 45.89 2pll n GLY 194 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2pll s ILE 195 N -3.19 2.70 -0.10 -0.61 1.01 -0.54 -4.90 121.20 115.56 2pll s ILE 195 Ca 0.37 0.66 -0.28 0.00 0.00 0.00 0.00 60.65 61.41 2pll s ILE 195 Cb -0.16 -3.42 -0.02 0.00 0.01 0.00 0.00 42.46 38.87 2pll s ILE 195 CO 0.46 0.14 0.95 -0.75 0.00 0.00 0.00 174.94 175.74 2pll s LYS 196 N -1.36 4.41 -0.01 2.79 2.47 -1.26 -4.90 119.74 121.89 2pll s LYS 196 Ca 0.52 1.28 -0.15 0.00 -1.56 0.00 0.00 55.97 56.06 2pll s LYS 196 Cb -0.40 -3.53 0.02 0.00 -1.46 0.00 0.00 37.83 32.46 2pll s LYS 196 CO 0.50 -0.26 0.32 1.52 0.16 0.00 0.00 175.35 177.59 2pll s TYR 197 N 1.83 -0.19 -0.45 4.03 -0.85 -1.26 -2.09 117.35 118.37 2pll s TYR 197 Ca 0.46 0.28 0.03 0.00 -0.52 0.00 0.00 57.07 57.32 2pll s TYR 197 Cb -0.18 0.10 0.12 0.00 0.38 0.00 0.00 41.96 42.39 2pll s TYR 197 CO 0.18 -0.40 0.21 -0.06 -1.52 0.00 0.00 175.55 173.96 2pll s PHE 198 N -1.34 2.81 1.18 -3.49 0.40 0.18 -4.92 117.98 112.80 2pll s PHE 198 Ca -0.13 -2.82 -0.19 0.00 -0.60 0.00 0.00 56.93 53.19 2pll s PHE 198 Cb -0.05 -2.48 0.28 0.00 0.51 0.00 0.00 43.02 41.28 2pll s PHE 198 CO 0.04 -0.80 1.11 -1.54 0.70 0.00 0.00 175.22 174.74 2pll s SER 199 N 0.23 1.09 0.58 1.36 1.04 -1.26 -1.31 113.70 115.43 2pll s SER 199 Ca 0.16 0.67 0.32 0.00 0.48 0.00 0.00 55.95 57.58 2pll s SER 199 Cb -0.24 -0.95 1.79 0.00 0.10 0.00 0.00 66.02 66.72 2pll s SER 199 CO -0.03 -4.02 2.21 0.24 0.98 0.00 0.00 173.24 172.61 2pll h MET 200 N -2.51 0.00 -0.48 4.02 2.86 -1.23 -1.88 114.93 115.71 2pll h MET 200 Ca -0.46 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.15 2pll h MET 200 Cb 1.30 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.94 2pll h MET 200 CO 0.36 0.04 0.19 1.15 1.06 0.00 0.00 176.91 179.72 2pll h THR 201 N 0.00 1.21 -0.23 2.22 2.02 -1.90 0.16 112.91 116.40 2pll h THR 201 Ca -0.00 -0.65 -0.13 0.00 0.77 0.00 0.00 66.41 66.40 2pll h THR 201 Cb 0.14 0.73 -0.01 0.00 -1.74 0.00 0.00 68.15 67.27 2pll h THR 201 CO 0.01 0.24 -0.41 -0.33 0.37 0.00 0.00 175.52 175.39 2pll h GLU 202 N 0.64 0.55 -0.31 6.66 3.07 -1.68 -0.89 114.58 122.62 2pll h GLU 202 Ca 0.16 -0.28 -0.03 0.00 -0.50 0.00 0.00 59.36 58.71 2pll h GLU 202 Cb 0.19 0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.10 2pll h GLU 202 CO -0.01 0.86 0.07 0.28 -1.40 0.00 0.00 179.01 178.81 2pll h VAL 203 N 0.45 1.22 -0.51 3.13 2.07 -1.22 0.95 116.25 122.34 2pll h VAL 203 Ca 0.04 -0.75 -0.01 0.00 0.82 0.00 0.00 66.70 66.80 2pll h VAL 203 Cb 0.91 1.11 -0.02 0.00 -1.52 0.00 0.00 31.29 31.77 2pll h VAL 203 CO 0.08 0.25 0.29 0.44 0.02 0.00 0.00 177.57 178.64 2pll h ASP 204 N 0.35 0.64 -0.12 0.57 3.32 -0.81 0.14 116.42 120.50 2pll h ASP 204 Ca 0.10 -0.09 -0.02 0.00 0.02 0.00 0.00 57.03 57.04 2pll h ASP 204 Cb 0.30 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 39.69 2pll h ASP 204 CO 0.00 0.54 -0.01 -0.09 -1.72 0.00 0.00 179.24 177.97 2pll h ARG 205 N 0.69 0.22 0.00 3.56 2.43 -0.97 -3.37 114.38 116.94 2pll h ARG 205 Ca 0.18 -0.07 -0.31 0.00 -0.81 0.00 0.00 59.98 58.97 2pll h ARG 205 Cb 0.04 -0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 29.52 2pll h ARG 205 CO -0.03 0.48 -1.99 1.28 -1.51 0.00 0.00 179.97 178.19 2pll n LEU 206 N -4.78 0.47 0.00 3.80 4.77 0.31 -5.09 117.00 116.49 2pll n LEU 206 Ca -0.06 0.22 0.00 0.00 -0.03 0.00 0.00 56.01 56.14 2pll n LEU 206 Cb 0.22 0.31 0.00 0.00 -2.33 0.00 0.00 43.42 41.61 2pll n LEU 206 CO 0.36 0.41 0.00 0.61 -1.33 0.00 0.00 177.39 177.44 2pll n GLY 207 N 1.62 0.97 0.27 -0.72 0.00 0.48 -4.25 105.19 103.56 2pll n GLY 207 Ca -0.23 -1.62 0.11 0.00 0.00 0.00 0.00 46.02 44.27 2pll n GLY 207 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2pll h ILE 208 N 0.00 0.77 -0.12 -0.61 6.09 -1.93 -2.08 117.51 119.63 2pll h ILE 208 Ca 0.00 -0.27 -0.01 0.00 -1.37 0.00 0.00 64.86 63.21 2pll h ILE 208 Cb 0.00 1.16 -0.01 0.00 0.47 0.00 0.00 36.82 38.44 2pll h ILE 208 CO 0.00 0.07 0.04 1.23 -3.07 0.00 0.00 178.15 176.42 2pll h GLY 209 N 0.32 0.19 1.33 8.18 0.00 -1.96 -1.66 103.07 109.48 2pll h GLY 209 Ca -0.00 -0.11 -0.14 0.00 0.00 0.00 0.00 47.33 47.08 2pll h GLY 209 CO 0.01 0.10 -0.38 1.70 0.00 0.00 0.00 176.54 177.97 2pll h LYS 210 N 0.01 0.74 -0.16 4.80 1.63 -1.67 -2.45 116.57 119.47 2pll h LYS 210 Ca 0.04 -0.37 0.03 0.00 -0.85 0.00 0.00 60.65 59.49 2pll h LYS 210 Cb 0.20 0.01 -0.03 0.00 -0.60 0.00 0.00 32.23 31.81 2pll h LYS 210 CO -0.00 0.99 -0.01 0.28 -3.45 0.00 0.00 179.45 177.26 2pll h VAL 211 N 0.61 0.87 -0.51 2.00 2.07 -1.25 -0.86 116.25 119.17 2pll h VAL 211 Ca 0.05 -0.01 -0.09 0.00 0.82 0.00 0.00 66.70 67.47 2pll h VAL 211 Cb 0.93 0.83 -0.02 0.00 -1.52 0.00 0.00 31.29 31.51 2pll h VAL 211 CO 0.08 0.01 -0.03 0.24 0.02 0.00 0.00 177.57 177.89 2pll h MET 212 N 0.03 0.89 0.17 1.57 2.86 -1.29 0.41 114.93 119.57 2pll h MET 212 Ca 0.08 -0.27 0.01 0.00 -2.06 0.00 0.00 59.70 57.46 2pll h MET 212 Cb 0.10 -0.09 -0.03 0.00 0.06 0.00 0.00 31.60 31.65 2pll h MET 212 CO -0.14 0.90 -0.24 1.49 1.06 0.00 0.00 176.91 179.98 2pll h GLU 213 N 0.82 -0.45 -0.41 1.72 4.81 -1.03 -1.04 114.58 119.00 2pll h GLU 213 Ca 0.15 0.03 -0.07 0.00 -0.13 0.00 0.00 59.36 59.34 2pll h GLU 213 Cb 0.53 0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.99 2pll h GLU 213 CO 0.03 -0.30 -0.03 0.93 -0.73 0.00 0.00 179.01 178.90 2pll h GLU 214 N -0.47 0.68 -0.22 1.92 5.08 -1.01 -0.78 114.58 119.78 2pll h GLU 214 Ca 0.01 -0.18 -0.03 0.00 -1.00 0.00 0.00 59.36 58.16 2pll h GLU 214 Cb 0.47 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.63 2pll h GLU 214 CO -0.10 0.72 0.02 1.15 -1.00 0.00 0.00 179.01 179.81 2pll h THR 215 N 0.64 1.24 -0.18 1.13 2.02 -0.61 -0.20 112.91 116.94 2pll h THR 215 Ca 0.12 -0.80 -0.17 0.00 0.77 0.00 0.00 66.41 66.34 2pll h THR 215 Cb 0.45 1.34 -0.00 0.00 -1.74 0.00 0.00 68.15 68.20 2pll h THR 215 CO 0.02 0.25 -0.59 -0.07 0.37 0.00 0.00 175.52 175.50 2pll h LEU 216 N 0.15 0.66 -0.57 2.58 3.38 -1.12 -1.88 115.31 118.51 2pll h LEU 216 Ca 0.06 -0.37 -0.09 0.00 0.09 0.00 0.00 57.88 57.58 2pll h LEU 216 Cb 0.35 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 2pll h LEU 216 CO 0.01 1.10 0.00 -1.28 0.09 0.00 0.00 178.44 178.36 2pll h SER 217 N 0.44 0.98 -0.69 -0.43 0.87 -1.12 0.45 113.55 114.05 2pll h SER 217 Ca -0.00 -0.31 -0.02 0.00 -1.23 0.00 0.00 61.79 60.24 2pll h SER 217 Cb 1.15 -0.26 -0.03 0.00 -0.44 0.00 0.00 62.40 62.81 2pll h SER 217 CO 0.11 1.05 0.36 0.22 -0.53 0.00 0.00 176.83 178.04 2pll h TYR 218 N 0.89 0.96 0.00 2.24 3.20 -0.85 0.69 116.97 124.09 2pll h TYR 218 Ca 0.16 -0.03 -0.15 0.00 3.14 0.00 0.00 58.73 61.85 2pll h TYR 218 Cb 0.54 -0.30 -0.03 0.00 1.54 0.00 0.00 36.73 38.48 2pll h TYR 218 CO 0.04 0.69 -1.21 -0.07 -1.64 0.00 0.00 178.16 175.97 2pll h LEU 219 N 0.95 0.00 -3.00 2.82 3.38 -1.13 -3.37 115.31 114.96 2pll h LEU 219 Ca 0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.21 2pll h LEU 219 Cb 0.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.82 2pll h LEU 219 CO -0.04 0.55 0.00 0.18 0.09 0.00 0.00 178.44 179.22 2pll n LEU 220 N -2.95 2.34 -0.01 1.67 4.77 0.16 -4.77 117.00 118.20 2pll n LEU 220 Ca -0.07 -2.37 -0.12 0.00 -0.03 0.00 0.00 56.01 53.42 2pll n LEU 220 Cb 0.81 -0.18 -0.07 0.00 -2.33 0.00 0.00 43.42 41.64 2pll n LEU 220 CO 0.42 0.60 0.77 1.23 -1.33 0.00 0.00 177.39 179.08 2pll h GLY 221 N 0.37 0.12 1.52 -0.72 0.00 0.29 -3.23 103.07 101.41 2pll h GLY 221 Ca 0.00 -0.08 -0.20 0.00 0.00 0.00 0.00 47.33 47.05 2pll h GLY 221 CO 0.01 0.07 -0.79 -0.09 0.00 0.00 0.00 176.54 175.75 2pll h ARG 222 N -0.12 0.46 -1.60 4.80 2.43 -1.86 -3.48 114.38 115.01 2pll h ARG 222 Ca 0.02 -0.40 0.21 0.00 -0.81 0.00 0.00 59.98 59.00 2pll h ARG 222 Cb 0.27 0.09 -0.19 0.00 -0.42 0.00 0.00 29.97 29.72 2pll h ARG 222 CO 0.00 1.04 0.75 -1.59 -1.51 0.00 0.00 179.97 178.66 2pll s LYS 223 N -3.56 0.40 0.38 0.20 -2.85 -1.22 -5.16 119.74 107.93 2pll s LYS 223 Ca -0.06 -0.12 -0.25 0.00 -1.00 0.00 0.00 55.97 54.54 2pll s LYS 223 Cb 0.10 0.19 -0.09 0.00 -2.06 0.00 0.00 37.83 35.96 2pll s LYS 223 CO 0.86 -0.17 1.06 0.15 0.10 0.00 0.00 175.35 177.35 2pll s LYS 224 N -2.35 4.25 0.23 1.78 3.01 -1.26 -4.41 119.74 121.00 2pll s LYS 224 Ca 0.08 1.57 -0.22 0.00 -1.01 0.00 0.00 55.97 56.39 2pll s LYS 224 Cb -0.01 -2.67 0.04 0.00 -1.01 0.00 0.00 37.83 34.18 2pll s LYS 224 CO -0.05 -0.07 0.68 -0.98 0.51 0.00 0.00 175.35 175.43 2pll s ARG 225 N -2.28 1.59 0.45 1.68 1.70 -1.26 -5.11 118.95 115.72 2pll s ARG 225 Ca 0.55 -0.79 -0.24 0.00 -0.47 0.00 0.00 55.73 54.77 2pll s ARG 225 Cb -0.24 0.60 -0.08 0.00 -0.57 0.00 0.00 34.95 34.66 2pll s ARG 225 CO 0.30 -0.72 1.30 -2.14 -1.08 0.00 0.00 175.30 172.96 2pll s PRO 226 N -3.85 3.74 -0.08 3.89 0.02 -1.26 -4.86 135.00 132.60 2pll s PRO 226 Ca 0.07 2.12 0.03 0.00 0.02 0.00 0.00 61.00 63.24 2pll s PRO 226 Cb -0.04 -2.58 -0.02 0.00 0.02 0.00 0.00 34.50 31.88 2pll s PRO 226 CO -0.01 -0.67 -0.17 0.42 -0.33 0.00 0.00 177.00 176.24 2pll s ILE 227 N -1.32 2.72 -0.23 2.83 -1.09 -0.07 -0.83 121.20 123.21 2pll s ILE 227 Ca 0.61 -0.82 -0.03 0.00 -2.23 0.00 0.00 60.65 58.18 2pll s ILE 227 Cb -0.37 -2.07 -0.00 0.00 -1.58 0.00 0.00 42.46 38.43 2pll s ILE 227 CO 0.46 0.56 -0.05 -2.28 -1.23 0.00 0.00 174.94 172.41 2pll s HIS 228 N -0.12 2.97 -0.33 3.97 5.65 0.94 0.06 115.29 128.42 2pll s HIS 228 Ca -0.03 -1.04 -0.10 0.00 0.25 0.00 0.00 55.06 54.14 2pll s HIS 228 Cb -0.14 -2.10 0.00 0.00 -1.18 0.00 0.00 32.58 29.17 2pll s HIS 228 CO 0.04 -0.58 0.17 -1.17 -0.65 0.00 0.00 174.74 172.55 2pll s LEU 229 N 1.45 4.31 -0.46 8.88 2.96 0.11 -1.36 118.68 134.57 2pll s LEU 229 Ca 0.05 -0.66 -0.12 0.00 -0.22 0.00 0.00 54.13 53.19 2pll s LEU 229 Cb -0.15 -2.02 0.09 0.00 0.50 0.00 0.00 46.19 44.62 2pll s LEU 229 CO -0.04 -0.25 0.35 -0.55 -1.32 0.00 0.00 176.35 174.54 2pll s SER 230 N 1.60 5.86 -0.36 3.68 0.15 -0.10 -0.94 113.70 123.59 2pll s SER 230 Ca 0.04 -1.60 -0.12 0.00 0.70 0.00 0.00 55.95 54.97 2pll s SER 230 Cb -0.18 -2.08 0.01 0.00 -1.71 0.00 0.00 66.02 62.07 2pll s SER 230 CO 0.07 -0.65 0.22 0.12 1.20 0.00 0.00 173.24 174.19 2pll s PHE 231 N 1.49 3.22 -0.26 3.44 2.19 0.03 -1.73 117.98 126.37 2pll s PHE 231 Ca 0.04 -0.65 -0.15 0.00 0.33 0.00 0.00 56.93 56.49 2pll s PHE 231 Cb -0.25 -2.46 -0.04 0.00 -1.31 0.00 0.00 43.02 38.97 2pll s PHE 231 CO 0.03 -0.54 0.39 0.34 1.83 0.00 0.00 175.22 177.27 2pll s ASP 232 N 1.62 6.29 0.50 6.13 -1.08 -0.25 -0.57 116.67 129.32 2pll s ASP 232 Ca 0.04 0.34 0.32 0.00 -0.52 0.00 0.00 52.55 52.73 2pll s ASP 232 Cb -0.18 -2.22 1.72 0.00 -1.46 0.00 0.00 42.92 40.78 2pll s ASP 232 CO 0.08 -0.17 1.96 -0.37 0.52 0.00 0.00 175.17 177.19 2pll h VAL 233 N 5.33 0.00 -0.00 1.11 -1.51 -1.51 0.16 116.25 119.84 2pll h VAL 233 Ca -0.32 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.15 2pll h VAL 233 Cb 1.16 0.70 0.00 0.00 -2.13 0.00 0.00 31.29 31.02 2pll h VAL 233 CO 0.66 0.00 -0.01 -0.90 -1.23 0.00 0.00 177.57 176.09 2pll n ASP 234 N -2.65 0.40 0.01 4.19 5.68 -1.26 -2.83 116.55 120.09 2pll n ASP 234 Ca -0.02 -1.07 -0.03 0.00 -0.50 0.00 0.00 54.79 53.16 2pll n ASP 234 Cb 0.10 -0.01 0.20 0.00 -1.14 0.00 0.00 41.12 40.27 2pll n ASP 234 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 2pll h GLY 235 N 4.96 0.54 -1.15 6.12 0.00 -1.21 -3.36 103.07 108.98 2pll h GLY 235 Ca 0.00 -0.43 -0.50 0.00 0.00 0.00 0.00 47.33 46.40 2pll h GLY 235 CO 0.00 0.40 0.40 1.08 0.00 0.00 0.00 176.54 178.42 2pll s LEU 236 N -8.70 2.96 0.46 3.11 1.43 -1.13 -2.70 118.68 114.11 2pll s LEU 236 Ca -0.07 1.28 -0.23 0.00 -1.03 0.00 0.00 54.13 54.08 2pll s LEU 236 Cb 0.14 -4.12 -0.07 0.00 0.03 0.00 0.00 46.19 42.16 2pll s LEU 236 CO 0.79 -1.34 1.20 -0.62 0.23 0.00 0.00 176.35 176.62 2pll s ASP 237 N -4.18 6.07 0.24 2.29 -1.08 0.72 -4.54 116.67 116.19 2pll s ASP 237 Ca 0.58 2.40 0.18 0.00 -0.52 0.00 0.00 52.55 55.19 2pll s ASP 237 Cb -0.12 -2.61 0.92 0.00 -1.46 0.00 0.00 42.92 39.65 2pll s ASP 237 CO 0.53 -0.99 1.56 -0.81 0.52 0.00 0.00 175.17 175.97 2pll n PRO 238 N -0.48 0.12 0.05 4.34 -0.04 -1.26 -1.03 135.00 136.70 2pll n PRO 238 Ca 0.07 0.55 0.11 0.00 -0.04 0.00 0.00 63.50 64.19 2pll n PRO 238 Cb 0.47 -1.84 0.45 0.00 -0.04 0.00 0.00 33.50 32.54 2pll n PRO 238 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2pll n SER 239 N -2.09 0.32 -0.05 3.54 3.41 -1.26 -1.78 113.62 115.71 2pll n SER 239 Ca -0.00 0.55 -0.05 0.00 -0.26 0.00 0.00 58.87 59.11 2pll n SER 239 Cb 0.08 -0.63 -0.06 0.00 -0.26 0.00 0.00 64.21 63.34 2pll n SER 239 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 2pll n PHE 240 N -1.82 0.00 -3.18 7.33 3.72 -0.19 -4.82 117.46 118.49 2pll n PHE 240 Ca 0.05 0.00 -0.23 0.00 -0.05 0.00 0.00 57.45 57.22 2pll n PHE 240 Cb 0.28 -0.42 -0.05 0.00 -0.94 0.00 0.00 39.48 38.35 2pll n PHE 240 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 2pll n THR 241 N -2.49 0.62 -0.03 4.37 -2.24 -0.71 -3.83 114.28 109.97 2pll n THR 241 Ca -0.16 -4.67 -0.03 0.00 -2.27 0.00 0.00 64.05 56.92 2pll n THR 241 Cb 0.75 -1.30 0.22 0.00 -2.10 0.00 0.00 70.33 67.90 2pll n THR 241 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 2pll h PRO 242 N 3.51 0.59 -3.69 -0.78 0.13 -1.60 -3.36 132.00 126.79 2pll h PRO 242 Ca 0.11 -0.17 -0.60 0.00 -0.87 0.00 0.00 66.00 64.48 2pll h PRO 242 Cb 0.81 -0.06 0.01 0.00 0.13 0.00 0.00 31.00 31.89 2pll h PRO 242 CO 0.60 0.68 3.01 0.00 -0.23 0.00 0.00 178.00 182.05 2pll n ALA 243 N -2.48 5.37 -2.81 -0.56 0.00 -1.26 -4.76 120.51 114.01 2pll n ALA 243 Ca 0.01 -3.15 -0.09 0.00 0.00 0.00 0.00 53.44 50.21 2pll n ALA 243 Cb 0.32 -3.37 -0.11 0.00 0.00 0.00 0.00 19.45 16.29 2pll n ALA 243 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 2pll s THR 244 N 3.38 0.13 0.18 0.00 -1.32 -1.26 -0.69 115.64 116.07 2pll s THR 244 Ca 0.53 -1.08 -0.11 0.00 -1.21 0.00 0.00 61.69 59.83 2pll s THR 244 Cb 0.14 -0.52 0.08 0.00 -1.51 0.00 0.00 72.50 70.70 2pll s THR 244 CO -0.02 -0.59 1.70 1.23 -2.21 0.00 0.00 174.62 174.73 2pll h GLY 245 N 4.33 1.06 -6.20 6.08 0.00 -1.88 -3.37 103.07 103.09 2pll h GLY 245 Ca -0.32 -0.64 -0.60 0.00 0.00 0.00 0.00 47.33 45.77 2pll h GLY 245 CO 0.46 0.60 -0.64 2.41 0.00 0.00 0.00 176.54 179.37 2pll n THR 246 N -4.36 2.08 -2.50 4.70 -1.04 -1.26 -5.09 114.28 106.81 2pll n THR 246 Ca 0.04 -5.11 -0.39 0.00 -2.04 0.00 0.00 64.05 56.55 2pll n THR 246 Cb 0.22 -2.09 -0.04 0.00 -1.82 0.00 0.00 70.33 66.60 2pll n THR 246 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 2pll s PRO 247 N -2.34 4.44 -0.04 -2.82 0.04 -1.26 -4.94 135.00 128.09 2pll s PRO 247 Ca 0.39 1.68 0.01 0.00 0.04 0.00 0.00 61.00 63.13 2pll s PRO 247 Cb 0.15 -2.92 0.02 0.00 0.04 0.00 0.00 34.50 31.78 2pll s PRO 247 CO -0.02 0.07 -0.05 0.08 0.04 0.00 0.00 177.00 177.11 2pll s VAL 248 N -1.36 0.54 0.71 -0.36 1.01 -1.26 -5.08 120.40 114.61 2pll s VAL 248 Ca 0.50 -0.16 -0.12 0.00 0.00 0.00 0.00 61.98 62.20 2pll s VAL 248 Cb -0.28 -0.55 0.02 0.00 0.00 0.00 0.00 36.38 35.58 2pll s VAL 248 CO 0.35 0.21 1.08 0.68 0.00 0.00 0.00 175.10 177.43 2pll s VAL 249 N 0.70 3.58 0.00 2.92 -7.23 -1.26 -4.08 120.40 115.03 2pll s VAL 249 Ca -0.09 0.57 0.00 0.00 -1.81 0.00 0.00 61.98 60.64 2pll s VAL 249 Cb -0.13 -3.14 0.00 0.00 0.56 0.00 0.00 36.38 33.68 2pll s VAL 249 CO 0.00 -0.62 0.00 0.61 -0.31 0.00 0.00 175.10 174.79 2pll n GLY 250 N -1.32 0.63 2.68 2.32 0.00 -1.26 -5.05 105.19 103.19 2pll n GLY 250 Ca 0.09 -0.75 -0.19 0.00 0.00 0.00 0.00 46.02 45.17 2pll n GLY 250 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2pll n GLY 251 N -0.94 -0.66 3.77 -0.02 0.00 -1.26 -4.96 105.19 101.13 2pll n GLY 251 Ca 0.00 -1.81 -0.35 0.00 0.00 0.00 0.00 46.02 43.86 2pll n GLY 251 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2pll s LEU 252 N 0.00 3.66 0.71 0.99 1.43 -1.10 -4.31 118.68 120.06 2pll s LEU 252 Ca 0.50 2.19 -0.07 0.00 -1.03 0.00 0.00 54.13 55.72 2pll s LEU 252 Cb -0.02 -4.58 0.06 0.00 0.03 0.00 0.00 46.19 41.69 2pll s LEU 252 CO 0.34 -1.39 1.03 0.42 0.23 0.00 0.00 176.35 176.98 2pll s THR 253 N -1.85 2.25 0.20 5.49 -4.23 -1.26 -0.20 115.64 116.04 2pll s THR 253 Ca 0.73 -0.26 -0.11 0.00 -1.18 0.00 0.00 61.69 60.87 2pll s THR 253 Cb -0.24 -2.99 0.13 0.00 1.34 0.00 0.00 72.50 70.73 2pll s THR 253 CO 0.31 0.00 1.86 0.22 -0.54 0.00 0.00 174.62 176.47 2pll h TYR 254 N -0.64 0.85 0.21 3.99 3.20 -1.95 -0.78 116.97 121.85 2pll h TYR 254 Ca -0.44 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.44 2pll h TYR 254 Cb 1.32 -0.28 -0.01 0.00 1.54 0.00 0.00 36.73 39.30 2pll h TYR 254 CO 0.31 0.52 -0.14 0.00 -1.64 0.00 0.00 178.16 177.20 2pll h ARG 255 N 0.90 -0.33 -1.01 1.82 3.08 -1.99 -1.45 114.38 115.40 2pll h ARG 255 Ca 0.26 0.02 0.03 0.00 0.07 0.00 0.00 59.98 60.36 2pll h ARG 255 Cb -0.06 0.08 -0.06 0.00 0.08 0.00 0.00 29.97 30.01 2pll h ARG 255 CO -0.07 -0.22 0.66 0.93 -1.07 0.00 0.00 179.97 180.20 2pll h GLU 256 N -0.34 1.26 -0.77 0.04 5.08 -1.86 0.19 114.58 118.18 2pll h GLU 256 Ca -0.02 -0.08 -0.02 0.00 -1.00 0.00 0.00 59.36 58.24 2pll h GLU 256 Cb 0.29 -0.28 -0.04 0.00 0.50 0.00 0.00 28.75 29.22 2pll h GLU 256 CO 0.01 0.83 0.39 0.78 -1.00 0.00 0.00 179.01 180.02 2pll h GLY 257 N 1.30 1.18 1.98 -3.84 0.00 -0.93 0.14 103.07 102.89 2pll h GLY 257 Ca 0.39 -0.57 -0.13 0.00 0.00 0.00 0.00 47.33 47.03 2pll h GLY 257 CO -0.11 0.54 -0.59 1.41 0.00 0.00 0.00 176.54 177.79 2pll h LEU 258 N 1.08 0.03 -0.24 3.11 3.38 -0.53 -2.70 115.31 119.44 2pll h LEU 258 Ca 0.27 -0.02 -0.13 0.00 0.09 0.00 0.00 57.88 58.09 2pll h LEU 258 Cb 0.09 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 2pll h LEU 258 CO -0.04 0.61 -0.34 0.22 0.09 0.00 0.00 178.44 178.98 2pll h TYR 259 N 0.02 0.80 -0.09 1.13 3.20 0.22 -0.96 116.97 121.29 2pll h TYR 259 Ca -0.01 -0.27 0.03 0.00 3.14 0.00 0.00 58.73 61.63 2pll h TYR 259 Cb 1.05 -0.16 -0.04 0.00 1.54 0.00 0.00 36.73 39.12 2pll h TYR 259 CO 0.00 1.02 -0.11 0.82 -1.64 0.00 0.00 178.16 178.25 2pll h ILE 260 N 0.36 0.69 -0.19 1.81 2.04 -0.68 -2.07 117.51 119.48 2pll h ILE 260 Ca 0.02 0.00 -0.13 0.00 1.00 0.00 0.00 64.86 65.76 2pll h ILE 260 Cb 0.93 0.69 -0.01 0.00 -0.74 0.00 0.00 36.82 37.69 2pll h ILE 260 CO 0.08 0.00 -0.41 0.71 0.00 0.00 0.00 178.15 178.53 2pll h THR 261 N -0.14 1.31 -0.62 -0.27 1.35 -1.49 -2.19 112.91 110.85 2pll h THR 261 Ca 0.07 -1.57 -0.10 0.00 -0.55 0.00 0.00 66.41 64.26 2pll h THR 261 Cb 0.25 1.61 -0.02 0.00 -1.73 0.00 0.00 68.15 68.26 2pll h THR 261 CO -0.18 0.49 0.01 -0.33 -0.25 0.00 0.00 175.52 175.25 2pll h GLU 262 N 0.37 1.08 -0.29 4.72 5.08 -0.99 -1.38 114.58 123.17 2pll h GLU 262 Ca 0.03 -0.34 -0.14 0.00 -1.00 0.00 0.00 59.36 57.91 2pll h GLU 262 Cb 0.89 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 30.03 2pll h GLU 262 CO 0.07 1.05 -0.37 0.93 -1.00 0.00 0.00 179.01 179.69 2pll h GLU 263 N 0.99 0.68 -0.13 2.33 4.39 -1.30 -2.04 114.58 119.50 2pll h GLU 263 Ca 0.18 -0.34 -0.01 0.00 0.34 0.00 0.00 59.36 59.53 2pll h GLU 263 Cb 0.56 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.20 2pll h GLU 263 CO 0.03 0.94 0.06 0.82 -1.16 0.00 0.00 179.01 179.70 2pll h ILE 264 N 0.56 1.13 -0.50 3.13 1.08 -1.20 -2.88 117.51 118.83 2pll h ILE 264 Ca 0.05 -0.37 0.06 0.00 -0.39 0.00 0.00 64.86 64.22 2pll h ILE 264 Cb 0.90 1.14 -0.06 0.00 -3.07 0.00 0.00 36.82 35.73 2pll h ILE 264 CO 0.08 0.12 0.19 0.22 -0.69 0.00 0.00 178.15 178.06 2pll h TYR 265 N 0.07 0.33 0.00 1.37 3.20 -1.15 -1.87 116.97 118.93 2pll h TYR 265 Ca 0.04 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.94 2pll h TYR 265 Cb 0.13 -0.07 0.00 0.00 1.54 0.00 0.00 36.73 38.33 2pll h TYR 265 CO -0.03 0.12 0.00 0.87 -1.64 0.00 0.00 178.16 177.48 2pll h LYS 266 N 0.37 0.00 0.00 1.82 1.57 -1.16 0.05 116.57 119.22 2pll h LYS 266 Ca 0.24 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.96 2pll h LYS 266 Cb 0.24 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.54 2pll h LYS 266 CO -0.23 0.00 -0.27 1.79 -0.57 0.00 0.00 179.45 180.17 2pll h THR 267 N 0.00 0.61 -0.09 -0.16 1.35 -1.16 -3.46 112.91 110.00 2pll h THR 267 Ca 0.00 -1.30 -0.04 0.00 -0.55 0.00 0.00 66.41 64.52 2pll h THR 267 Cb 0.03 1.87 -0.02 0.00 -1.73 0.00 0.00 68.15 68.31 2pll h THR 267 CO 0.00 0.26 -0.04 0.61 -0.25 0.00 0.00 175.52 176.11 2pll n GLY 268 N 0.32 0.42 0.57 5.82 0.00 0.00 -4.86 105.19 107.47 2pll n GLY 268 Ca 0.00 -0.10 0.05 0.00 0.00 0.00 0.00 46.02 45.97 2pll n GLY 268 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2pll n LEU 269 N -0.22 2.81 -4.71 0.99 4.77 -1.26 -4.99 117.00 114.38 2pll n LEU 269 Ca -0.02 -1.98 -0.42 0.00 -0.03 0.00 0.00 56.01 53.56 2pll n LEU 269 Cb 0.27 -0.20 -0.03 0.00 -2.33 0.00 0.00 43.42 41.12 2pll n LEU 269 CO 0.03 0.70 1.26 -0.22 -1.33 0.00 0.00 177.39 177.83 2pll s LEU 270 N -1.00 4.37 0.00 2.23 2.96 -1.26 -0.89 118.68 125.09 2pll s LEU 270 Ca 0.21 2.63 0.00 0.00 -0.22 0.00 0.00 54.13 56.75 2pll s LEU 270 Cb 0.11 -3.59 0.00 0.00 0.50 0.00 0.00 46.19 43.21 2pll s LEU 270 CO 0.14 -0.85 0.00 -0.24 -1.32 0.00 0.00 176.35 174.08 2pll n SER 271 N 4.19 4.09 -3.88 3.68 2.88 0.11 -4.79 113.62 119.90 2pll n SER 271 Ca 0.14 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.57 2pll n SER 271 Cb 0.38 0.23 -0.13 0.00 -0.75 0.00 0.00 64.21 63.94 2pll n SER 271 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2pll s GLY 272 N -3.37 0.02 -0.00 0.46 0.00 -0.71 -2.63 107.32 101.08 2pll s GLY 272 Ca 0.00 -0.00 0.01 0.00 0.00 0.00 0.00 44.72 44.72 2pll s GLY 272 CO 0.00 -0.05 -0.02 -2.27 0.00 0.00 0.00 173.10 170.77 2pll s LEU 273 N -0.38 1.92 -0.06 0.66 2.96 0.77 0.06 118.68 124.62 2pll s LEU 273 Ca -0.04 -0.04 0.04 0.00 -0.22 0.00 0.00 54.13 53.87 2pll s LEU 273 Cb -0.03 -0.12 -0.00 0.00 0.50 0.00 0.00 46.19 46.54 2pll s LEU 273 CO 0.00 0.01 -0.19 -1.81 -1.32 0.00 0.00 176.35 173.04 2pll s ASP 274 N 0.06 2.44 -0.34 3.68 1.01 -0.12 -0.57 116.67 122.83 2pll s ASP 274 Ca -0.00 -0.41 0.04 0.00 0.71 0.00 0.00 52.55 52.88 2pll s ASP 274 Cb -0.02 -0.80 0.10 0.00 1.01 0.00 0.00 42.92 43.21 2pll s ASP 274 CO -0.00 0.16 0.05 -0.63 0.21 0.00 0.00 175.17 174.96 2pll s ILE 275 N 0.12 2.20 0.35 0.77 -1.09 -0.62 -0.79 121.20 122.13 2pll s ILE 275 Ca -0.07 -2.29 0.08 0.00 -2.23 0.00 0.00 60.65 56.14 2pll s ILE 275 Cb -0.14 -2.63 -0.07 0.00 -1.58 0.00 0.00 42.46 38.05 2pll s ILE 275 CO 0.04 -0.60 -0.06 -0.04 -1.23 0.00 0.00 174.94 173.05 2pll s MET 276 N 0.94 1.80 -1.25 2.79 -1.94 0.27 -1.60 119.30 120.31 2pll s MET 276 Ca 0.11 -1.95 0.00 0.00 -1.71 0.00 0.00 55.69 52.13 2pll s MET 276 Cb -0.19 -1.56 0.00 0.00 2.01 0.00 0.00 34.83 35.09 2pll s MET 276 CO -0.09 0.06 0.00 0.39 -0.01 0.00 0.00 175.02 175.37 2pll n GLU 277 N -0.80 -0.88 -2.76 2.03 -0.58 -0.76 -1.35 120.64 115.54 2pll n GLU 277 Ca -0.05 0.86 -0.43 0.00 -0.42 0.00 0.00 57.16 57.12 2pll n GLU 277 Cb 0.64 -4.92 -0.03 0.00 -0.57 0.00 0.00 31.44 26.56 2pll n GLU 277 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 2pll s VAL 278 N -2.49 4.41 -0.52 2.62 1.01 -1.26 -4.27 120.40 119.90 2pll s VAL 278 Ca 0.00 0.92 0.02 0.00 0.00 0.00 0.00 61.98 62.92 2pll s VAL 278 Cb 0.00 -4.47 0.13 0.00 0.00 0.00 0.00 36.38 32.04 2pll s VAL 278 CO 0.00 -0.85 0.27 0.21 0.00 0.00 0.00 175.10 174.73 2pll s ASN 279 N 2.28 4.58 0.46 3.32 3.84 0.14 -4.04 114.94 125.51 2pll s ASN 279 Ca 0.40 -2.86 0.24 0.00 0.21 0.00 0.00 52.86 50.86 2pll s ASN 279 Cb -0.09 -1.69 1.27 0.00 -0.55 0.00 0.00 41.25 40.18 2pll s ASN 279 CO 0.27 -0.28 1.83 -0.65 -2.79 0.00 0.00 177.10 175.47 2pll h PRO 280 N 6.77 0.23 0.00 0.43 0.11 -1.75 -0.42 132.00 137.37 2pll h PRO 280 Ca -0.06 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.03 2pll h PRO 280 Cb 0.92 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.98 2pll h PRO 280 CO 0.67 0.15 0.00 -1.13 -0.21 0.00 0.00 178.00 177.49 2pll n SER 281 N -4.44 0.00 -0.77 -2.05 3.41 -1.26 -2.92 113.62 105.59 2pll n SER 281 Ca 0.22 -0.09 0.13 0.00 -0.26 0.00 0.00 58.87 58.87 2pll n SER 281 Cb 0.92 -0.28 0.25 0.00 -0.26 0.00 0.00 64.21 64.84 2pll n SER 281 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2pll n LEU 282 N -1.28 2.43 -4.69 1.04 4.77 -0.17 -4.89 117.00 114.22 2pll n LEU 282 Ca 0.12 -0.81 -0.42 0.00 -0.03 0.00 0.00 56.01 54.86 2pll n LEU 282 Cb 0.19 -0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.25 2pll n LEU 282 CO 0.18 0.41 0.94 -0.83 -1.33 0.00 0.00 177.39 176.76 2pll s GLY 283 N -2.01 2.14 0.62 -0.72 0.00 -1.15 -4.58 107.32 101.62 2pll s GLY 283 Ca 0.31 0.62 0.40 0.00 0.00 0.00 0.00 44.72 46.05 2pll s GLY 283 CO 0.32 2.18 2.22 0.50 0.00 0.00 0.00 173.10 178.32 2pll h LYS 284 N 7.39 0.00 -3.85 2.90 1.57 -1.92 -3.44 116.57 119.23 2pll h LYS 284 Ca -0.34 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.35 2pll h LYS 284 Cb 1.16 0.00 -0.14 0.00 0.08 0.00 0.00 32.23 33.34 2pll h LYS 284 CO 0.87 0.00 -0.38 0.95 -0.57 0.00 0.00 179.45 180.32 2pll s THR 285 N -3.96 0.13 0.40 -0.16 -4.23 -1.26 -5.02 115.64 101.54 2pll s THR 285 Ca -0.03 -1.25 0.38 0.00 -1.18 0.00 0.00 61.69 59.61 2pll s THR 285 Cb 0.11 -1.43 0.40 0.00 1.34 0.00 0.00 72.50 72.92 2pll s THR 285 CO 0.45 -0.61 2.17 -0.65 -0.54 0.00 0.00 174.62 175.44 2pll h PRO 286 N 2.74 0.00 -0.01 3.99 0.11 -1.98 -1.53 132.00 135.32 2pll h PRO 286 Ca -0.34 0.00 -0.21 0.00 0.11 0.00 0.00 66.00 65.57 2pll h PRO 286 Cb 1.20 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.31 2pll h PRO 286 CO 0.56 0.02 -0.87 1.49 -0.21 0.00 0.00 178.00 178.98 2pll h GLU 287 N 0.00 0.32 -0.07 1.05 4.22 -1.96 -2.34 114.58 115.81 2pll h GLU 287 Ca -0.00 -0.33 -0.14 0.00 0.08 0.00 0.00 59.36 58.97 2pll h GLU 287 Cb 0.26 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 2pll h GLU 287 CO 0.00 1.02 -0.58 0.93 -2.18 0.00 0.00 179.01 178.20 2pll h GLU 288 N 0.19 0.22 -0.07 1.92 5.08 -1.66 -1.30 114.58 118.96 2pll h GLU 288 Ca -0.06 -0.15 -0.01 0.00 -1.00 0.00 0.00 59.36 58.15 2pll h GLU 288 Cb 1.49 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 30.76 2pll h GLU 288 CO 0.14 0.74 -0.00 0.28 -1.00 0.00 0.00 179.01 179.17 2pll h VAL 289 N 0.17 1.26 -0.79 3.13 2.07 -1.40 -1.57 116.25 119.12 2pll h VAL 289 Ca -0.00 -0.81 -0.02 0.00 0.82 0.00 0.00 66.70 66.69 2pll h VAL 289 Cb 1.06 1.66 -0.04 0.00 -1.52 0.00 0.00 31.29 32.46 2pll h VAL 289 CO 0.09 0.22 0.41 0.71 0.02 0.00 0.00 177.57 179.02 2pll h THR 290 N -0.17 1.24 -0.38 2.57 1.35 -1.36 -0.55 112.91 115.61 2pll h THR 290 Ca 0.02 -0.64 0.01 0.00 -0.55 0.00 0.00 66.41 65.26 2pll h THR 290 Cb 0.35 0.20 -0.02 0.00 -1.73 0.00 0.00 68.15 66.94 2pll h THR 290 CO 0.00 0.28 0.23 -0.09 -0.25 0.00 0.00 175.52 175.69 2pll h ARG 291 N 1.12 0.45 0.01 4.72 2.43 -1.09 0.43 114.38 122.44 2pll h ARG 291 Ca 0.28 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.42 2pll h ARG 291 Cb 0.07 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.52 2pll h ARG 291 CO -0.04 0.30 -0.01 1.15 -1.51 0.00 0.00 179.97 179.86 2pll h THR 292 N 0.46 1.19 -0.15 0.20 2.02 -0.91 -1.46 112.91 114.26 2pll h THR 292 Ca 0.15 -0.62 -0.00 0.00 0.77 0.00 0.00 66.41 66.71 2pll h THR 292 Cb -0.00 1.61 -0.01 0.00 -1.74 0.00 0.00 68.15 68.01 2pll h THR 292 CO -0.06 0.16 0.09 0.58 0.37 0.00 0.00 175.52 176.65 2pll h VAL 293 N -0.29 1.07 -0.59 3.16 2.07 -0.97 -0.34 116.25 120.37 2pll h VAL 293 Ca -0.00 -0.19 -0.02 0.00 0.82 0.00 0.00 66.70 67.31 2pll h VAL 293 Cb 0.28 0.93 -0.03 0.00 -1.52 0.00 0.00 31.29 30.95 2pll h VAL 293 CO 0.00 0.07 0.26 0.78 0.02 0.00 0.00 177.57 178.70 2pll h ASN 294 N 0.17 0.75 -0.25 0.57 2.35 -0.15 0.28 115.58 119.30 2pll h ASN 294 Ca 0.05 -0.08 -0.14 0.00 -0.55 0.00 0.00 56.30 55.58 2pll h ASN 294 Cb 0.03 -0.19 -0.00 0.00 0.05 0.00 0.00 38.32 38.21 2pll h ASN 294 CO -0.01 0.66 -0.39 0.74 -1.65 0.00 0.00 177.43 176.77 2pll h THR 295 N 0.83 1.31 -0.90 2.81 2.02 -1.11 -1.68 112.91 116.19 2pll h THR 295 Ca 0.20 -1.59 0.01 0.00 0.77 0.00 0.00 66.41 65.79 2pll h THR 295 Cb 0.12 1.73 -0.04 0.00 -1.74 0.00 0.00 68.15 68.21 2pll h THR 295 CO -0.02 0.51 0.58 0.00 0.37 0.00 0.00 175.52 176.95 2pll h ALA 296 N 0.65 1.14 0.00 6.16 0.00 -0.55 -1.23 119.26 125.42 2pll h ALA 296 Ca 0.02 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 2pll h ALA 296 Cb 0.99 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2pll h ALA 296 CO 0.09 0.55 -0.00 0.28 0.00 0.00 0.00 179.25 180.17 2pll h VAL 297 N 1.22 1.13 -0.73 0.00 2.07 -0.87 -2.49 116.25 116.57 2pll h VAL 297 Ca 0.33 -0.37 0.08 0.00 0.82 0.00 0.00 66.70 67.56 2pll h VAL 297 Cb -0.12 1.38 -0.07 0.00 -1.52 0.00 0.00 31.29 30.96 2pll h VAL 297 CO -0.07 0.10 0.39 0.00 0.02 0.00 0.00 177.57 178.01 2pll h ALA 298 N 0.84 1.01 -0.60 1.67 0.00 -0.88 0.42 119.26 121.71 2pll h ALA 298 Ca -0.00 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 2pll h ALA 298 Cb 0.16 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 2pll h ALA 298 CO 0.00 0.02 0.37 0.82 0.00 0.00 0.00 179.25 180.45 2pll h ILE 299 N 0.67 1.18 -0.41 0.00 1.08 -1.16 -1.87 117.51 116.99 2pll h ILE 299 Ca 0.35 -0.38 -0.08 0.00 -0.39 0.00 0.00 64.86 64.35 2pll h ILE 299 Cb 0.32 0.35 -0.01 0.00 -3.07 0.00 0.00 36.82 34.40 2pll h ILE 299 CO -0.24 0.18 -0.06 0.74 -0.69 0.00 0.00 178.15 178.08 2pll h THR 300 N 0.81 1.27 -0.58 -0.27 2.02 -0.87 -2.46 112.91 112.84 2pll h THR 300 Ca 0.22 -1.13 -0.02 0.00 0.77 0.00 0.00 66.41 66.24 2pll h THR 300 Cb -0.03 1.17 -0.03 0.00 -1.74 0.00 0.00 68.15 67.52 2pll h THR 300 CO -0.04 0.38 0.27 -0.07 0.37 0.00 0.00 175.52 176.43 2pll h LEU 301 N 0.59 0.74 -1.09 2.58 3.38 -0.77 -1.79 115.31 118.94 2pll h LEU 301 Ca 0.11 -0.08 -0.09 0.00 0.09 0.00 0.00 57.88 57.92 2pll h LEU 301 Cb 0.57 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 2pll h LEU 301 CO 0.03 0.64 -0.29 0.00 0.09 0.00 0.00 178.44 178.91 2pll h ALA 302 N 1.48 1.24 0.00 1.53 0.00 -1.14 -2.09 119.26 120.28 2pll h ALA 302 Ca 0.20 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2pll h ALA 302 Cb 0.10 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2pll h ALA 302 CO -0.02 0.51 0.00 0.00 0.00 0.00 0.00 179.25 179.73 2pll n PHE 304 N -2.74 0.30 0.00 0.00 3.72 -0.81 -4.52 117.46 113.41 2pll n PHE 304 Ca -0.01 -1.06 0.00 0.00 -0.05 0.00 0.00 57.45 56.33 2pll n PHE 304 Cb 0.16 -0.22 0.00 0.00 -0.94 0.00 0.00 39.48 38.47 2pll n PHE 304 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2pll n GLY 305 N -1.16 3.75 3.40 1.37 0.00 -1.09 -4.82 105.19 106.65 2pll n GLY 305 Ca 0.19 -0.94 -0.50 0.00 0.00 0.00 0.00 46.02 44.76 2pll n GLY 305 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2pll n LEU 306 N 0.00 1.21 -4.72 0.99 0.00 -1.04 -4.92 117.00 108.52 2pll n LEU 306 Ca 0.00 0.37 -0.35 0.00 0.00 0.00 0.00 56.01 56.03 2pll n LEU 306 Cb 0.00 -1.08 -0.09 0.00 0.00 0.00 0.00 43.42 42.25 2pll n LEU 306 CO 0.00 -0.82 -0.28 0.00 0.00 0.00 0.00 177.39 176.29 2pll s ALA 307 N 7.68 3.40 0.40 1.96 0.00 -1.26 -4.33 121.76 129.62 2pll s ALA 307 Ca 1.19 -0.77 0.21 0.00 0.00 0.00 0.00 51.96 52.58 2pll s ALA 307 Cb -1.12 -1.58 1.14 0.00 0.00 0.00 0.00 23.12 21.56 2pll s ALA 307 CO 0.53 0.59 1.98 0.00 0.00 0.00 0.00 175.76 178.86 2pll h ARG 308 N 5.14 0.00 0.00 0.00 3.08 -1.98 -1.97 114.38 118.65 2pll h ARG 308 Ca -0.51 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.54 2pll h ARG 308 Cb 1.20 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.25 2pll h ARG 308 CO 0.55 0.20 0.00 1.05 -1.07 0.00 0.00 179.97 180.70 2pll h GLU 309 N 0.00 0.00 0.00 0.04 4.11 -2.00 -3.48 114.58 113.25 2pll h GLU 309 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2pll h GLU 309 Cb 0.43 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.68 2pll h GLU 309 CO 0.03 0.00 0.00 0.41 0.07 0.00 0.00 179.01 179.52 2pll n GLY 310 N 0.51 2.89 3.16 1.06 0.00 -0.74 -5.12 105.19 106.94 2pll n GLY 310 Ca 0.03 -2.02 -0.10 0.00 0.00 0.00 0.00 46.02 43.94 2pll n GLY 310 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2pll s ASN 311 N 0.00 0.80 -0.23 1.61 -0.87 -1.26 -4.63 114.94 110.36 2pll s ASN 311 Ca 0.00 -1.08 -0.27 0.00 -1.57 0.00 0.00 52.86 49.94 2pll s ASN 311 Cb 0.00 0.17 0.13 0.00 -0.02 0.00 0.00 41.25 41.53 2pll s ASN 311 CO 0.00 -0.58 1.04 -1.38 -2.57 0.00 0.00 177.10 173.61 2pll s HIS 312 N -3.80 -0.41 0.73 2.20 -3.43 -1.26 -5.13 115.29 104.19 2pll s HIS 312 Ca 0.15 0.87 -0.11 0.00 -0.80 0.00 0.00 55.06 55.18 2pll s HIS 312 Cb 0.07 0.41 0.03 0.00 -1.43 0.00 0.00 32.58 31.65 2pll s HIS 312 CO -0.03 -0.27 1.07 0.15 -2.00 0.00 0.00 174.74 173.66 2pll s LYS 313 N -0.39 2.65 -0.98 -0.38 1.02 -1.26 -4.89 119.74 115.52 2pll s LYS 313 Ca 0.01 0.88 -0.10 0.00 0.02 0.00 0.00 55.97 56.77 2pll s LYS 313 Cb -0.03 -1.96 -0.07 0.00 -0.52 0.00 0.00 37.83 35.24 2pll s LYS 313 CO -0.03 -1.28 2.15 -0.35 -0.92 0.00 0.00 175.35 174.92 2pll n PRO 314 N -3.24 2.15 -4.12 -1.68 -0.04 -1.26 -4.79 135.00 122.02 2pll n PRO 314 Ca 0.07 -1.69 -0.15 0.00 -0.04 0.00 0.00 63.50 61.70 2pll n PRO 314 Cb 0.54 -2.64 -0.11 0.00 -0.04 0.00 0.00 33.50 31.25 2pll n PRO 314 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2pll s ILE 315 N 3.65 0.79 -0.63 0.52 1.01 -1.26 -5.10 121.20 120.19 2pll s ILE 315 Ca 0.47 -1.30 -0.24 0.00 0.00 0.00 0.00 60.65 59.58 2pll s ILE 315 Cb 0.12 -0.94 0.05 0.00 0.01 0.00 0.00 42.46 41.70 2pll s ILE 315 CO -0.00 -0.40 1.03 -0.62 0.00 0.00 0.00 174.94 174.95 2pll s ASP 316 N -1.87 6.25 0.48 3.58 3.68 -1.26 -4.89 116.67 122.64 2pll s ASP 316 Ca -0.04 -0.57 0.26 0.00 2.13 0.00 0.00 52.55 54.34 2pll s ASP 316 Cb -0.08 -2.46 1.10 0.00 -1.45 0.00 0.00 42.92 40.03 2pll s ASP 316 CO 0.01 -1.43 1.90 1.88 0.13 0.00 0.00 175.17 177.65 2pll h TYR 317 N 9.55 0.00 -0.01 -5.34 0.05 -1.99 -3.54 116.97 115.69 2pll h TYR 317 Ca -0.27 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.51 2pll h TYR 317 Cb 1.07 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.81 2pll h TYR 317 CO 0.98 0.17 0.00 1.28 -1.05 0.00 0.00 178.16 179.54