#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d1d s THR 12 N 0.00 0.84 -0.07 5.87 -4.23 -1.26 -4.64 115.64 112.15 1d1d s THR 12 Ca 0.00 -0.68 -0.30 0.00 -1.18 0.00 0.00 61.69 59.53 1d1d s THR 12 Cb 0.00 -0.75 -0.03 0.00 1.34 0.00 0.00 72.50 73.06 1d1d s THR 12 CO 0.00 0.07 1.23 -2.16 -0.54 0.00 0.00 174.62 173.22 1d1d s PRO 13 N -0.68 4.33 0.16 3.99 0.04 -1.26 -5.03 135.00 136.55 1d1d s PRO 13 Ca 0.01 1.70 0.10 0.00 0.04 0.00 0.00 61.00 62.85 1d1d s PRO 13 Cb -0.06 -3.59 -0.04 0.00 0.04 0.00 0.00 34.50 30.85 1d1d s PRO 13 CO 0.00 -0.50 -0.17 -1.17 0.04 0.00 0.00 177.00 175.21 1d1d s LEU 14 N 2.43 2.71 -0.43 -3.56 2.96 -1.26 -5.10 118.68 116.43 1d1d s LEU 14 Ca 0.56 -0.67 -0.08 0.00 -0.22 0.00 0.00 54.13 53.73 1d1d s LEU 14 Cb -0.25 -1.46 0.09 0.00 0.50 0.00 0.00 46.19 45.07 1d1d s LEU 14 CO 0.21 0.13 0.26 -0.70 -1.32 0.00 0.00 176.35 174.94 1d1d s GLU 15 N -2.57 2.45 0.18 1.98 2.56 -1.26 -4.93 118.70 117.12 1d1d s GLU 15 Ca 0.21 -1.60 0.03 0.00 0.00 0.00 0.00 54.97 53.61 1d1d s GLU 15 Cb -0.09 -3.76 0.06 0.00 2.00 0.00 0.00 34.13 32.34 1d1d s GLU 15 CO 0.12 -1.03 1.43 -1.00 -0.56 0.00 0.00 175.26 174.21 1d1d h PRO 16 N 8.34 0.20 -0.20 4.30 0.13 -1.99 -0.47 132.00 142.31 1d1d h PRO 16 Ca -0.21 -0.19 -0.02 0.00 -0.87 0.00 0.00 66.00 64.71 1d1d h PRO 16 Cb 1.07 0.05 -0.01 0.00 0.13 0.00 0.00 31.00 32.25 1d1d h PRO 16 CO 0.77 0.90 0.03 1.57 -0.23 0.00 0.00 178.00 181.04 1d1d h LYS 17 N 0.12 0.33 -0.40 0.86 2.10 -1.97 1.79 116.57 119.40 1d1d h LYS 17 Ca -0.03 -0.09 -0.15 0.00 -2.00 0.00 0.00 60.65 58.38 1d1d h LYS 17 Cb 1.40 -0.04 -0.01 0.00 -0.90 0.00 0.00 32.23 32.69 1d1d h LYS 17 CO 0.12 0.49 -0.33 -0.07 -2.00 0.00 0.00 179.45 177.66 1d1d h LEU 18 N 0.12 0.95 -0.55 7.07 3.38 -1.98 -0.65 115.31 123.65 1d1d h LEU 18 Ca 0.06 -0.40 -0.15 0.00 0.09 0.00 0.00 57.88 57.47 1d1d h LEU 18 Cb 0.32 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 1d1d h LEU 18 CO 0.00 1.18 -0.49 0.40 0.09 0.00 0.00 178.44 179.63 1d1d h ILE 19 N 0.75 1.31 0.02 1.22 2.04 -0.90 -1.13 117.51 120.83 1d1d h ILE 19 Ca 0.08 -1.70 -0.00 0.00 1.00 0.00 0.00 64.86 64.23 1d1d h ILE 19 Cb 0.90 1.66 0.00 0.00 -0.74 0.00 0.00 36.82 38.64 1d1d h ILE 19 CO 0.08 0.54 -0.01 0.74 0.00 0.00 0.00 178.15 179.50 1d1d h THR 20 N 0.48 1.13 -0.85 -0.27 2.02 0.30 0.50 112.91 116.22 1d1d h THR 20 Ca 0.02 -0.47 -0.02 0.00 0.77 0.00 0.00 66.41 66.71 1d1d h THR 20 Cb 1.02 1.45 -0.04 0.00 -1.74 0.00 0.00 68.15 68.84 1d1d h THR 20 CO 0.10 0.12 0.46 0.08 0.37 0.00 0.00 175.52 176.65 1d1d h ARG 21 N -0.24 1.18 -0.25 6.66 0.11 -1.09 0.60 114.38 121.35 1d1d h ARG 21 Ca -0.00 -0.14 -0.04 0.00 0.10 0.00 0.00 59.98 59.89 1d1d h ARG 21 Cb 0.22 -0.23 -0.01 0.00 1.11 0.00 0.00 29.97 31.06 1d1d h ARG 21 CO 0.01 0.87 -0.01 -0.07 0.10 0.00 0.00 179.97 180.87 1d1d h LEU 22 N 1.18 0.45 -1.29 0.08 3.38 -1.03 -1.67 115.31 116.41 1d1d h LEU 22 Ca 0.30 -0.32 -0.06 0.00 0.09 0.00 0.00 57.88 57.89 1d1d h LEU 22 Cb 0.04 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 1d1d h LEU 22 CO -0.05 0.66 -0.18 0.00 0.09 0.00 0.00 178.44 178.96 1d1d h ALA 23 N 0.80 1.41 -0.21 1.53 0.00 0.43 -1.96 119.26 121.27 1d1d h ALA 23 Ca 0.07 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 1d1d h ALA 23 Cb 0.44 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1d1d h ALA 23 CO 0.02 0.41 0.10 -0.44 0.00 0.00 0.00 179.25 179.34 1d1d h ASP 24 N 0.24 0.27 -0.71 0.00 3.32 0.59 -0.36 116.42 119.76 1d1d h ASP 24 Ca 0.04 -0.11 -0.01 0.00 0.02 0.00 0.00 57.03 56.97 1d1d h ASP 24 Cb 0.46 -0.07 -0.03 0.00 0.22 0.00 0.00 39.33 39.91 1d1d h ASP 24 CO 0.03 0.30 0.40 0.74 -1.72 0.00 0.00 179.24 179.00 1d1d h THR 25 N 0.21 1.21 -0.70 0.35 2.02 -0.90 0.12 112.91 115.23 1d1d h THR 25 Ca 0.07 -0.52 -0.04 0.00 0.77 0.00 0.00 66.41 66.69 1d1d h THR 25 Cb 0.11 0.23 -0.03 0.00 -1.74 0.00 0.00 68.15 66.71 1d1d h THR 25 CO -0.01 0.23 0.27 0.58 0.37 0.00 0.00 175.52 176.96 1d1d h VAL 26 N 1.00 1.25 -0.11 3.16 2.07 -0.88 1.59 116.25 124.33 1d1d h VAL 26 Ca 0.26 -0.78 -0.02 0.00 0.82 0.00 0.00 66.70 66.97 1d1d h VAL 26 Cb 0.01 0.46 -0.00 0.00 -1.52 0.00 0.00 31.29 30.24 1d1d h VAL 26 CO -0.04 0.31 -0.02 -0.09 0.02 0.00 0.00 177.57 177.75 1d1d h ARG 27 N 0.99 0.21 -0.03 1.57 2.43 -0.24 0.29 114.38 119.61 1d1d h ARG 27 Ca 0.23 -0.08 -0.11 0.00 -0.81 0.00 0.00 59.98 59.21 1d1d h ARG 27 Cb 0.22 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.75 1d1d h ARG 27 CO -0.02 0.51 -0.51 1.79 -1.51 0.00 0.00 179.97 180.24 1d1d h THR 28 N -0.10 1.36 0.00 0.20 1.35 -0.58 -2.16 112.91 112.97 1d1d h THR 28 Ca 0.03 -1.74 0.00 0.00 -0.55 0.00 0.00 66.41 64.15 1d1d h THR 28 Cb 0.43 1.91 0.00 0.00 -1.73 0.00 0.00 68.15 68.76 1d1d h THR 28 CO 0.01 0.50 -0.07 0.29 -0.25 0.00 0.00 175.52 176.00 1d1d n LYS 29 N -3.94 0.22 -0.35 4.72 4.76 0.54 -5.02 118.16 119.09 1d1d n LYS 29 Ca -0.02 0.16 0.00 0.00 -2.87 0.00 0.00 58.31 55.59 1d1d n LYS 29 Cb 0.53 -1.74 0.00 0.00 -1.84 0.00 0.00 35.03 31.98 1d1d n LYS 29 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1d1d n GLY 30 N 1.34 -3.63 0.30 0.72 0.00 0.10 -4.14 105.19 99.88 1d1d n GLY 30 Ca 0.06 -0.86 0.19 0.00 0.00 0.00 0.00 46.02 45.40 1d1d n GLY 30 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1d1d h LEU 31 N 0.49 0.00 -0.98 0.99 3.38 -1.81 -0.08 115.31 117.30 1d1d h LEU 31 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1d1d h LEU 31 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1d1d h LEU 31 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 178.44 179.07 1d1d n ARG 32 N -3.09 1.66 -4.06 1.13 1.74 -1.26 -4.82 116.66 107.95 1d1d n ARG 32 Ca -0.00 -0.97 -0.27 0.00 -0.77 0.00 0.00 57.85 55.83 1d1d n ARG 32 Cb 0.24 -1.43 -0.06 0.00 -1.02 0.00 0.00 32.46 30.19 1d1d n ARG 32 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1d1d s SER 33 N -1.76 5.57 -0.74 0.55 0.15 -0.04 -5.04 113.70 112.39 1d1d s SER 33 Ca 0.35 -0.08 -0.26 0.00 0.70 0.00 0.00 55.95 56.66 1d1d s SER 33 Cb 0.19 -1.48 0.00 0.00 -1.71 0.00 0.00 66.02 63.02 1d1d s SER 33 CO 0.29 0.10 1.59 -2.16 1.20 0.00 0.00 173.24 174.26 1d1d s PRO 34 N -2.91 2.95 0.00 5.44 0.04 -1.26 -3.22 135.00 136.03 1d1d s PRO 34 Ca 0.31 -0.01 0.00 0.00 0.04 0.00 0.00 61.00 61.33 1d1d s PRO 34 Cb -0.11 -4.48 0.00 0.00 0.04 0.00 0.00 34.50 29.95 1d1d s PRO 34 CO 0.23 -2.51 0.00 -0.89 0.04 0.00 0.00 177.00 173.87 1d1d n ILE 35 N 6.91 0.00 -0.07 0.56 5.41 -1.26 -4.99 119.36 125.92 1d1d n ILE 35 Ca 0.17 0.00 -0.08 0.00 1.00 0.00 0.00 62.75 63.84 1d1d n ILE 35 Cb 0.50 0.00 -0.01 0.00 -0.71 0.00 0.00 39.64 39.42 1d1d n ILE 35 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 176.55 177.29 1d1d h THR 36 N 0.00 0.98 -0.63 1.39 2.02 -1.77 0.72 112.91 115.61 1d1d h THR 36 Ca 0.00 -0.10 -0.06 0.00 0.77 0.00 0.00 66.41 67.03 1d1d h THR 36 Cb 0.00 0.67 -0.03 0.00 -1.74 0.00 0.00 68.15 67.06 1d1d h THR 36 CO 0.00 0.05 0.17 0.24 0.37 0.00 0.00 175.52 176.35 1d1d h MET 37 N 0.28 0.99 0.04 6.66 2.86 -1.90 0.37 114.93 124.23 1d1d h MET 37 Ca 0.12 -0.23 -0.00 0.00 -2.06 0.00 0.00 59.70 57.53 1d1d h MET 37 Cb 0.05 -0.14 0.00 0.00 0.06 0.00 0.00 31.60 31.57 1d1d h MET 37 CO -0.09 0.89 -0.02 0.00 1.06 0.00 0.00 176.91 178.76 1d1d h ALA 38 N 1.06 -0.05 -0.26 6.32 0.00 -1.83 0.43 119.26 124.92 1d1d h ALA 38 Ca 0.20 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1d1d h ALA 38 Cb 0.33 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1d1d h ALA 38 CO -0.00 -0.40 0.17 0.93 0.00 0.00 0.00 179.25 179.95 1d1d h GLU 39 N -0.31 0.34 -0.09 0.00 5.08 0.56 0.45 114.58 120.60 1d1d h GLU 39 Ca -0.01 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1d1d h GLU 39 Cb 0.29 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.46 1d1d h GLU 39 CO 0.01 0.22 0.06 0.28 -1.00 0.00 0.00 179.01 178.58 1d1d h VAL 40 N 0.35 1.05 0.00 3.13 2.07 -0.20 -1.22 116.25 121.43 1d1d h VAL 40 Ca 0.10 -0.13 -0.01 0.00 0.82 0.00 0.00 66.70 67.47 1d1d h VAL 40 Cb -0.03 0.98 -0.00 0.00 -1.52 0.00 0.00 31.29 30.71 1d1d h VAL 40 CO -0.03 0.05 -0.07 -0.33 0.02 0.00 0.00 177.57 177.21 1d1d h GLU 41 N 0.09 0.00 0.54 1.57 5.08 0.19 0.34 114.58 122.39 1d1d h GLU 41 Ca 0.03 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.37 1d1d h GLU 41 Cb 0.03 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.28 1d1d h GLU 41 CO -0.01 0.07 -0.26 0.00 -1.00 0.00 0.00 179.01 177.81 1d1d h ALA 42 N 1.93 -0.73 -0.10 3.43 0.00 0.11 1.61 119.26 125.51 1d1d h ALA 42 Ca -0.00 -0.18 -0.12 0.00 0.00 0.00 0.00 54.91 54.61 1d1d h ALA 42 Cb 0.22 0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1d1d h ALA 42 CO 0.01 -0.86 -0.40 1.37 0.00 0.00 0.00 179.25 179.37 1d1d h LEU 43 N -0.82 0.52 0.00 0.00 8.10 -1.13 -2.91 115.31 119.07 1d1d h LEU 43 Ca -0.07 -0.63 0.00 0.00 0.11 0.00 0.00 57.88 57.28 1d1d h LEU 43 Cb 0.60 -0.15 0.00 0.00 -0.44 0.00 0.00 40.66 40.66 1d1d h LEU 43 CO 0.12 1.06 0.00 0.23 -4.11 0.00 0.00 178.44 175.74 1d1d n MET 44 N -4.33 0.00 -0.39 0.17 2.81 0.12 -3.53 117.12 111.97 1d1d n MET 44 Ca -0.08 0.25 0.32 0.00 -1.81 0.00 0.00 57.70 56.39 1d1d n MET 44 Cb 0.54 -1.50 0.54 0.00 -0.71 0.00 0.00 33.22 32.09 1d1d n MET 44 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1d1d n SER 45 N -1.50 0.14 -4.93 7.83 2.88 0.55 -4.18 113.62 114.42 1d1d n SER 45 Ca 0.04 1.04 -0.22 0.00 -1.33 0.00 0.00 58.87 58.39 1d1d n SER 45 Cb 0.17 -0.51 -0.03 0.00 -0.75 0.00 0.00 64.21 63.09 1d1d n SER 45 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1d1d s SER 46 N -4.28 6.13 0.48 -3.46 1.04 -1.23 -5.07 113.70 107.31 1d1d s SER 46 Ca -0.05 0.02 -0.20 0.00 0.48 0.00 0.00 55.95 56.19 1d1d s SER 46 Cb 0.24 -1.76 -0.08 0.00 0.10 0.00 0.00 66.02 64.51 1d1d s SER 46 CO 0.64 -0.04 1.04 -2.16 0.98 0.00 0.00 173.24 173.70 1d1d s PRO 47 N -3.79 3.81 0.26 4.02 0.04 -1.26 -4.98 135.00 133.11 1d1d s PRO 47 Ca 0.34 1.37 -0.02 0.00 0.04 0.00 0.00 61.00 62.72 1d1d s PRO 47 Cb -0.09 -2.11 0.01 0.00 0.04 0.00 0.00 34.50 32.35 1d1d s PRO 47 CO 0.28 -0.42 0.38 1.47 0.04 0.00 0.00 177.00 178.74 1d1d n LEU 48 N -0.93 0.00 -4.91 -3.56 -0.00 -1.26 -5.00 117.00 101.33 1d1d n LEU 48 Ca 0.09 -2.07 -0.27 0.00 -0.00 0.00 0.00 56.01 53.76 1d1d n LEU 48 Cb 0.52 1.94 0.02 0.00 -0.00 0.00 0.00 43.42 45.90 1d1d n LEU 48 CO 0.40 -0.49 0.50 -0.76 -0.00 0.00 0.00 177.39 177.04 1d1d s LEU 49 N 0.00 3.41 0.32 1.47 1.43 -1.26 -4.69 118.68 119.36 1d1d s LEU 49 Ca 0.20 0.83 0.16 0.00 -1.03 0.00 0.00 54.13 54.30 1d1d s LEU 49 Cb -0.01 -3.73 0.42 0.00 0.03 0.00 0.00 46.19 42.91 1d1d s LEU 49 CO 0.15 -0.84 1.61 1.55 0.23 0.00 0.00 176.35 179.05 1d1d h PRO 50 N -0.00 0.00 0.07 1.29 0.13 -1.92 -2.47 132.00 129.10 1d1d h PRO 50 Ca -0.46 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1d1d h PRO 50 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 1d1d h PRO 50 CO 0.61 0.47 -0.03 0.45 -0.23 0.00 0.00 178.00 179.27 1d1d h HIS 51 N 0.00 -0.09 -0.18 1.56 3.86 -1.94 -2.85 115.15 115.52 1d1d h HIS 51 Ca -0.00 -0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.17 1d1d h HIS 51 Cb 1.11 0.03 -0.01 0.00 1.06 0.00 0.00 27.41 29.60 1d1d h HIS 51 CO 0.00 0.30 -0.03 -0.44 0.86 0.00 0.00 177.93 178.62 1d1d h ASP 52 N -0.49 0.25 -0.68 2.45 3.32 -1.97 -1.94 116.42 117.36 1d1d h ASP 52 Ca -0.01 -0.03 0.09 0.00 0.02 0.00 0.00 57.03 57.10 1d1d h ASP 52 Cb 0.42 -0.06 -0.07 0.00 0.22 0.00 0.00 39.33 39.84 1d1d h ASP 52 CO 0.02 0.33 0.32 0.58 -1.72 0.00 0.00 179.24 178.76 1d1d h VAL 53 N 0.27 0.83 -0.46 -1.35 2.07 -1.25 0.63 116.25 116.98 1d1d h VAL 53 Ca 0.06 -0.19 -0.08 0.00 0.82 0.00 0.00 66.70 67.31 1d1d h VAL 53 Cb 0.24 0.24 -0.02 0.00 -1.52 0.00 0.00 31.29 30.22 1d1d h VAL 53 CO 0.01 0.10 -0.04 0.71 0.02 0.00 0.00 177.57 178.37 1d1d h THR 54 N 0.54 1.25 -0.35 2.57 1.35 -1.13 0.40 112.91 117.54 1d1d h THR 54 Ca 0.34 -1.06 -0.08 0.00 -0.55 0.00 0.00 66.41 65.06 1d1d h THR 54 Cb 0.37 0.94 -0.01 0.00 -1.73 0.00 0.00 68.15 67.72 1d1d h THR 54 CO -0.28 0.37 -0.08 -1.13 -0.25 0.00 0.00 175.52 174.15 1d1d h ASN 55 N 0.72 0.68 0.30 5.36 -1.24 -0.70 0.45 115.58 121.14 1d1d h ASN 55 Ca 0.13 -0.36 -0.01 0.00 0.71 0.00 0.00 56.30 56.77 1d1d h ASN 55 Cb 0.50 -0.19 0.00 0.00 0.73 0.00 0.00 38.32 39.37 1d1d h ASN 55 CO 0.03 0.88 -0.14 0.25 -1.29 0.00 0.00 177.43 177.16 1d1d h LEU 56 N 0.46 -0.34 -1.02 0.34 5.85 0.45 -2.54 115.31 118.52 1d1d h LEU 56 Ca 0.09 -0.18 0.05 0.00 0.84 0.00 0.00 57.88 58.69 1d1d h LEU 56 Cb 0.59 0.09 -0.06 0.00 0.37 0.00 0.00 40.66 41.64 1d1d h LEU 56 CO 0.03 0.02 0.65 0.24 -0.34 0.00 0.00 178.44 179.04 1d1d h MET 57 N -0.73 1.18 -0.80 1.25 2.86 -0.22 -0.60 114.93 117.87 1d1d h MET 57 Ca -0.04 -0.07 0.08 0.00 -2.06 0.00 0.00 59.70 57.61 1d1d h MET 57 Cb 0.49 -0.27 -0.05 0.00 0.06 0.00 0.00 31.60 31.84 1d1d h MET 57 CO 0.07 0.78 0.52 -0.09 1.06 0.00 0.00 176.91 179.24 1d1d h ARG 58 N 1.21 0.76 -0.04 1.72 2.43 -0.02 1.66 114.38 122.10 1d1d h ARG 58 Ca 0.42 -0.05 -0.20 0.00 -0.81 0.00 0.00 59.98 59.34 1d1d h ARG 58 Cb 0.11 -0.17 -0.00 0.00 -0.42 0.00 0.00 29.97 29.48 1d1d h ARG 58 CO -0.15 0.50 -0.83 0.28 -1.51 0.00 0.00 179.97 178.26 1d1d h VAL 59 N 0.78 1.39 -0.13 0.20 2.07 -0.72 -3.22 116.25 116.62 1d1d h VAL 59 Ca 0.36 -2.29 -0.14 0.00 0.82 0.00 0.00 66.70 65.45 1d1d h VAL 59 Cb 0.36 2.25 0.00 0.00 -1.52 0.00 0.00 31.29 32.39 1d1d h VAL 59 CO -0.13 0.69 -0.45 0.40 0.02 0.00 0.00 177.57 178.09 1d1d h ILE 60 N 0.26 1.36 -3.40 4.57 2.04 0.30 -3.44 117.51 119.20 1d1d h ILE 60 Ca -0.05 -1.75 -0.64 0.00 1.00 0.00 0.00 64.86 63.41 1d1d h ILE 60 Cb 1.43 2.11 -0.33 0.00 -0.74 0.00 0.00 36.82 39.30 1d1d h ILE 60 CO 0.14 0.53 -0.87 -1.48 0.00 0.00 0.00 178.15 176.48 1d1d s LEU 61 N -8.66 1.99 0.00 1.44 2.34 0.55 -4.83 118.68 111.51 1d1d s LEU 61 Ca -0.13 -0.50 -0.10 0.00 0.06 0.00 0.00 54.13 53.46 1d1d s LEU 61 Cb 0.06 -1.28 0.16 0.00 -0.56 0.00 0.00 46.19 44.57 1d1d s LEU 61 CO 0.82 0.14 0.36 0.61 -1.06 0.00 0.00 176.35 177.22 1d1d n GLY 62 N 3.55 -1.97 0.22 -3.48 0.00 -1.25 -4.07 105.19 98.18 1d1d n GLY 62 Ca -0.20 -0.64 0.14 0.00 0.00 0.00 0.00 46.02 45.32 1d1d n GLY 62 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1d1d h PRO 63 N 0.00 0.00 0.31 1.61 0.13 -1.97 0.47 132.00 132.54 1d1d h PRO 63 Ca -0.16 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.95 1d1d h PRO 63 Cb 0.55 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.69 1d1d h PRO 63 CO 0.10 0.00 -0.15 0.00 -0.23 0.00 0.00 178.00 177.72 1d1d h ALA 64 N 2.09 -0.41 0.00 -0.56 0.00 -1.98 -3.17 119.26 115.23 1d1d h ALA 64 Ca 0.00 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.67 1d1d h ALA 64 Cb 0.71 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 1d1d h ALA 64 CO 0.00 -0.45 -0.30 -1.00 0.00 0.00 0.00 179.25 177.49 1d1d h PRO 65 N -0.97 0.00 -0.94 0.00 0.13 -1.88 -3.18 132.00 125.16 1d1d h PRO 65 Ca -0.04 0.00 0.10 0.00 -0.87 0.00 0.00 66.00 65.18 1d1d h PRO 65 Cb 0.50 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 31.55 1d1d h PRO 65 CO 0.07 0.30 0.58 -0.92 -0.23 0.00 0.00 178.00 177.80 1d1d h TYR 66 N 0.00 1.06 -0.54 1.56 5.03 -0.95 0.86 116.97 124.00 1d1d h TYR 66 Ca -0.00 0.03 -0.05 0.00 2.58 0.00 0.00 58.73 61.29 1d1d h TYR 66 Cb 0.98 -0.34 -0.03 0.00 1.55 0.00 0.00 36.73 38.90 1d1d h TYR 66 CO 0.00 0.46 0.15 0.00 -1.32 0.00 0.00 178.16 177.45 1d1d h ALA 67 N 1.49 1.24 -0.45 1.82 0.00 -1.52 0.49 119.26 122.34 1d1d h ALA 67 Ca 0.45 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 55.09 1d1d h ALA 67 Cb 0.36 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1d1d h ALA 67 CO -0.23 0.53 -0.03 -0.07 0.00 0.00 0.00 179.25 179.45 1d1d h LEU 68 N 0.79 0.80 -0.82 0.00 4.07 -1.05 0.32 115.31 119.41 1d1d h LEU 68 Ca 0.18 -0.32 -0.11 0.00 0.08 0.00 0.00 57.88 57.70 1d1d h LEU 68 Cb 0.27 -0.21 -0.01 0.00 1.08 0.00 0.00 40.66 41.78 1d1d h LEU 68 CO -0.00 0.93 -0.36 -0.25 -1.08 0.00 0.00 178.44 177.67 1d1d h TRP 69 N 0.64 0.52 -0.39 1.13 7.01 -0.37 -1.08 115.95 123.42 1d1d h TRP 69 Ca 0.12 -0.14 -0.08 0.00 2.11 0.00 0.00 58.89 60.90 1d1d h TRP 69 Cb 0.54 -0.12 -0.02 0.00 -2.10 0.00 0.00 29.16 27.46 1d1d h TRP 69 CO 0.04 0.75 -0.10 0.52 -2.79 0.00 0.00 178.44 176.87 1d1d h MET 70 N 0.38 0.68 -0.07 2.65 2.86 0.42 0.91 114.93 122.75 1d1d h MET 70 Ca 0.04 -0.21 -0.05 0.00 -2.06 0.00 0.00 59.70 57.42 1d1d h MET 70 Cb 0.81 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 32.41 1d1d h MET 70 CO 0.07 0.77 -0.15 0.22 1.06 0.00 0.00 176.91 178.88 1d1d h ASP 71 N 0.62 0.25 -0.27 1.22 1.82 -0.59 -2.24 116.42 117.24 1d1d h ASP 71 Ca 0.11 -0.57 -0.04 0.00 -0.39 0.00 0.00 57.03 56.14 1d1d h ASP 71 Cb 0.54 -0.07 -0.01 0.00 0.68 0.00 0.00 39.33 40.46 1d1d h ASP 71 CO 0.03 0.77 0.02 0.00 -1.61 0.00 0.00 179.24 178.45 1d1d h ALA 72 N 0.48 0.36 -0.90 -0.78 0.00 -1.07 -2.49 119.26 114.87 1d1d h ALA 72 Ca 0.00 -0.21 0.18 0.00 0.00 0.00 0.00 54.91 54.88 1d1d h ALA 72 Cb 0.73 -0.10 -0.11 0.00 0.00 0.00 0.00 17.79 18.32 1d1d h ALA 72 CO 0.03 0.08 0.46 2.35 0.00 0.00 0.00 179.25 182.17 1d1d h TRP 73 N 0.25 0.80 -0.62 0.00 7.01 0.82 0.60 115.95 124.80 1d1d h TRP 73 Ca 0.08 0.04 0.03 0.00 2.11 0.00 0.00 58.89 61.14 1d1d h TRP 73 Cb 0.39 -0.22 -0.04 0.00 -2.10 0.00 0.00 29.16 27.19 1d1d h TRP 73 CO 0.03 0.12 0.39 0.78 -2.79 0.00 0.00 178.44 176.97 1d1d h GLY 74 N 0.58 0.89 0.79 2.65 0.00 -0.97 0.14 103.07 107.16 1d1d h GLY 74 Ca 0.52 -0.29 -0.05 0.00 0.00 0.00 0.00 47.33 47.51 1d1d h GLY 74 CO -0.42 0.25 -0.07 -2.08 0.00 0.00 0.00 176.54 174.22 1d1d h VAL 75 N 0.76 1.30 -0.56 4.60 2.07 -0.13 -2.49 116.25 121.81 1d1d h VAL 75 Ca 0.25 -1.09 0.08 0.00 0.82 0.00 0.00 66.70 66.76 1d1d h VAL 75 Cb 0.01 1.62 -0.07 0.00 -1.52 0.00 0.00 31.29 31.34 1d1d h VAL 75 CO -0.10 0.33 0.20 1.56 0.02 0.00 0.00 177.57 179.58 1d1d h GLN 76 N 0.08 0.37 -0.83 1.57 1.08 0.41 0.22 115.11 118.02 1d1d h GLN 76 Ca 0.05 -0.02 0.07 0.00 -1.45 0.00 0.00 58.65 57.29 1d1d h GLN 76 Cb 0.53 -0.08 -0.06 0.00 -0.05 0.00 0.00 27.48 27.82 1d1d h GLN 76 CO 0.02 0.24 0.50 -0.07 -0.95 0.00 0.00 178.83 178.58 1d1d h LEU 77 N 0.38 0.78 -1.21 1.46 3.38 -0.63 0.85 115.31 120.32 1d1d h LEU 77 Ca 0.27 0.02 -0.08 0.00 0.09 0.00 0.00 57.88 58.19 1d1d h LEU 77 Cb 0.32 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1d1d h LEU 77 CO -0.28 0.49 -0.38 1.56 0.09 0.00 0.00 178.44 179.91 1d1d h GLN 78 N 0.91 0.02 -0.27 1.13 4.20 -0.58 -2.48 115.11 118.05 1d1d h GLN 78 Ca 0.37 -0.01 -0.11 0.00 0.06 0.00 0.00 58.65 58.96 1d1d h GLN 78 Cb 0.20 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.97 1d1d h GLN 78 CO -0.19 0.40 -0.28 1.15 -0.67 0.00 0.00 178.83 179.25 1d1d h THR 79 N 0.02 1.27 -0.22 -0.54 2.02 0.17 0.44 112.91 116.07 1d1d h THR 79 Ca -0.00 -1.34 -0.13 0.00 0.77 0.00 0.00 66.41 65.71 1d1d h THR 79 Cb 0.69 1.38 -0.01 0.00 -1.74 0.00 0.00 68.15 68.47 1d1d h THR 79 CO 0.05 0.43 -0.40 0.58 0.37 0.00 0.00 175.52 176.55 1d1d h VAL 80 N 0.46 1.30 0.00 3.16 2.07 -0.77 0.45 116.25 122.92 1d1d h VAL 80 Ca 0.06 -1.55 -0.00 0.00 0.82 0.00 0.00 66.70 66.03 1d1d h VAL 80 Cb 0.73 1.56 0.00 0.00 -1.52 0.00 0.00 31.29 32.06 1d1d h VAL 80 CO 0.06 0.49 -0.00 0.40 0.02 0.00 0.00 177.57 178.53 1d1d h ILE 81 N 0.43 1.60 -0.26 4.57 5.03 -1.09 -1.85 117.51 125.94 1d1d h ILE 81 Ca 0.04 -1.81 0.00 0.00 -0.12 0.00 0.00 64.86 62.97 1d1d h ILE 81 Cb 0.88 2.83 -0.01 0.00 -3.03 0.00 0.00 36.82 37.49 1d1d h ILE 81 CO 0.08 0.47 0.17 0.00 -0.68 0.00 0.00 178.15 178.18 1d1d h ALA 82 N 0.21 0.33 -0.74 1.87 0.00 -0.11 0.14 119.26 120.97 1d1d h ALA 82 Ca -0.00 -0.02 0.06 0.00 0.00 0.00 0.00 54.91 54.96 1d1d h ALA 82 Cb 0.77 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 18.40 1d1d h ALA 82 CO 0.00 -0.20 0.43 0.00 0.00 0.00 0.00 179.25 179.48 1d1d h ALA 83 N 1.10 1.00 -0.09 0.00 0.00 -0.18 0.35 119.26 121.44 1d1d h ALA 83 Ca 0.10 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 1d1d h ALA 83 Cb -0.04 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 1d1d h ALA 83 CO -0.03 0.12 0.05 0.00 0.00 0.00 0.00 179.25 179.40 1d1d h ALA 84 N 1.37 0.12 0.00 0.00 0.00 -0.60 0.25 119.26 120.40 1d1d h ALA 84 Ca 0.33 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 1d1d h ALA 84 Cb 0.19 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 1d1d h ALA 84 CO -0.18 -0.36 -0.07 1.15 0.00 0.00 0.00 179.25 179.79 1d1d h THR 85 N 0.08 0.98 -0.04 0.00 2.02 0.17 -2.03 112.91 114.09 1d1d h THR 85 Ca 0.03 -0.23 -0.21 0.00 0.77 0.00 0.00 66.41 66.76 1d1d h THR 85 Cb 0.05 1.13 0.02 0.00 -1.74 0.00 0.00 68.15 67.60 1d1d h THR 85 CO -0.01 0.07 -0.81 -0.09 0.37 0.00 0.00 175.52 175.05 1d1d h ARG 86 N 0.00 0.62 -4.15 6.66 2.43 0.57 -3.43 114.38 117.09 1d1d h ARG 86 Ca -0.00 -0.62 -0.55 0.00 -0.81 0.00 0.00 59.98 58.01 1d1d h ARG 86 Cb 0.12 0.16 -0.38 0.00 -0.42 0.00 0.00 29.97 29.46 1d1d h ARG 86 CO 0.01 1.22 -0.79 0.16 -1.51 0.00 0.00 179.97 179.06 1d1d s ASP 87 N -7.04 2.75 -0.60 -3.80 1.47 0.80 -5.02 116.67 105.22 1d1d s ASP 87 Ca -0.11 -0.62 -0.06 0.00 1.18 0.00 0.00 52.55 52.94 1d1d s ASP 87 Cb 0.06 -0.89 -0.14 0.00 -0.34 0.00 0.00 42.92 41.62 1d1d s ASP 87 CO 0.88 -0.18 2.66 -0.81 0.68 0.00 0.00 175.17 178.40 1d1d n PRO 88 N 4.89 2.13 -0.22 2.11 -0.04 -1.20 -3.25 135.00 139.41 1d1d n PRO 88 Ca -0.12 -1.25 0.00 0.00 -0.04 0.00 0.00 63.50 62.09 1d1d n PRO 88 Cb 0.48 -2.23 0.00 0.00 -0.04 0.00 0.00 33.50 31.71 1d1d n PRO 88 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1d1d n ARG 89 N 3.27 0.00 -2.93 0.54 5.12 -1.26 -5.08 116.66 116.32 1d1d n ARG 89 Ca 0.45 -0.67 -0.40 0.00 -1.93 0.00 0.00 57.85 55.31 1d1d n ARG 89 Cb 0.43 -0.46 -0.05 0.00 -1.16 0.00 0.00 32.46 31.22 1d1d n ARG 89 CO 0.00 0.00 0.00 -1.01 -1.93 0.00 0.00 177.63 174.69 1d1d s HIS 90 N 0.00 3.74 -0.08 -1.55 3.76 -1.20 -4.94 115.29 115.02 1d1d s HIS 90 Ca 0.00 1.53 0.25 0.00 -0.15 0.00 0.00 55.06 56.69 1d1d s HIS 90 Cb 0.00 -2.87 0.72 0.00 1.11 0.00 0.00 32.58 31.54 1d1d s HIS 90 CO 0.00 0.25 1.74 -1.00 -0.85 0.00 0.00 174.74 174.88 1d1d h PRO 91 N 5.70 0.00 0.00 8.40 0.13 -1.96 -2.84 132.00 141.43 1d1d h PRO 91 Ca -0.44 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.69 1d1d h PRO 91 Cb 1.21 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.34 1d1d h PRO 91 CO 0.71 0.16 -0.04 0.00 -0.23 0.00 0.00 178.00 178.60 1d1d h ALA 92 N 1.84 1.15 -2.63 -0.56 0.00 -1.92 -3.42 119.26 113.72 1d1d h ALA 92 Ca -0.00 -0.03 -0.56 0.00 0.00 0.00 0.00 54.91 54.32 1d1d h ALA 92 Cb 0.87 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.62 1d1d h ALA 92 CO 0.02 0.05 -0.48 0.54 0.00 0.00 0.00 179.25 179.38 1d1d s ASN 93 N -5.69 6.29 0.00 0.00 2.20 -1.07 -4.46 114.94 112.21 1d1d s ASN 93 Ca -0.03 0.17 0.00 0.00 -0.94 0.00 0.00 52.86 52.06 1d1d s ASN 93 Cb 0.12 -1.89 0.00 0.00 -2.00 0.00 0.00 41.25 37.48 1d1d s ASN 93 CO 0.51 0.07 0.00 0.61 -2.94 0.00 0.00 177.10 175.35 1d1d n GLY 94 N -0.39 1.21 2.70 0.45 0.00 -1.26 -4.78 105.19 103.11 1d1d n GLY 94 Ca -0.07 0.10 -0.07 0.00 0.00 0.00 0.00 46.02 45.98 1d1d n GLY 94 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1d1d n GLN 95 N 0.00 1.18 0.00 1.61 10.64 -1.26 -4.91 117.38 124.64 1d1d n GLN 95 Ca 0.00 -1.86 0.00 0.00 -1.83 0.00 0.00 57.00 53.31 1d1d n GLN 95 Cb 0.00 -0.16 0.00 0.00 -0.86 0.00 0.00 30.24 29.22 1d1d n GLN 95 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1d1d n GLY 96 N -0.49 0.72 0.12 2.61 0.00 -1.26 -4.68 105.19 102.21 1d1d n GLY 96 Ca -0.02 -1.90 0.15 0.00 0.00 0.00 0.00 46.02 44.26 1d1d n GLY 96 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1d1d n ARG 97 N 0.00 1.17 -0.10 1.61 0.00 -1.26 -3.92 116.66 114.17 1d1d n ARG 97 Ca 0.00 -0.25 -0.12 0.00 -0.00 0.00 0.00 57.85 57.48 1d1d n ARG 97 Cb 0.00 -1.49 -0.04 0.00 0.00 0.00 0.00 32.46 30.92 1d1d n ARG 97 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1d1d n GLY 98 N 1.05 -0.61 2.32 5.14 0.00 -1.26 -5.07 105.19 106.75 1d1d n GLY 98 Ca 0.23 -0.25 -0.00 0.00 0.00 0.00 0.00 46.02 46.00 1d1d n GLY 98 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1d1d n GLU 99 N -4.45 -0.69 -3.78 1.61 1.02 -1.25 -4.94 120.64 108.15 1d1d n GLU 99 Ca -0.20 1.03 -0.24 0.00 -0.02 0.00 0.00 57.16 57.72 1d1d n GLU 99 Cb 0.54 -3.73 -0.17 0.00 -0.02 0.00 0.00 31.44 28.05 1d1d n GLU 99 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 1d1d s ARG 100 N -2.99 0.72 0.92 3.49 3.52 -1.26 -4.23 118.95 119.12 1d1d s ARG 100 Ca 0.00 0.00 -0.12 0.00 -0.13 0.00 0.00 55.73 55.48 1d1d s ARG 100 Cb -0.00 -1.19 0.15 0.00 -1.56 0.00 0.00 34.95 32.35 1d1d s ARG 100 CO 0.39 -0.34 1.14 -0.08 -0.81 0.00 0.00 175.30 175.60 1d1d s THR 101 N 1.93 1.99 -0.08 4.11 -1.32 -1.26 -4.60 115.64 116.41 1d1d s THR 101 Ca 0.04 0.00 -0.20 0.00 -1.21 0.00 0.00 61.69 60.32 1d1d s THR 101 Cb -0.13 -2.72 0.04 0.00 -1.51 0.00 0.00 72.50 68.18 1d1d s THR 101 CO -0.06 0.00 0.48 0.21 -2.21 0.00 0.00 174.62 173.04 1d1d s ASN 102 N -3.98 -0.43 0.51 8.08 3.84 -1.26 -4.95 114.94 116.74 1d1d s ASN 102 Ca 0.64 0.57 0.21 0.00 0.21 0.00 0.00 52.86 54.49 1d1d s ASN 102 Cb -0.15 0.61 1.29 0.00 -0.55 0.00 0.00 41.25 42.45 1d1d s ASN 102 CO 0.54 -0.40 2.02 0.25 -2.79 0.00 0.00 177.10 176.71 1d1d h LEU 103 N 4.12 0.09 -0.31 3.21 5.85 -1.98 0.83 115.31 127.11 1d1d h LEU 103 Ca -0.28 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.39 1d1d h LEU 103 Cb 1.17 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 42.17 1d1d h LEU 103 CO 0.33 0.05 -0.00 -0.78 -0.34 0.00 0.00 178.44 177.70 1d1d h ASP 104 N 0.10 0.54 -0.29 1.25 3.58 -1.98 0.20 116.42 119.82 1d1d h ASP 104 Ca 0.21 -0.31 0.01 0.00 0.42 0.00 0.00 57.03 57.36 1d1d h ASP 104 Cb 0.72 -0.15 -0.02 0.00 1.72 0.00 0.00 39.33 41.61 1d1d h ASP 104 CO -0.02 0.72 0.17 0.03 -2.88 0.00 0.00 179.24 177.26 1d1d h ARG 105 N 0.35 0.35 0.00 0.28 2.47 -1.28 0.02 114.38 116.56 1d1d h ARG 105 Ca 0.09 -0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.79 1d1d h ARG 105 Cb 0.44 -0.08 0.00 0.00 -1.65 0.00 0.00 29.97 28.68 1d1d h ARG 105 CO 0.02 0.23 0.00 -0.07 0.56 0.00 0.00 179.97 180.71 1d1d h LEU 106 N 0.36 0.00 0.40 3.04 3.38 -1.16 -3.11 115.31 118.21 1d1d h LEU 106 Ca 0.11 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 1d1d h LEU 106 Cb -0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.74 1d1d h LEU 106 CO -0.05 0.00 -0.19 0.50 0.09 0.00 0.00 178.44 178.79 1d1d h LYS 107 N 0.00 -0.52 0.00 1.13 1.63 0.13 -3.47 116.57 115.48 1d1d h LYS 107 Ca 0.00 0.04 0.00 0.00 -0.85 0.00 0.00 60.65 59.84 1d1d h LYS 107 Cb 0.46 0.12 0.00 0.00 -0.60 0.00 0.00 32.23 32.21 1d1d h LYS 107 CO 0.00 -0.21 0.00 0.41 -3.45 0.00 0.00 179.45 176.20 1d1d n GLY 108 N -0.07 1.76 0.89 5.01 0.00 -0.81 -4.95 105.19 107.02 1d1d n GLY 108 Ca -0.09 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.02 1d1d n GLY 108 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1d1d n LEU 109 N 0.00 3.04 -4.39 0.99 -0.00 -1.24 -3.97 117.00 111.43 1d1d n LEU 109 Ca 0.00 -1.53 -0.29 0.00 -0.00 0.00 0.00 56.01 54.19 1d1d n LEU 109 Cb 0.00 -0.20 0.25 0.00 -0.00 0.00 0.00 43.42 43.47 1d1d n LEU 109 CO 0.00 0.67 0.28 0.00 -0.00 0.00 0.00 177.39 178.34 1d1d n ALA 110 N 1.09 -3.49 -2.29 1.96 0.00 -1.26 -4.77 120.51 111.75 1d1d n ALA 110 Ca 0.15 -1.33 -0.42 0.00 0.00 0.00 0.00 53.44 51.83 1d1d n ALA 110 Cb 0.50 -1.84 -0.03 0.00 0.00 0.00 0.00 19.45 18.08 1d1d n ALA 110 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1d1d s ASP 111 N -2.34 6.89 0.00 0.00 1.11 -1.26 -1.97 116.67 119.11 1d1d s ASP 111 Ca 0.66 2.00 0.00 0.00 0.18 0.00 0.00 52.55 55.39 1d1d s ASP 111 Cb -0.22 -2.56 0.00 0.00 1.07 0.00 0.00 42.92 41.22 1d1d s ASP 111 CO 0.65 -0.71 0.00 0.61 1.18 0.00 0.00 175.17 176.90 1d1d n GLY 112 N 3.61 0.60 0.03 0.21 0.00 -1.26 -4.88 105.19 103.50 1d1d n GLY 112 Ca 0.13 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.19 1d1d n GLY 112 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1d1d n MET 113 N -2.79 0.74 -3.72 1.61 2.81 -0.83 -4.17 117.12 110.76 1d1d n MET 113 Ca 0.00 -0.12 -0.36 0.00 -1.81 0.00 0.00 57.70 55.40 1d1d n MET 113 Cb 0.00 -1.43 -0.07 0.00 -0.71 0.00 0.00 33.22 31.01 1d1d n MET 113 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 1d1d s VAL 114 N -3.04 5.39 0.00 2.03 -7.23 -1.24 -4.06 120.40 112.25 1d1d s VAL 114 Ca -0.07 0.33 0.00 0.00 -1.81 0.00 0.00 61.98 60.43 1d1d s VAL 114 Cb 0.10 -3.50 0.00 0.00 0.56 0.00 0.00 36.38 33.54 1d1d s VAL 114 CO 0.74 0.51 0.00 0.61 -0.31 0.00 0.00 175.10 176.65 1d1d n GLY 115 N 2.78 0.72 2.99 2.32 0.00 -1.26 -5.00 105.19 107.75 1d1d n GLY 115 Ca -0.16 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.81 1d1d n GLY 115 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1d1d s ASN 116 N -2.68 -0.29 0.12 1.61 -0.87 -1.26 -5.02 114.94 106.55 1d1d s ASN 116 Ca 0.00 -0.25 -0.08 0.00 -1.57 0.00 0.00 52.86 50.96 1d1d s ASN 116 Cb 0.00 1.41 -0.11 0.00 -0.02 0.00 0.00 41.25 42.53 1d1d s ASN 116 CO 0.00 -0.33 1.30 1.55 -2.57 0.00 0.00 177.10 177.05 1d1d h PRO 117 N 8.04 0.56 0.02 -0.60 0.13 -1.95 0.75 132.00 138.96 1d1d h PRO 117 Ca -0.05 -0.55 -0.21 0.00 -0.87 0.00 0.00 66.00 64.32 1d1d h PRO 117 Cb 1.14 0.14 -0.01 0.00 0.13 0.00 0.00 31.00 32.40 1d1d h PRO 117 CO 0.22 1.17 -0.95 0.37 -0.23 0.00 0.00 178.00 178.58 1d1d h GLN 118 N 0.34 0.14 0.02 0.86 4.15 -1.96 -2.65 115.11 116.02 1d1d h GLN 118 Ca -0.08 -0.19 -0.20 0.00 0.77 0.00 0.00 58.65 58.95 1d1d h GLN 118 Cb 1.53 0.06 0.02 0.00 0.21 0.00 0.00 27.48 29.30 1d1d h GLN 118 CO 0.17 0.99 -0.81 0.78 -1.93 0.00 0.00 178.83 178.02 1d1d h GLY 119 N 2.11 0.57 0.99 2.39 0.00 -1.91 -2.57 103.07 104.64 1d1d h GLY 119 Ca -0.05 -1.04 -0.01 0.00 0.00 0.00 0.00 47.33 46.23 1d1d h GLY 119 CO 0.14 0.92 0.29 0.06 0.00 0.00 0.00 176.54 177.96 1d1d h GLN 120 N 0.06 0.70 -0.68 4.80 3.07 -0.91 0.52 115.11 122.67 1d1d h GLN 120 Ca -0.11 -0.07 -0.01 0.00 0.09 0.00 0.00 58.65 58.55 1d1d h GLN 120 Cb 1.51 -0.14 -0.03 0.00 0.08 0.00 0.00 27.48 28.90 1d1d h GLN 120 CO 0.16 0.53 0.37 0.00 0.09 0.00 0.00 178.83 179.98 1d1d h ALA 121 N 1.13 0.86 0.00 0.06 0.00 -1.54 0.72 119.26 120.49 1d1d h ALA 121 Ca 0.18 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1d1d h ALA 121 Cb 0.02 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.54 1d1d h ALA 121 CO -0.03 0.38 0.00 0.00 0.00 0.00 0.00 179.25 179.59 1d1d h ALA 122 N 1.19 1.00 0.02 0.00 0.00 -0.99 -2.56 119.26 117.91 1d1d h ALA 122 Ca 0.24 0.00 -0.22 0.00 0.00 0.00 0.00 54.91 54.93 1d1d h ALA 122 Cb 0.03 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1d1d h ALA 122 CO -0.04 0.00 -1.02 1.25 0.00 0.00 0.00 179.25 179.44 1d1d h LEU 123 N 0.00 0.09 -8.38 0.00 6.46 0.18 -3.41 115.31 110.25 1d1d h LEU 123 Ca 0.00 -0.09 -0.63 0.00 -0.12 0.00 0.00 57.88 57.04 1d1d h LEU 123 Cb 0.61 -0.03 -0.14 0.00 -0.73 0.00 0.00 40.66 40.37 1d1d h LEU 123 CO 0.00 1.05 0.46 -0.76 -0.62 0.00 0.00 178.44 178.56 1d1d s LEU 124 N -6.86 4.38 0.92 2.25 1.43 0.06 -5.01 118.68 115.85 1d1d s LEU 124 Ca -0.00 -0.70 -0.16 0.00 -1.03 0.00 0.00 54.13 52.23 1d1d s LEU 124 Cb 0.10 -2.61 -0.14 0.00 0.03 0.00 0.00 46.19 43.57 1d1d s LEU 124 CO 0.83 -1.24 -0.72 -2.11 0.23 0.00 0.00 176.35 173.34 1d1d n ARG 125 N 7.29 0.00 -2.34 1.70 0.00 -1.26 -4.75 116.66 117.31 1d1d n ARG 125 Ca -0.02 0.00 -0.43 0.00 -0.00 0.00 0.00 57.85 57.41 1d1d n ARG 125 Cb 0.46 -0.96 -0.02 0.00 -0.00 0.00 0.00 32.46 31.94 1d1d n ARG 125 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.63 176.38 1d1d s PRO 126 N -1.83 3.47 0.00 2.89 0.04 -1.26 -3.49 135.00 134.81 1d1d s PRO 126 Ca 0.40 0.82 0.00 0.00 0.04 0.00 0.00 61.00 62.26 1d1d s PRO 126 Cb -0.20 -4.07 0.00 0.00 0.04 0.00 0.00 34.50 30.27 1d1d s PRO 126 CO 0.78 -1.71 0.00 0.41 0.04 0.00 0.00 177.00 176.52 1d1d n GLY 127 N 5.16 2.66 0.30 0.56 0.00 -1.26 -4.97 105.19 107.65 1d1d n GLY 127 Ca 0.16 -0.31 -0.09 0.00 0.00 0.00 0.00 46.02 45.79 1d1d n GLY 127 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1d1d h GLU 128 N 0.00 1.04 -0.78 1.61 3.07 -1.82 -2.53 114.58 115.17 1d1d h GLU 128 Ca 0.00 -0.33 0.02 0.00 -0.50 0.00 0.00 59.36 58.55 1d1d h GLU 128 Cb 0.00 -0.09 -0.04 0.00 -0.84 0.00 0.00 28.75 27.77 1d1d h GLU 128 CO 0.00 1.02 0.50 -0.07 -1.40 0.00 0.00 179.01 179.07 1d1d h LEU 129 N 0.94 0.85 -1.02 1.33 3.38 -1.84 -1.05 115.31 117.90 1d1d h LEU 129 Ca 0.17 -0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.15 1d1d h LEU 129 Cb 0.57 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 41.07 1d1d h LEU 129 CO 0.03 0.59 0.66 0.58 0.09 0.00 0.00 178.44 180.39 1d1d h VAL 130 N 1.00 1.21 -0.92 1.22 2.07 -1.78 0.08 116.25 119.12 1d1d h VAL 130 Ca 0.30 -0.45 0.07 0.00 0.82 0.00 0.00 66.70 67.45 1d1d h VAL 130 Cb -0.03 -0.21 -0.07 0.00 -1.52 0.00 0.00 31.29 29.46 1d1d h VAL 130 CO -0.09 0.24 0.58 0.00 0.02 0.00 0.00 177.57 178.31 1d1d h ALA 131 N 1.40 1.29 -0.39 1.67 0.00 -0.79 0.53 119.26 122.98 1d1d h ALA 131 Ca 0.38 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 55.15 1d1d h ALA 131 Cb -0.07 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 1d1d h ALA 131 CO -0.10 0.31 -0.32 0.82 0.00 0.00 0.00 179.25 179.96 1d1d h ILE 132 N 1.03 1.28 -0.10 0.00 2.04 -0.67 0.13 117.51 121.22 1d1d h ILE 132 Ca 0.41 -1.48 -0.01 0.00 1.00 0.00 0.00 64.86 64.78 1d1d h ILE 132 Cb 0.22 1.32 -0.00 0.00 -0.74 0.00 0.00 36.82 37.62 1d1d h ILE 132 CO -0.19 0.50 0.03 0.74 0.00 0.00 0.00 178.15 179.23 1d1d h THR 133 N 0.72 1.17 -0.46 -0.27 2.02 0.64 0.47 112.91 117.20 1d1d h THR 133 Ca 0.08 -0.52 -0.04 0.00 0.77 0.00 0.00 66.41 66.70 1d1d h THR 133 Cb 0.88 1.33 -0.02 0.00 -1.74 0.00 0.00 68.15 68.60 1d1d h THR 133 CO 0.08 0.15 0.13 0.00 0.37 0.00 0.00 175.52 176.25 1d1d h ALA 134 N 0.85 0.60 -0.32 6.16 0.00 0.05 -0.22 119.26 126.38 1d1d h ALA 134 Ca 0.03 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.71 1d1d h ALA 134 Cb 0.21 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1d1d h ALA 134 CO -0.00 0.28 0.00 0.66 0.00 0.00 0.00 179.25 180.19 1d1d h SER 135 N 0.61 0.45 -0.44 0.00 4.64 -0.57 0.17 113.55 118.41 1d1d h SER 135 Ca 0.15 -0.08 -0.14 0.00 -0.47 0.00 0.00 61.79 61.25 1d1d h SER 135 Cb 0.30 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.26 1d1d h SER 135 CO -0.00 0.52 -0.27 0.00 -0.87 0.00 0.00 176.83 176.21 1d1d h ALA 136 N 1.54 0.66 -0.15 5.18 0.00 0.49 0.19 119.26 127.17 1d1d h ALA 136 Ca 0.10 -0.41 -0.13 0.00 0.00 0.00 0.00 54.91 54.47 1d1d h ALA 136 Cb 0.30 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1d1d h ALA 136 CO 0.01 0.68 -0.47 -0.07 0.00 0.00 0.00 179.25 179.39 1d1d h LEU 137 N 0.82 0.41 -0.27 0.00 4.07 -0.36 -0.88 115.31 119.10 1d1d h LEU 137 Ca 0.09 -0.19 -0.20 0.00 0.08 0.00 0.00 57.88 57.67 1d1d h LEU 137 Cb 0.86 -0.11 0.00 0.00 1.08 0.00 0.00 40.66 42.48 1d1d h LEU 137 CO 0.08 0.82 -0.61 1.56 -1.08 0.00 0.00 178.44 179.21 1d1d h GLN 138 N 0.30 0.85 -0.16 1.13 4.20 -0.41 -2.17 115.11 118.85 1d1d h GLN 138 Ca 0.02 -0.58 -0.10 0.00 0.06 0.00 0.00 58.65 58.05 1d1d h GLN 138 Cb 0.94 0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.79 1d1d h GLN 138 CO 0.08 1.21 -0.33 0.00 -0.67 0.00 0.00 178.83 179.12 1d1d h ALA 139 N 0.66 1.16 0.55 3.87 0.00 -0.48 -2.22 119.26 122.80 1d1d h ALA 139 Ca -0.00 -0.36 -0.03 0.00 0.00 0.00 0.00 54.91 54.52 1d1d h ALA 139 Cb 1.22 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.92 1d1d h ALA 139 CO 0.13 0.55 -0.26 0.35 0.00 0.00 0.00 179.25 180.02 1d1d h PHE 140 N 0.27 -0.68 -0.16 0.00 3.57 -1.02 -2.57 116.94 116.36 1d1d h PHE 140 Ca 0.03 -0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.56 1d1d h PHE 140 Cb 0.71 0.22 -0.01 0.00 2.79 0.00 0.00 35.95 39.67 1d1d h PHE 140 CO 0.02 -0.35 0.20 0.07 -2.23 0.00 0.00 178.31 176.02 1d1d h ARG 141 N -1.01 0.00 -0.40 1.11 0.11 -1.37 0.59 114.38 113.41 1d1d h ARG 141 Ca -0.07 0.00 -0.11 0.00 0.10 0.00 0.00 59.98 59.90 1d1d h ARG 141 Cb 0.63 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.70 1d1d h ARG 141 CO 0.12 0.00 -0.17 1.49 0.10 0.00 0.00 179.97 181.51 1d1d h GLU 142 N 0.00 0.82 -0.42 0.08 4.57 -1.11 0.25 114.58 118.77 1d1d h GLU 142 Ca 0.07 -0.35 -0.14 0.00 -1.18 0.00 0.00 59.36 57.77 1d1d h GLU 142 Cb 0.48 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 29.03 1d1d h GLU 142 CO -0.00 0.98 -0.28 0.28 -1.18 0.00 0.00 179.01 178.81 1d1d h VAL 143 N 0.63 1.27 -0.03 0.32 2.07 -0.52 -0.11 116.25 119.88 1d1d h VAL 143 Ca 0.09 -1.44 -0.00 0.00 0.82 0.00 0.00 66.70 66.17 1d1d h VAL 143 Cb 0.72 1.28 -0.00 0.00 -1.52 0.00 0.00 31.29 31.77 1d1d h VAL 143 CO 0.05 0.49 0.01 0.00 0.02 0.00 0.00 177.57 178.14 1d1d h ALA 144 N 0.81 0.04 -0.70 1.67 0.00 -1.20 -2.75 119.26 117.13 1d1d h ALA 144 Ca 0.08 -0.12 0.02 0.00 0.00 0.00 0.00 54.91 54.89 1d1d h ALA 144 Cb 0.86 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.60 1d1d h ALA 144 CO 0.08 -0.34 0.46 -0.09 0.00 0.00 0.00 179.25 179.35 1d1d h ARG 145 N -0.17 0.87 -5.31 0.00 1.12 -0.44 -3.41 114.38 107.04 1d1d h ARG 145 Ca 0.01 -0.05 -0.49 0.00 -1.11 0.00 0.00 59.98 58.34 1d1d h ARG 145 Cb 0.23 -0.20 -0.04 0.00 -0.01 0.00 0.00 29.97 29.95 1d1d h ARG 145 CO 0.00 0.58 1.69 -0.11 -3.11 0.00 0.00 179.97 179.02 1d1d n LEU 146 N -4.44 1.25 -3.67 3.80 7.94 -0.06 -4.78 117.00 117.04 1d1d n LEU 146 Ca 0.08 -0.11 -0.04 0.00 -1.11 0.00 0.00 56.01 54.82 1d1d n LEU 146 Cb 0.08 -1.23 -0.01 0.00 0.53 0.00 0.00 43.42 42.78 1d1d n LEU 146 CO 0.35 -1.10 0.75 0.00 -1.11 0.00 0.00 177.39 176.29 1d1d s ALA 147 N 10.36 -1.77 -0.34 1.96 0.00 -1.26 -4.98 121.76 125.73 1d1d s ALA 147 Ca 1.18 0.46 0.01 0.00 0.00 0.00 0.00 51.96 53.61 1d1d s ALA 147 Cb -0.77 0.53 0.09 0.00 0.00 0.00 0.00 23.12 22.97 1d1d s ALA 147 CO 0.39 -0.94 0.06 -2.00 0.00 0.00 0.00 175.76 173.27 1d1d s GLU 148 N -3.13 1.86 -1.17 0.00 -6.30 -1.26 -5.01 118.70 103.69 1d1d s GLU 148 Ca 0.10 -1.70 -0.12 0.00 -2.50 0.00 0.00 54.97 50.76 1d1d s GLU 148 Cb -0.01 -3.26 -0.07 0.00 0.00 0.00 0.00 34.13 30.80 1d1d s GLU 148 CO -0.02 -0.87 2.32 -0.35 0.02 0.00 0.00 175.26 176.36 1d1d n PRO 149 N 4.42 2.54 -2.94 4.30 -0.04 -1.26 -4.88 135.00 137.14 1d1d n PRO 149 Ca -0.03 -1.94 -0.43 0.00 -0.04 0.00 0.00 63.50 61.07 1d1d n PRO 149 Cb 0.42 -2.79 -0.05 0.00 -0.04 0.00 0.00 33.50 31.04 1d1d n PRO 149 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1d1d s ALA 150 N 3.36 3.36 0.00 0.55 0.00 -1.26 -4.66 121.76 123.11 1d1d s ALA 150 Ca 0.53 -0.80 0.00 0.00 0.00 0.00 0.00 51.96 51.69 1d1d s ALA 150 Cb 0.14 -3.43 0.00 0.00 0.00 0.00 0.00 23.12 19.82 1d1d s ALA 150 CO -0.02 -1.71 0.00 0.41 0.00 0.00 0.00 175.76 174.44 1d1d n GLY 151 N 4.75 0.34 0.20 0.00 0.00 -1.26 -5.01 105.19 104.20 1d1d n GLY 151 Ca 0.03 -0.18 -0.18 0.00 0.00 0.00 0.00 46.02 45.69 1d1d n GLY 151 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1d1d h PRO 152 N 0.00 0.70 -0.54 1.61 0.13 -1.90 -2.99 132.00 129.00 1d1d h PRO 152 Ca 0.00 -0.69 0.16 0.00 -0.87 0.00 0.00 66.00 64.60 1d1d h PRO 152 Cb 0.00 0.18 -0.02 0.00 0.13 0.00 0.00 31.00 31.29 1d1d h PRO 152 CO 0.00 1.28 0.54 0.11 -0.23 0.00 0.00 178.00 179.70 1d1d h TRP 153 N 0.43 0.00 -0.32 1.56 0.09 -1.89 1.40 115.95 117.23 1d1d h TRP 153 Ca -0.10 0.00 -0.04 0.00 0.09 0.00 0.00 58.89 58.85 1d1d h TRP 153 Cb 1.59 0.00 -0.02 0.00 0.08 0.00 0.00 29.16 30.81 1d1d h TRP 153 CO 0.09 0.00 0.04 0.00 0.09 0.00 0.00 178.44 178.66 1d1d h ALA 154 N 1.43 1.49 0.00 0.11 0.00 -1.93 -1.42 119.26 118.94 1d1d h ALA 154 Ca 0.26 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 1d1d h ALA 154 Cb 1.33 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 1d1d h ALA 154 CO -0.00 0.37 -0.89 -0.44 0.00 0.00 0.00 179.25 178.29 1d1d h ASP 155 N 0.46 0.00 -3.31 0.00 3.32 0.17 -3.44 116.42 113.61 1d1d h ASP 155 Ca 0.11 0.00 -0.59 0.00 0.02 0.00 0.00 57.03 56.56 1d1d h ASP 155 Cb 0.24 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 39.70 1d1d h ASP 155 CO 0.00 0.21 0.41 -0.63 -1.72 0.00 0.00 179.24 177.51 1d1d s ILE 156 N -3.18 4.87 0.04 0.35 1.01 -0.21 -5.04 121.20 119.04 1d1d s ILE 156 Ca 0.01 1.52 0.05 0.00 0.00 0.00 0.00 60.65 62.22 1d1d s ILE 156 Cb 0.08 -4.09 -0.02 0.00 0.01 0.00 0.00 42.46 38.44 1d1d s ILE 156 CO 0.77 -0.03 -0.15 0.42 0.00 0.00 0.00 174.94 175.94 1d1d s THR 157 N 2.63 1.23 -0.58 2.92 -4.23 -1.26 -4.82 115.64 111.52 1d1d s THR 157 Ca 0.34 -1.03 -0.28 0.00 -1.18 0.00 0.00 61.69 59.55 1d1d s THR 157 Cb -0.16 -1.10 0.02 0.00 1.34 0.00 0.00 72.50 72.60 1d1d s THR 157 CO 0.08 0.06 1.38 -1.58 -0.54 0.00 0.00 174.62 174.02 1d1d s GLN 158 N -1.12 3.30 0.32 3.99 2.00 -1.25 -4.99 119.66 121.90 1d1d s GLN 158 Ca 0.03 0.37 0.07 0.00 -2.00 0.00 0.00 55.36 53.83 1d1d s GLN 158 Cb -0.08 -4.12 -0.03 0.00 0.80 0.00 0.00 33.01 29.58 1d1d s GLN 158 CO 0.01 -1.95 0.26 0.20 -0.50 0.00 0.00 175.29 173.32 1d1d s GLY 159 N 4.27 1.70 0.39 2.59 0.00 -1.26 -4.34 107.32 110.66 1d1d s GLY 159 Ca 0.50 -1.60 0.27 0.00 0.00 0.00 0.00 44.72 43.88 1d1d s GLY 159 CO 0.24 -1.56 1.78 -0.56 0.00 0.00 0.00 173.10 173.00 1d1d h PRO 160 N 1.32 0.00 0.00 2.90 0.13 -1.98 -2.81 132.00 131.57 1d1d h PRO 160 Ca -0.46 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.61 1d1d h PRO 160 Cb 1.25 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.37 1d1d h PRO 160 CO 0.59 0.00 -0.33 1.03 -0.23 0.00 0.00 178.00 179.06 1d1d h SER 161 N 0.00 0.00 -4.03 1.44 0.87 -1.99 -3.43 113.55 106.41 1d1d h SER 161 Ca 0.00 0.00 -0.68 0.00 -1.23 0.00 0.00 61.79 59.88 1d1d h SER 161 Cb 0.67 0.00 -0.31 0.00 -0.44 0.00 0.00 62.40 62.32 1d1d h SER 161 CO 0.00 0.33 -0.88 -0.70 -0.53 0.00 0.00 176.83 175.05 1d1d s GLU 162 N -3.41 2.49 0.83 2.24 2.56 -1.06 -5.12 118.70 117.24 1d1d s GLU 162 Ca 0.02 -0.89 -0.13 0.00 0.00 0.00 0.00 54.97 53.96 1d1d s GLU 162 Cb 0.09 -2.12 0.06 0.00 2.00 0.00 0.00 34.13 34.16 1d1d s GLU 162 CO 0.68 0.38 0.99 0.43 -0.56 0.00 0.00 175.26 177.18 1d1d n SER 163 N 2.94 0.20 0.09 -1.70 7.64 -1.26 -4.39 113.62 117.14 1d1d n SER 163 Ca -0.17 0.54 -0.13 0.00 1.01 0.00 0.00 58.87 60.11 1d1d n SER 163 Cb 0.52 -1.42 -0.08 0.00 -1.01 0.00 0.00 64.21 62.22 1d1d n SER 163 CO 0.00 0.00 0.00 0.15 -3.01 0.00 0.00 175.04 172.18 1d1d h PHE 164 N -1.01 -0.20 -0.37 1.43 3.57 -1.97 0.16 116.94 118.54 1d1d h PHE 164 Ca -0.45 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.02 1d1d h PHE 164 Cb 1.30 0.07 -0.02 0.00 2.79 0.00 0.00 35.95 40.09 1d1d h PHE 164 CO 0.44 0.07 0.16 -0.24 -2.23 0.00 0.00 178.31 176.51 1d1d h VAL 165 N -0.47 1.18 -0.36 1.41 3.04 -1.97 0.43 116.25 119.51 1d1d h VAL 165 Ca -0.02 -0.54 0.05 0.00 -1.01 0.00 0.00 66.70 65.17 1d1d h VAL 165 Cb 0.37 0.84 -0.04 0.00 -2.01 0.00 0.00 31.29 30.44 1d1d h VAL 165 CO 0.04 0.20 0.10 0.44 -1.01 0.00 0.00 177.57 177.34 1d1d h ASP 166 N 0.46 0.08 0.02 3.17 5.19 -1.91 0.77 116.42 124.20 1d1d h ASP 166 Ca 0.13 0.05 -0.09 0.00 -0.62 0.00 0.00 57.03 56.49 1d1d h ASP 166 Cb 0.16 0.05 -0.01 0.00 0.18 0.00 0.00 39.33 39.70 1d1d h ASP 166 CO -0.01 0.08 -0.26 0.15 -3.12 0.00 0.00 179.24 176.08 1d1d h PHE 167 N 0.24 0.44 -0.24 4.55 3.57 -0.34 -2.32 116.94 122.84 1d1d h PHE 167 Ca 0.17 -0.09 -0.06 0.00 3.53 0.00 0.00 57.97 61.52 1d1d h PHE 167 Cb 0.17 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.78 1d1d h PHE 167 CO -0.16 0.63 -0.10 0.00 -2.23 0.00 0.00 178.31 176.44 1d1d h ALA 168 N 1.38 1.39 -0.02 2.41 0.00 0.11 0.11 119.26 124.63 1d1d h ALA 168 Ca 0.05 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.73 1d1d h ALA 168 Cb 0.65 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 1d1d h ALA 168 CO 0.05 0.42 -0.00 -0.91 0.00 0.00 0.00 179.25 178.81 1d1d h ASN 169 N 0.36 0.03 -0.67 0.00 2.35 -0.37 0.48 115.58 117.77 1d1d h ASN 169 Ca 0.07 -0.36 -0.02 0.00 -0.55 0.00 0.00 56.30 55.44 1d1d h ASN 169 Cb 0.41 -0.01 -0.03 0.00 0.05 0.00 0.00 38.32 38.74 1d1d h ASN 169 CO 0.02 0.39 0.34 0.03 -1.65 0.00 0.00 177.43 176.56 1d1d h ARG 170 N -0.32 0.97 -0.03 0.81 -0.00 -1.15 0.35 114.38 115.02 1d1d h ARG 170 Ca 0.00 -0.12 -0.01 0.00 -0.50 0.00 0.00 59.98 59.35 1d1d h ARG 170 Cb 0.37 -0.18 -0.00 0.00 0.00 0.00 0.00 29.97 30.16 1d1d h ARG 170 CO 0.00 0.74 -0.02 1.25 0.00 0.00 0.00 179.97 181.94 1d1d h LEU 171 N 0.97 0.06 -0.50 3.04 6.46 -0.66 -0.69 115.31 124.00 1d1d h LEU 171 Ca 0.24 -0.47 0.04 0.00 -0.12 0.00 0.00 57.88 57.56 1d1d h LEU 171 Cb 0.08 -0.02 -0.04 0.00 -0.73 0.00 0.00 40.66 39.96 1d1d h LEU 171 CO -0.03 0.52 0.27 0.40 -0.62 0.00 0.00 178.44 178.98 1d1d h ILE 172 N -0.39 0.99 -0.54 4.05 2.04 0.28 0.44 117.51 124.38 1d1d h ILE 172 Ca 0.00 -0.18 -0.01 0.00 1.00 0.00 0.00 64.86 65.68 1d1d h ILE 172 Cb 0.50 0.42 -0.03 0.00 -0.74 0.00 0.00 36.82 36.97 1d1d h ILE 172 CO 0.01 0.10 0.31 0.50 0.00 0.00 0.00 178.15 179.07 1d1d h LYS 173 N 0.53 0.73 0.11 2.37 3.64 -0.26 0.44 116.57 124.12 1d1d h LYS 173 Ca 0.21 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.53 1d1d h LYS 173 Cb 0.09 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 31.76 1d1d h LYS 173 CO -0.13 0.52 -0.05 0.00 -2.27 0.00 0.00 179.45 177.51 1d1d h ALA 174 N 1.61 -0.15 -0.43 5.00 0.00 0.51 -2.26 119.26 123.54 1d1d h ALA 174 Ca 0.19 -0.21 0.04 0.00 0.00 0.00 0.00 54.91 54.93 1d1d h ALA 174 Cb -0.01 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.80 1d1d h ALA 174 CO -0.04 -0.36 0.19 0.28 0.00 0.00 0.00 179.25 179.32 1d1d h VAL 175 N -0.59 0.93 -0.96 0.00 2.07 0.23 0.31 116.25 118.23 1d1d h VAL 175 Ca -0.02 -0.13 0.16 0.00 0.82 0.00 0.00 66.70 67.54 1d1d h VAL 175 Cb 0.47 0.51 -0.10 0.00 -1.52 0.00 0.00 31.29 30.65 1d1d h VAL 175 CO 0.03 0.07 0.57 -0.33 0.02 0.00 0.00 177.57 177.92 1d1d h GLU 176 N 0.39 0.75 -0.90 1.57 5.08 -0.12 0.32 114.58 121.68 1d1d h GLU 176 Ca 0.19 -0.05 -0.40 0.00 -1.00 0.00 0.00 59.36 58.11 1d1d h GLU 176 Cb 0.13 -0.17 -0.24 0.00 0.50 0.00 0.00 28.75 28.97 1d1d h GLU 176 CO -0.16 0.50 0.50 0.41 -1.00 0.00 0.00 179.01 179.26 1d1d n GLY 177 N -1.33 4.18 3.74 -3.84 0.00 -0.44 -4.94 105.19 102.55 1d1d n GLY 177 Ca 0.21 -1.06 -0.23 0.00 0.00 0.00 0.00 46.02 44.94 1d1d n GLY 177 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1d1d s SER 178 N -1.21 4.66 -1.07 1.61 1.04 0.11 -4.99 113.70 113.86 1d1d s SER 178 Ca 0.56 -0.82 -0.15 0.00 0.48 0.00 0.00 55.95 56.02 1d1d s SER 178 Cb 0.47 -0.68 0.17 0.00 0.10 0.00 0.00 66.02 66.08 1d1d s SER 178 CO 0.12 -0.35 1.23 -0.62 0.98 0.00 0.00 173.24 174.60 1d1d s ASP 179 N -3.87 6.92 0.15 7.02 -1.08 -1.26 -4.97 116.67 119.57 1d1d s ASP 179 Ca 0.39 -2.70 0.06 0.00 -0.52 0.00 0.00 52.55 49.77 1d1d s ASP 179 Cb -0.02 -2.36 -0.04 0.00 -1.46 0.00 0.00 42.92 39.04 1d1d s ASP 179 CO 0.23 -0.79 -0.13 -0.76 0.52 0.00 0.00 175.17 174.24 1d1d s LEU 180 N 1.52 2.46 0.74 -1.34 1.43 -1.26 -4.92 118.68 117.31 1d1d s LEU 180 Ca 0.36 -0.90 -0.11 0.00 -1.03 0.00 0.00 54.13 52.45 1d1d s LEU 180 Cb -0.05 -0.54 0.03 0.00 0.03 0.00 0.00 46.19 45.67 1d1d s LEU 180 CO -0.05 -0.19 1.08 -2.16 0.23 0.00 0.00 176.35 175.26 1d1d s PRO 181 N -3.11 2.58 -1.23 1.29 0.04 -1.26 -4.92 135.00 128.39 1d1d s PRO 181 Ca 0.14 0.82 -0.20 0.00 0.04 0.00 0.00 61.00 61.80 1d1d s PRO 181 Cb -0.02 -1.96 -0.02 0.00 0.04 0.00 0.00 34.50 32.54 1d1d s PRO 181 CO 0.03 -1.32 1.87 -0.35 0.04 0.00 0.00 177.00 177.27 1d1d n PRO 182 N -3.26 2.38 0.00 0.56 -0.04 -1.26 -2.35 135.00 131.04 1d1d n PRO 182 Ca 0.07 -2.79 0.00 0.00 -0.04 0.00 0.00 63.50 60.74 1d1d n PRO 182 Cb 0.55 -3.55 0.00 0.00 -0.04 0.00 0.00 33.50 30.46 1d1d n PRO 182 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1d1d n SER 183 N 10.76 0.00 0.03 3.54 7.64 -1.26 -4.94 113.62 129.40 1d1d n SER 183 Ca 0.47 0.00 0.13 0.00 1.01 0.00 0.00 58.87 60.49 1d1d n SER 183 Cb 0.45 0.00 0.51 0.00 -1.01 0.00 0.00 64.21 64.16 1d1d n SER 183 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1d1d n ALA 184 N 0.00 2.43 -1.96 -0.43 0.00 -0.99 -4.31 120.51 115.26 1d1d n ALA 184 Ca 0.00 -0.10 -0.42 0.00 0.00 0.00 0.00 53.44 52.92 1d1d n ALA 184 Cb 0.00 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.02 1d1d n ALA 184 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1d1d n ARG 185 N -1.75 3.15 0.00 0.00 1.74 -1.24 -2.52 116.66 116.04 1d1d n ARG 185 Ca 0.06 -2.95 0.00 0.00 -0.77 0.00 0.00 57.85 54.19 1d1d n ARG 185 Cb 0.37 -3.15 0.00 0.00 -1.02 0.00 0.00 32.46 28.66 1d1d n ARG 185 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1d1d n ALA 186 N 5.22 0.00 0.13 7.54 0.00 -1.26 -4.91 120.51 127.23 1d1d n ALA 186 Ca 0.47 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.91 1d1d n ALA 186 Cb 0.38 0.00 0.13 0.00 0.00 0.00 0.00 19.45 19.96 1d1d n ALA 186 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1d1d h PRO 187 N 0.00 0.00 -0.47 0.00 0.13 -1.71 -2.68 132.00 127.26 1d1d h PRO 187 Ca 0.00 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 65.01 1d1d h PRO 187 Cb 0.00 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.11 1d1d h PRO 187 CO 0.00 0.63 -0.17 0.28 -0.23 0.00 0.00 178.00 178.51 1d1d h VAL 188 N 0.00 1.27 -0.10 1.56 2.07 -1.83 1.31 116.25 120.53 1d1d h VAL 188 Ca -0.01 -1.30 -0.02 0.00 0.82 0.00 0.00 66.70 66.19 1d1d h VAL 188 Cb 1.23 1.08 -0.00 0.00 -1.52 0.00 0.00 31.29 32.08 1d1d h VAL 188 CO 0.08 0.45 -0.01 0.40 0.02 0.00 0.00 177.57 178.51 1d1d h ILE 189 N 0.81 1.27 -0.26 4.57 2.04 -1.76 0.17 117.51 124.34 1d1d h ILE 189 Ca 0.12 -0.86 -0.13 0.00 1.00 0.00 0.00 64.86 64.99 1d1d h ILE 189 Cb 0.71 1.65 -0.01 0.00 -0.74 0.00 0.00 36.82 38.43 1d1d h ILE 189 CO 0.05 0.24 -0.38 0.40 0.00 0.00 0.00 178.15 178.47 1d1d h ILE 190 N -0.12 1.29 -0.56 -0.67 2.04 -1.36 -2.60 117.51 115.53 1d1d h ILE 190 Ca 0.03 -1.54 -0.06 0.00 1.00 0.00 0.00 64.86 64.29 1d1d h ILE 190 Cb 0.38 1.51 -0.03 0.00 -0.74 0.00 0.00 36.82 37.95 1d1d h ILE 190 CO 0.01 0.49 0.12 -0.78 0.00 0.00 0.00 178.15 177.98 1d1d h ASP 191 N 0.50 0.83 -0.37 1.72 1.82 0.19 -2.32 116.42 118.79 1d1d h ASP 191 Ca 0.05 -0.16 0.00 0.00 -0.39 0.00 0.00 57.03 56.53 1d1d h ASP 191 Cb 0.88 -0.22 -0.02 0.00 0.68 0.00 0.00 39.33 40.66 1d1d h ASP 191 CO 0.08 0.82 0.23 0.00 -1.61 0.00 0.00 179.24 178.76 1d1d h PHE 193 N 0.49 0.94 -0.67 0.00 0.04 -1.06 0.41 116.94 117.08 1d1d h PHE 193 Ca 0.13 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.93 1d1d h PHE 193 Cb -0.02 -0.30 0.00 0.00 2.20 0.00 0.00 35.95 37.83 1d1d h PHE 193 CO -0.04 0.34 0.00 2.89 -0.60 0.00 0.00 178.31 180.89 1d1d n ARG 194 N -4.60 2.58 -0.03 1.51 1.85 -0.69 -3.41 116.66 113.86 1d1d n ARG 194 Ca 0.19 -2.45 -0.21 0.00 -1.00 0.00 0.00 57.85 54.38 1d1d n ARG 194 Cb 0.45 -1.53 -0.13 0.00 -1.05 0.00 0.00 32.46 30.20 1d1d n ARG 194 CO 0.00 0.00 0.00 0.37 -0.01 0.00 0.00 177.63 177.99 1d1d h GLN 195 N 4.01 0.17 -0.08 2.89 4.15 0.47 -3.45 115.11 123.27 1d1d h GLN 195 Ca 0.00 -0.29 -0.18 0.00 0.77 0.00 0.00 58.65 58.95 1d1d h GLN 195 Cb 0.92 0.11 -0.14 0.00 0.21 0.00 0.00 27.48 28.57 1d1d h GLN 195 CO 0.00 1.14 -0.39 1.17 -1.93 0.00 0.00 178.83 178.82 1d1d n LYS 196 N -4.01 0.61 -4.20 1.69 0.00 -1.03 -5.06 118.16 106.15 1d1d n LYS 196 Ca -0.28 -1.52 -0.12 0.00 0.00 0.00 0.00 58.31 56.40 1d1d n LYS 196 Cb 0.85 -1.17 -0.10 0.00 0.00 0.00 0.00 35.03 34.60 1d1d n LYS 196 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.40 176.28 1d1d s SER 197 N -1.13 0.53 0.66 3.14 0.01 -1.22 -3.92 113.70 111.77 1d1d s SER 197 Ca 0.30 -1.28 -0.16 0.00 1.31 0.00 0.00 55.95 56.12 1d1d s SER 197 Cb 0.20 0.27 -0.14 0.00 0.21 0.00 0.00 66.02 66.57 1d1d s SER 197 CO -0.20 -0.74 -0.39 0.00 0.41 0.00 0.00 173.24 172.33 1d1d n GLN 198 N -0.22 0.00 0.04 12.44 3.00 -1.26 -4.57 117.38 126.82 1d1d n GLN 198 Ca -0.03 0.00 -0.15 0.00 -0.01 0.00 0.00 57.00 56.81 1d1d n GLN 198 Cb 0.65 -0.92 -0.05 0.00 0.00 0.00 0.00 30.24 29.92 1d1d n GLN 198 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.06 176.06 1d1d h PRO 199 N -0.41 0.54 -0.38 -1.09 0.13 -1.97 0.22 132.00 129.04 1d1d h PRO 199 Ca -0.39 -0.52 -0.05 0.00 -0.87 0.00 0.00 66.00 64.17 1d1d h PRO 199 Cb 1.27 0.14 -0.01 0.00 0.13 0.00 0.00 31.00 32.52 1d1d h PRO 199 CO 0.31 1.15 0.05 0.22 -0.23 0.00 0.00 178.00 179.50 1d1d h ASP 200 N 0.33 0.61 0.03 1.44 1.82 -1.97 1.58 116.42 120.25 1d1d h ASP 200 Ca -0.08 -0.27 -0.20 0.00 -0.39 0.00 0.00 57.03 56.10 1d1d h ASP 200 Cb 1.52 -0.16 0.00 0.00 0.68 0.00 0.00 39.33 41.37 1d1d h ASP 200 CO 0.16 0.72 -0.71 0.40 -1.61 0.00 0.00 179.24 178.21 1d1d h ILE 201 N 0.47 1.32 -0.22 2.25 1.08 -1.90 -2.05 117.51 118.46 1d1d h ILE 201 Ca 0.11 -1.99 -0.11 0.00 -0.39 0.00 0.00 64.86 62.49 1d1d h ILE 201 Cb 0.38 1.97 -0.00 0.00 -3.07 0.00 0.00 36.82 36.10 1d1d h ILE 201 CO 0.01 0.62 -0.28 -0.61 -0.69 0.00 0.00 178.15 177.20 1d1d h GLN 202 N 0.43 0.57 -0.18 2.37 4.15 -0.34 -2.25 115.11 119.86 1d1d h GLN 202 Ca -0.03 -0.32 -0.02 0.00 0.77 0.00 0.00 58.65 59.05 1d1d h GLN 202 Cb 1.30 0.02 -0.01 0.00 0.21 0.00 0.00 27.48 29.00 1d1d h GLN 202 CO 0.13 0.92 0.01 0.37 -1.93 0.00 0.00 178.83 178.34 1d1d h GLN 203 N 0.26 0.25 -0.05 1.69 5.75 0.23 0.31 115.11 123.55 1d1d h GLN 203 Ca 0.03 -0.03 -0.01 0.00 -0.15 0.00 0.00 58.65 58.48 1d1d h GLN 203 Cb 0.85 -0.05 -0.00 0.00 1.07 0.00 0.00 27.48 29.35 1d1d h GLN 203 CO 0.07 0.27 -0.02 1.25 -2.65 0.00 0.00 178.83 177.74 1d1d h LEU 204 N 0.25 0.11 -0.76 -2.39 6.46 -1.21 -0.11 115.31 117.66 1d1d h LEU 204 Ca 0.06 -0.41 -0.06 0.00 -0.12 0.00 0.00 57.88 57.35 1d1d h LEU 204 Cb 0.16 -0.03 -0.03 0.00 -0.73 0.00 0.00 40.66 40.03 1d1d h LEU 204 CO 0.00 0.49 0.21 0.40 -0.62 0.00 0.00 178.44 178.92 1d1d h ILE 205 N -0.28 1.26 -0.31 4.05 5.03 -0.90 -0.06 117.51 126.31 1d1d h ILE 205 Ca 0.01 -0.93 -0.04 0.00 -0.12 0.00 0.00 64.86 63.78 1d1d h ILE 205 Cb 0.45 0.46 -0.02 0.00 -3.03 0.00 0.00 36.82 34.68 1d1d h ILE 205 CO 0.01 0.36 0.03 0.03 -0.68 0.00 0.00 178.15 177.90 1d1d h ARG 206 N 1.10 0.46 -0.09 2.37 3.08 -0.30 0.41 114.38 121.42 1d1d h ARG 206 Ca 0.24 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 60.20 1d1d h ARG 206 Cb 0.33 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.30 1d1d h ARG 206 CO -0.00 0.47 0.00 0.00 -1.07 0.00 0.00 179.97 179.36 1d1d n ALA 207 N -2.48 2.55 -1.26 0.04 0.00 -0.06 -4.92 120.51 114.38 1d1d n ALA 207 Ca 0.01 -0.47 -0.34 0.00 0.00 0.00 0.00 53.44 52.65 1d1d n ALA 207 Cb 0.21 -1.14 0.11 0.00 0.00 0.00 0.00 19.45 18.63 1d1d n ALA 207 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1d1d s ALA 208 N -1.89 2.01 0.58 0.00 0.00 0.13 -4.98 121.76 117.62 1d1d s ALA 208 Ca 0.35 0.84 -0.16 0.00 0.00 0.00 0.00 51.96 52.99 1d1d s ALA 208 Cb 0.19 -3.47 -0.04 0.00 0.00 0.00 0.00 23.12 19.80 1d1d s ALA 208 CO 0.29 -2.03 1.05 -1.25 0.00 0.00 0.00 175.76 173.82 1d1d s PRO 209 N -4.04 3.40 -0.04 0.00 0.04 -1.26 -4.94 135.00 128.17 1d1d s PRO 209 Ca 0.73 1.17 0.08 0.00 0.04 0.00 0.00 61.00 63.02 1d1d s PRO 209 Cb -0.28 -2.05 0.29 0.00 0.04 0.00 0.00 34.50 32.50 1d1d s PRO 209 CO 0.48 -0.74 1.13 0.43 0.04 0.00 0.00 177.00 178.33 1d1d n SER 210 N -1.97 2.13 0.00 6.66 7.64 -1.26 -3.38 113.62 123.45 1d1d n SER 210 Ca 0.08 -2.16 0.11 0.00 1.01 0.00 0.00 58.87 57.92 1d1d n SER 210 Cb 0.53 -0.36 -0.02 0.00 -1.01 0.00 0.00 64.21 63.35 1d1d n SER 210 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1d1d n THR 211 N 0.32 0.03 -3.87 0.44 -1.04 -1.26 -4.91 114.28 103.99 1d1d n THR 211 Ca 0.10 -0.08 -0.12 0.00 -2.04 0.00 0.00 64.05 61.91 1d1d n THR 211 Cb 0.41 0.62 -0.13 0.00 -1.82 0.00 0.00 70.33 69.41 1d1d n THR 211 CO 0.00 0.00 0.00 -1.48 -0.64 0.00 0.00 175.07 172.95 1d1d s LEU 212 N -3.29 1.77 -0.36 -4.42 0.05 -1.22 -5.05 118.68 106.17 1d1d s LEU 212 Ca 0.07 0.03 0.12 0.00 0.05 0.00 0.00 54.13 54.39 1d1d s LEU 212 Cb 0.16 0.28 0.40 0.00 -2.05 0.00 0.00 46.19 44.98 1d1d s LEU 212 CO 0.83 -0.10 1.49 0.35 -0.55 0.00 0.00 176.35 178.37 1d1d n THR 213 N 2.69 0.01 -4.37 5.48 -2.24 -1.26 -4.72 114.28 109.87 1d1d n THR 213 Ca -0.15 -1.17 -0.25 0.00 -2.27 0.00 0.00 64.05 60.22 1d1d n THR 213 Cb 0.58 1.00 -0.09 0.00 -2.10 0.00 0.00 70.33 69.72 1d1d n THR 213 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1d1d s THR 214 N 0.13 2.93 -0.66 4.28 -4.23 -1.26 -4.11 115.64 112.72 1d1d s THR 214 Ca 0.13 -2.03 -0.06 0.00 -1.18 0.00 0.00 61.69 58.55 1d1d s THR 214 Cb 0.43 -2.51 -0.13 0.00 1.34 0.00 0.00 72.50 71.63 1d1d s THR 214 CO -0.12 -0.29 2.64 -0.81 -0.54 0.00 0.00 174.62 175.51 1d1d n PRO 215 N -0.43 2.18 0.13 3.99 -0.04 -1.26 -2.75 135.00 136.82 1d1d n PRO 215 Ca -0.08 -1.30 0.00 0.00 -0.04 0.00 0.00 63.50 62.08 1d1d n PRO 215 Cb 0.58 -2.26 0.00 0.00 -0.04 0.00 0.00 33.50 31.78 1d1d n PRO 215 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1d1d n GLY 216 N 3.20 -1.27 0.16 0.55 0.00 -1.26 -4.91 105.19 101.65 1d1d n GLY 216 Ca 0.47 0.22 -0.09 0.00 0.00 0.00 0.00 46.02 46.62 1d1d n GLY 216 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1d1d h GLU 217 N 0.00 0.31 -0.66 1.61 3.07 -1.97 -0.10 114.58 116.85 1d1d h GLU 217 Ca 0.00 -0.28 -0.02 0.00 -0.50 0.00 0.00 59.36 58.56 1d1d h GLU 217 Cb 0.00 0.07 -0.03 0.00 -0.84 0.00 0.00 28.75 27.95 1d1d h GLU 217 CO 0.00 0.94 0.33 0.82 -1.40 0.00 0.00 179.01 179.71 1d1d h ILE 218 N 0.20 1.22 -0.04 3.13 5.03 -1.87 0.50 117.51 125.68 1d1d h ILE 218 Ca -0.04 -0.59 -0.06 0.00 -0.12 0.00 0.00 64.86 64.05 1d1d h ILE 218 Cb 1.36 0.39 0.00 0.00 -3.03 0.00 0.00 36.82 35.55 1d1d h ILE 218 CO 0.13 0.25 -0.21 0.40 -0.68 0.00 0.00 178.15 178.03 1d1d h ILE 219 N 0.91 1.47 -0.99 -0.67 2.04 -1.79 -1.54 117.51 116.94 1d1d h ILE 219 Ca 0.23 -1.69 0.10 0.00 1.00 0.00 0.00 64.86 64.50 1d1d h ILE 219 Cb 0.09 2.45 -0.08 0.00 -0.74 0.00 0.00 36.82 38.54 1d1d h ILE 219 CO -0.03 0.47 0.63 0.50 0.00 0.00 0.00 178.15 179.72 1d1d h LYS 220 N -0.35 1.01 -0.21 2.37 3.64 -0.81 0.39 116.57 122.61 1d1d h LYS 220 Ca -0.01 -0.06 -0.05 0.00 -1.27 0.00 0.00 60.65 59.26 1d1d h LYS 220 Cb 0.87 -0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 32.46 1d1d h LYS 220 CO 0.04 0.67 -0.05 -0.92 -2.27 0.00 0.00 179.45 176.93 1d1d h TYR 221 N 1.04 0.45 -0.24 1.91 3.20 0.03 0.39 116.97 123.77 1d1d h TYR 221 Ca 0.46 -0.10 -0.00 0.00 3.14 0.00 0.00 58.73 62.24 1d1d h TYR 221 Cb 0.36 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.51 1d1d h TYR 221 CO -0.00 0.65 0.15 0.28 -1.64 0.00 0.00 178.16 177.59 1d1d h VAL 222 N 0.13 1.08 -0.44 1.81 2.07 -0.26 0.30 116.25 120.93 1d1d h VAL 222 Ca 0.05 -0.18 -0.07 0.00 0.82 0.00 0.00 66.70 67.31 1d1d h VAL 222 Cb 0.50 0.78 -0.02 0.00 -1.52 0.00 0.00 31.29 31.03 1d1d h VAL 222 CO 0.02 0.08 -0.03 -0.07 0.02 0.00 0.00 177.57 177.58 1d1d h LEU 223 N 0.30 0.71 -0.94 2.57 3.38 -0.22 0.49 115.31 121.60 1d1d h LEU 223 Ca 0.09 -0.18 -0.06 0.00 0.09 0.00 0.00 57.88 57.82 1d1d h LEU 223 Cb 0.00 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 1d1d h LEU 223 CO -0.02 0.80 0.09 0.44 0.09 0.00 0.00 178.44 179.84 1d1d h ASP 224 N 0.69 0.82 0.75 -0.43 3.32 0.50 -1.95 116.42 120.12 1d1d h ASP 224 Ca 0.13 -0.17 -0.22 0.00 0.02 0.00 0.00 57.03 56.79 1d1d h ASP 224 Cb 0.47 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.79 1d1d h ASP 224 CO 0.02 0.83 -1.01 -0.09 -1.72 0.00 0.00 179.24 177.27 1d1d h ARG 225 N 0.82 0.14 -0.03 3.56 2.43 0.21 -2.30 114.38 119.20 1d1d h ARG 225 Ca 0.17 -0.19 0.01 0.00 -0.81 0.00 0.00 59.98 59.16 1d1d h ARG 225 Cb 0.37 0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.97 1d1d h ARG 225 CO 0.01 1.03 -0.03 1.96 -1.51 0.00 0.00 179.97 181.42 1d1d h GLN 226 N 0.05 -0.04 -2.24 0.20 4.20 0.43 -3.31 115.11 114.40 1d1d h GLN 226 Ca -0.05 0.00 -0.59 0.00 0.06 0.00 0.00 58.65 58.07 1d1d h GLN 226 Cb 1.72 0.01 -0.41 0.00 0.30 0.00 0.00 27.48 29.10 1d1d h GLN 226 CO 0.15 -0.03 -0.80 1.17 -0.67 0.00 0.00 178.83 178.65 1d1d n LYS 227 N -5.15 1.61 -1.60 1.46 0.00 -0.78 -5.09 118.16 108.62 1d1d n LYS 227 Ca -0.06 -4.02 -0.41 0.00 0.00 0.00 0.00 58.31 53.83 1d1d n LYS 227 Cb 0.08 -1.85 0.01 0.00 0.00 0.00 0.00 35.03 33.28 1d1d n LYS 227 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.40 178.91 1d1d n ILE 228 N 1.35 2.47 -2.91 3.15 0.13 -0.86 -4.83 119.36 117.85 1d1d n ILE 228 Ca 0.26 -0.50 0.00 0.00 -1.10 0.00 0.00 62.75 61.41 1d1d n ILE 228 Cb 0.45 -1.12 0.00 0.00 -0.84 0.00 0.00 39.64 38.13 1d1d n ILE 228 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 1d1d s ALA 229 N -1.30 -3.46 -2.00 1.51 0.00 -1.26 -5.08 121.76 110.17 1d1d s ALA 229 Ca 0.64 0.63 0.24 0.00 0.00 0.00 0.00 51.96 53.47 1d1d s ALA 229 Cb -0.55 -2.88 1.43 0.00 0.00 0.00 0.00 23.12 21.12 1d1d s ALA 229 CO 0.56 -2.37 1.80 -0.35 0.00 0.00 0.00 175.76 175.40