#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 4.69 0.42 -0.99 -4.23 -1.26 -5.07 115.64 109.21 1d1d s THR 12 Ca 0.00 -1.20 -0.23 0.00 -1.18 0.00 0.00 61.69 59.08 1d1d s THR 12 Cb 0.00 -3.81 -0.09 0.00 1.34 0.00 0.00 72.50 69.94 1d1d s THR 12 CO 0.00 -0.51 1.05 -2.16 -0.54 0.00 0.00 174.62 172.46 1d1d s PRO 13 N 1.53 4.06 0.83 3.99 0.04 -1.26 -5.01 135.00 139.17 1d1d s PRO 13 Ca 0.03 1.48 -0.13 0.00 0.04 0.00 0.00 61.00 62.42 1d1d s PRO 13 Cb -0.23 -2.42 0.09 0.00 0.04 0.00 0.00 34.50 31.99 1d1d s PRO 13 CO 0.04 -0.23 1.19 -0.48 0.04 0.00 0.00 177.00 177.57 1d1d s LEU 14 N -2.88 3.08 -0.37 -3.56 2.34 -1.26 -4.92 118.68 111.11 1d1d s LEU 14 Ca 0.61 2.33 -0.28 0.00 0.06 0.00 0.00 54.13 56.85 1d1d s LEU 14 Cb -0.21 -4.58 0.02 0.00 -0.56 0.00 0.00 46.19 40.86 1d1d s LEU 14 CO 0.26 -2.75 1.05 -0.70 -1.06 0.00 0.00 176.35 173.15 1d1d s GLU 15 N -4.24 3.91 0.38 1.48 2.56 -1.26 -4.89 118.70 116.65 1d1d s GLU 15 Ca 0.72 0.80 0.21 0.00 0.00 0.00 0.00 54.97 56.70 1d1d s GLU 15 Cb -0.27 -3.80 0.57 0.00 2.00 0.00 0.00 34.13 32.63 1d1d s GLU 15 CO 0.52 -1.04 1.68 -1.00 -0.56 0.00 0.00 175.26 174.85 1d1d h PRO 16 N 8.49 0.00 -0.22 4.30 0.13 -1.98 -3.15 132.00 139.57 1d1d h PRO 16 Ca -0.22 0.00 0.05 0.00 -0.87 0.00 0.00 66.00 64.96 1d1d h PRO 16 Cb 1.07 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.15 1d1d h PRO 16 CO 1.04 0.31 -0.09 -0.22 -0.23 0.00 0.00 178.00 178.82 1d1d h LYS 17 N 0.00 -0.05 -0.36 0.86 3.64 -1.99 1.37 116.57 120.05 1d1d h LYS 17 Ca -0.00 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.36 1d1d h LYS 17 Cb 0.99 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.81 1d1d h LYS 17 CO 0.04 -0.03 0.13 -0.07 -2.27 0.00 0.00 179.45 177.25 1d1d h LEU 18 N -0.05 0.51 -1.27 5.20 3.38 -1.98 -2.24 115.31 118.85 1d1d h LEU 18 Ca 0.11 -0.19 0.01 0.00 0.09 0.00 0.00 57.88 57.91 1d1d h LEU 18 Cb 0.22 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.80 1d1d h LEU 18 CO -0.26 0.56 0.49 0.40 0.09 0.00 0.00 178.44 179.73 1d1d h ILE 19 N 0.43 1.18 -0.86 1.22 2.04 -1.30 -1.00 117.51 119.23 1d1d h ILE 19 Ca 0.12 -0.34 0.05 0.00 1.00 0.00 0.00 64.86 65.69 1d1d h ILE 19 Cb 0.22 0.10 -0.05 0.00 -0.74 0.00 0.00 36.82 36.34 1d1d h ILE 19 CO -0.01 0.18 0.56 0.74 0.00 0.00 0.00 178.15 179.62 1d1d h THR 20 N 0.99 1.08 -0.10 -0.27 2.02 0.24 0.71 112.91 117.59 1d1d h THR 20 Ca 0.28 -0.34 -0.01 0.00 0.77 0.00 0.00 66.41 67.11 1d1d h THR 20 Cb -0.09 0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 66.32 1d1d h THR 20 CO -0.06 0.18 0.03 0.03 0.37 0.00 0.00 175.52 176.07 1d1d h ARG 21 N 0.99 0.15 -0.43 6.66 3.08 -0.80 0.42 114.38 124.46 1d1d h ARG 21 Ca 0.36 -0.03 -0.10 0.00 0.07 0.00 0.00 59.98 60.28 1d1d h ARG 21 Cb 0.15 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.16 1d1d h ARG 21 CO -0.12 0.30 -0.14 1.25 -1.07 0.00 0.00 179.97 180.18 1d1d h LEU 22 N -0.02 0.80 -1.03 3.04 6.46 -1.03 -2.32 115.31 121.20 1d1d h LEU 22 Ca 0.03 -0.25 -0.08 0.00 -0.12 0.00 0.00 57.88 57.45 1d1d h LEU 22 Cb 0.21 -0.22 -0.01 0.00 -0.73 0.00 0.00 40.66 39.91 1d1d h LEU 22 CO -0.00 0.95 -0.20 0.00 -0.62 0.00 0.00 178.44 178.56 1d1d h ALA 23 N 1.12 1.19 -0.74 1.25 0.00 0.65 -2.23 119.26 120.50 1d1d h ALA 23 Ca 0.11 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 1d1d h ALA 23 Cb 0.64 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 1d1d h ALA 23 CO 0.04 0.52 0.37 -0.44 0.00 0.00 0.00 179.25 179.75 1d1d h ASP 24 N 0.41 0.94 -0.36 0.00 5.19 0.38 -1.71 116.42 121.27 1d1d h ASP 24 Ca 0.07 -0.09 -0.09 0.00 -0.62 0.00 0.00 57.03 56.30 1d1d h ASP 24 Cb 0.59 -0.24 -0.02 0.00 0.18 0.00 0.00 39.33 39.84 1d1d h ASP 24 CO 0.04 0.78 -0.07 0.74 -3.12 0.00 0.00 179.24 177.61 1d1d h THR 25 N 1.04 1.25 -0.07 0.35 2.02 -1.04 -0.94 112.91 115.53 1d1d h THR 25 Ca 0.26 -1.10 0.00 0.00 0.77 0.00 0.00 66.41 66.33 1d1d h THR 25 Cb 0.08 0.98 -0.00 0.00 -1.74 0.00 0.00 68.15 67.47 1d1d h THR 25 CO -0.04 0.38 0.04 0.58 0.37 0.00 0.00 175.52 176.86 1d1d h VAL 26 N 0.71 1.04 -0.11 3.16 2.07 -0.91 1.01 116.25 123.21 1d1d h VAL 26 Ca 0.13 -0.09 -0.00 0.00 0.82 0.00 0.00 66.70 67.56 1d1d h VAL 26 Cb 0.54 0.98 -0.01 0.00 -1.52 0.00 0.00 31.29 31.28 1d1d h VAL 26 CO 0.03 0.03 0.07 -0.09 0.02 0.00 0.00 177.57 177.63 1d1d h ARG 27 N 0.07 0.15 -0.01 1.57 1.12 -1.17 0.60 114.38 116.71 1d1d h ARG 27 Ca 0.02 -0.01 -0.05 0.00 -1.11 0.00 0.00 59.98 58.83 1d1d h ARG 27 Cb 0.02 -0.03 -0.01 0.00 -0.01 0.00 0.00 29.97 29.94 1d1d h ARG 27 CO -0.00 0.14 -0.25 1.79 -3.11 0.00 0.00 179.97 178.53 1d1d h THR 28 N 0.13 1.19 0.00 0.20 1.35 -0.94 -0.69 112.91 114.15 1d1d h THR 28 Ca 0.04 -0.88 0.00 0.00 -0.55 0.00 0.00 66.41 65.02 1d1d h THR 28 Cb 0.02 1.46 0.00 0.00 -1.73 0.00 0.00 68.15 67.90 1d1d h THR 28 CO -0.01 0.25 -0.23 0.29 -0.25 0.00 0.00 175.52 175.58 1d1d n LYS 29 N -4.24 0.23 0.00 4.72 4.76 0.35 -5.00 118.16 118.98 1d1d n LYS 29 Ca -0.02 0.14 0.00 0.00 -2.87 0.00 0.00 58.31 55.56 1d1d n LYS 29 Cb 0.31 -1.72 0.00 0.00 -1.84 0.00 0.00 35.03 31.77 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 1.35 1.90 0.22 0.72 0.00 0.20 -4.52 105.19 105.06 1d1d n GLY 30 Ca 0.05 -1.25 0.08 0.00 0.00 0.00 0.00 46.02 44.90 1d1d n GLY 30 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1d1d h LEU 31 N 0.00 0.00 -1.41 0.99 7.12 -1.72 -0.86 115.31 119.43 1d1d h LEU 31 Ca 0.00 0.00 0.00 0.00 0.13 0.00 0.00 57.88 58.01 1d1d h LEU 31 Cb 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.13 1d1d h LEU 31 CO 0.00 0.24 0.00 0.54 -0.13 0.00 0.00 178.44 179.09 1d1d n ARG 32 N -3.77 1.95 -2.65 1.25 1.74 -1.26 -4.87 116.66 109.05 1d1d n ARG 32 Ca -0.01 -1.40 -0.29 0.00 -0.77 0.00 0.00 57.85 55.37 1d1d n ARG 32 Cb 0.34 -1.45 -0.01 0.00 -1.02 0.00 0.00 32.46 30.31 1d1d n ARG 32 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 1d1d s SER 33 N -1.78 6.39 0.32 0.55 0.01 -0.33 -4.97 113.70 113.89 1d1d s SER 33 Ca 0.34 1.09 0.26 0.00 1.31 0.00 0.00 55.95 58.95 1d1d s SER 33 Cb 0.20 -2.31 0.89 0.00 0.21 0.00 0.00 66.02 65.01 1d1d s SER 33 CO 0.30 -0.53 1.76 1.55 0.41 0.00 0.00 173.24 176.74 1d1d h PRO 34 N 0.66 0.00 0.00 12.44 0.13 -1.89 -2.88 132.00 140.46 1d1d h PRO 34 Ca -0.47 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.65 1d1d h PRO 34 Cb 1.19 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.32 1d1d h PRO 34 CO 0.63 0.00 -0.07 0.82 -0.23 0.00 0.00 178.00 179.14 1d1d h ILE 35 N 0.00 0.46 -0.01 -3.56 1.08 -1.88 -2.35 117.51 111.24 1d1d h ILE 35 Ca 0.00 -0.35 -0.00 0.00 -0.39 0.00 0.00 64.86 64.12 1d1d h ILE 35 Cb 0.62 1.24 -0.00 0.00 -3.07 0.00 0.00 36.82 35.61 1d1d h ILE 35 CO 0.00 0.07 0.01 0.74 -0.69 0.00 0.00 178.15 178.28 1d1d h THR 36 N 0.00 1.08 -0.36 -0.27 2.02 -1.72 0.36 112.91 114.03 1d1d h THR 36 Ca -0.00 -0.24 -0.06 0.00 0.77 0.00 0.00 66.41 66.88 1d1d h THR 36 Cb 0.23 1.22 -0.02 0.00 -1.74 0.00 0.00 68.15 67.85 1d1d h THR 36 CO 0.01 0.06 -0.05 0.24 0.37 0.00 0.00 175.52 176.15 1d1d h MET 37 N -0.08 0.58 0.16 6.66 2.86 -1.63 0.32 114.93 123.79 1d1d h MET 37 Ca 0.00 -0.15 -0.01 0.00 -2.06 0.00 0.00 59.70 57.49 1d1d h MET 37 Cb 0.10 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 31.69 1d1d h MET 37 CO -0.00 0.64 -0.08 0.00 1.06 0.00 0.00 176.91 178.53 1d1d h ALA 38 N 1.41 -0.21 -0.21 6.32 0.00 -1.15 0.40 119.26 125.82 1d1d h ALA 38 Ca 0.11 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 1d1d h ALA 38 Cb 0.42 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1d1d h ALA 38 CO 0.02 -0.42 0.13 0.93 0.00 0.00 0.00 179.25 179.90 1d1d h GLU 39 N -0.61 0.28 -0.07 0.00 3.07 -0.14 0.22 114.58 117.34 1d1d h GLU 39 Ca -0.02 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.81 1d1d h GLU 39 Cb 0.46 -0.06 -0.00 0.00 -0.84 0.00 0.00 28.75 28.31 1d1d h GLU 39 CO 0.04 0.22 0.04 0.28 -1.40 0.00 0.00 179.01 178.19 1d1d h VAL 40 N 0.25 1.04 -0.05 3.13 2.07 -0.39 -0.91 116.25 121.39 1d1d h VAL 40 Ca 0.07 -0.09 0.02 0.00 0.82 0.00 0.00 66.70 67.52 1d1d h VAL 40 Cb 0.02 0.98 -0.00 0.00 -1.52 0.00 0.00 31.29 30.77 1d1d h VAL 40 CO -0.01 0.03 0.08 -0.33 0.02 0.00 0.00 177.57 177.36 1d1d h GLU 41 N 0.06 0.00 0.35 1.57 5.08 0.07 0.70 114.58 122.42 1d1d h GLU 41 Ca 0.02 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.37 1d1d h GLU 41 Cb 0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.27 1d1d h GLU 41 CO -0.00 0.00 -0.17 0.00 -1.00 0.00 0.00 179.01 177.84 1d1d h ALA 42 N 1.90 -0.47 -0.19 3.43 0.00 0.48 1.74 119.26 126.14 1d1d h ALA 42 Ca 0.03 -0.18 -0.20 0.00 0.00 0.00 0.00 54.91 54.56 1d1d h ALA 42 Cb 0.18 0.18 0.01 0.00 0.00 0.00 0.00 17.79 18.16 1d1d h ALA 42 CO -0.00 -0.63 -0.65 1.37 0.00 0.00 0.00 179.25 179.34 1d1d h LEU 43 N -0.74 0.89 0.00 0.00 8.10 -1.03 -2.86 115.31 119.67 1d1d h LEU 43 Ca -0.05 -0.60 0.00 0.00 0.11 0.00 0.00 57.88 57.34 1d1d h LEU 43 Cb 0.51 -0.26 0.00 0.00 -0.44 0.00 0.00 40.66 40.46 1d1d h LEU 43 CO 0.08 1.34 0.00 0.23 -4.11 0.00 0.00 178.44 175.98 1d1d n MET 44 N -4.02 0.02 -0.37 0.17 2.81 0.24 -3.81 117.12 112.16 1d1d n MET 44 Ca -0.07 0.10 0.31 0.00 -1.81 0.00 0.00 57.70 56.22 1d1d n MET 44 Cb 0.68 -1.50 0.51 0.00 -0.71 0.00 0.00 33.22 32.20 1d1d n MET 44 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 1d1d n SER 45 N -1.49 0.14 -4.93 7.83 7.64 0.59 -4.14 113.62 119.26 1d1d n SER 45 Ca 0.06 1.00 -0.25 0.00 1.01 0.00 0.00 58.87 60.69 1d1d n SER 45 Cb 0.27 -0.49 -0.03 0.00 -1.01 0.00 0.00 64.21 62.95 1d1d n SER 45 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1d1d s SER 46 N -4.31 6.21 0.47 6.43 0.01 -1.25 -5.06 113.70 116.20 1d1d s SER 46 Ca -0.05 0.10 -0.21 0.00 1.31 0.00 0.00 55.95 57.10 1d1d s SER 46 Cb 0.23 -1.83 -0.09 0.00 0.21 0.00 0.00 66.02 64.54 1d1d s SER 46 CO 0.61 0.02 1.04 -2.16 0.41 0.00 0.00 173.24 173.16 1d1d s PRO 47 N -3.41 3.85 0.18 12.44 0.04 -1.26 -5.00 135.00 141.83 1d1d s PRO 47 Ca 0.34 1.38 0.01 0.00 0.04 0.00 0.00 61.00 62.77 1d1d s PRO 47 Cb -0.10 -2.15 -0.00 0.00 0.04 0.00 0.00 34.50 32.28 1d1d s PRO 47 CO 0.28 -0.40 0.21 1.47 0.04 0.00 0.00 177.00 178.61 1d1d n LEU 48 N -0.85 0.00 -4.93 -3.56 -0.00 -1.26 -5.02 117.00 101.37 1d1d n LEU 48 Ca 0.09 -1.54 -0.25 0.00 -0.00 0.00 0.00 56.01 54.30 1d1d n LEU 48 Cb 0.52 1.14 0.03 0.00 -0.00 0.00 0.00 43.42 45.11 1d1d n LEU 48 CO 0.40 -0.31 0.47 -0.76 -0.00 0.00 0.00 177.39 177.19 1d1d s LEU 49 N 0.00 3.30 0.28 1.47 2.01 -1.26 -4.75 118.68 119.73 1d1d s LEU 49 Ca 0.17 0.56 0.14 0.00 0.01 0.00 0.00 54.13 55.01 1d1d s LEU 49 Cb 0.00 -3.39 0.32 0.00 0.01 0.00 0.00 46.19 43.13 1d1d s LEU 49 CO 0.12 -1.02 1.57 1.55 1.01 0.00 0.00 176.35 179.58 1d1d h PRO 50 N -0.06 0.00 0.09 1.29 0.13 -1.96 -2.07 132.00 129.42 1d1d h PRO 50 Ca -0.45 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1d1d h PRO 50 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 1d1d h PRO 50 CO 0.59 0.58 -0.04 1.25 -0.23 0.00 0.00 178.00 180.15 1d1d h HIS 51 N 0.00 -0.11 -0.12 1.56 -0.00 -1.98 -2.70 115.15 111.81 1d1d h HIS 51 Ca -0.01 -0.00 -0.05 0.00 -0.00 0.00 0.00 60.37 60.31 1d1d h HIS 51 Cb 1.19 0.04 -0.01 0.00 -0.00 0.00 0.00 27.41 28.63 1d1d h HIS 51 CO 0.00 0.25 -0.17 0.22 -0.00 0.00 0.00 177.93 178.22 1d1d h ASP 52 N -0.48 0.18 -0.48 3.26 3.58 -1.97 -2.27 116.42 118.24 1d1d h ASP 52 Ca -0.01 -0.04 0.07 0.00 0.42 0.00 0.00 57.03 57.47 1d1d h ASP 52 Cb 0.40 -0.05 -0.06 0.00 1.72 0.00 0.00 39.33 41.35 1d1d h ASP 52 CO 0.02 0.37 0.14 0.58 -2.88 0.00 0.00 179.24 177.47 1d1d h VAL 53 N 0.18 0.79 -0.38 2.25 2.07 -1.18 0.77 116.25 120.74 1d1d h VAL 53 Ca 0.03 -0.10 -0.12 0.00 0.82 0.00 0.00 66.70 67.34 1d1d h VAL 53 Cb 0.42 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 30.64 1d1d h VAL 53 CO 0.03 0.05 -0.24 0.71 0.02 0.00 0.00 177.57 178.14 1d1d h THR 54 N 0.29 1.27 -0.36 2.57 1.35 -1.12 0.52 112.91 117.44 1d1d h THR 54 Ca 0.24 -1.36 -0.03 0.00 -0.55 0.00 0.00 66.41 64.72 1d1d h THR 54 Cb 0.28 1.23 -0.02 0.00 -1.73 0.00 0.00 68.15 67.92 1d1d h THR 54 CO -0.27 0.45 0.12 -0.55 -0.25 0.00 0.00 175.52 175.02 1d1d h ASN 55 N 0.67 0.51 0.07 5.36 -1.07 -0.63 0.49 115.58 120.98 1d1d h ASN 55 Ca 0.09 -0.19 -0.00 0.00 0.07 0.00 0.00 56.30 56.27 1d1d h ASN 55 Cb 0.75 -0.13 0.00 0.00 -2.07 0.00 0.00 38.32 36.87 1d1d h ASN 55 CO 0.06 0.56 -0.04 0.25 0.07 0.00 0.00 177.43 178.34 1d1d h LEU 56 N 0.43 -0.08 -2.03 6.14 5.85 0.66 -2.66 115.31 123.61 1d1d h LEU 56 Ca 0.12 -0.41 0.06 0.00 0.84 0.00 0.00 57.88 58.49 1d1d h LEU 56 Cb 0.23 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 1d1d h LEU 56 CO -0.01 0.39 0.17 0.24 -0.34 0.00 0.00 178.44 178.89 1d1d h MET 57 N -0.58 0.00 -0.17 1.25 2.86 0.11 0.86 114.93 119.26 1d1d h MET 57 Ca -0.01 0.00 -0.13 0.00 -2.06 0.00 0.00 59.70 57.50 1d1d h MET 57 Cb 0.49 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.14 1d1d h MET 57 CO 0.02 0.00 -0.44 -0.09 1.06 0.00 0.00 176.91 177.46 1d1d h ARG 58 N 0.00 0.40 -0.02 1.72 2.43 0.12 2.69 114.38 121.72 1d1d h ARG 58 Ca 0.11 -0.21 -0.05 0.00 -0.81 0.00 0.00 59.98 59.02 1d1d h ARG 58 Cb 0.44 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.00 1d1d h ARG 58 CO -0.00 0.77 -0.16 0.28 -1.51 0.00 0.00 179.97 179.34 1d1d h VAL 59 N 0.33 1.51 -0.04 0.20 2.07 -0.55 -3.33 116.25 116.44 1d1d h VAL 59 Ca 0.02 -1.73 -0.11 0.00 0.82 0.00 0.00 66.70 65.71 1d1d h VAL 59 Cb 0.90 2.57 0.01 0.00 -1.52 0.00 0.00 31.29 33.25 1d1d h VAL 59 CO 0.08 0.47 -0.40 0.40 0.02 0.00 0.00 177.57 178.14 1d1d h ILE 60 N -0.47 1.44 -3.31 4.57 2.04 -1.10 -3.43 117.51 117.25 1d1d h ILE 60 Ca -0.01 -1.86 -0.57 0.00 1.00 0.00 0.00 64.86 63.41 1d1d h ILE 60 Cb 0.85 2.46 -0.07 0.00 -0.74 0.00 0.00 36.82 39.33 1d1d h ILE 60 CO 0.03 0.54 -0.07 -0.22 0.00 0.00 0.00 178.15 178.43 1d1d s LEU 61 N -8.56 4.33 1.25 1.44 1.98 0.90 -5.04 118.68 114.98 1d1d s LEU 61 Ca -0.14 0.98 -0.18 0.00 -2.89 0.00 0.00 54.13 51.90 1d1d s LEU 61 Cb 0.03 -2.82 0.28 0.00 0.66 0.00 0.00 46.19 44.34 1d1d s LEU 61 CO 0.79 0.02 0.69 0.61 -1.89 0.00 0.00 176.35 176.57 1d1d n GLY 62 N 2.94 -2.79 0.10 7.98 0.00 -1.26 -4.17 105.19 107.99 1d1d n GLY 62 Ca -0.06 -1.23 -0.15 0.00 0.00 0.00 0.00 46.02 44.57 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 -2.90 0.19 0.18 1.61 0.13 -1.96 -1.24 132.00 128.01 1d1d h PRO 63 Ca -0.51 -0.18 -0.01 0.00 -0.87 0.00 0.00 66.00 64.43 1d1d h PRO 63 Cb 1.28 0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.46 1d1d h PRO 63 CO 0.36 0.89 -0.09 0.00 -0.23 0.00 0.00 178.00 178.94 1d1d h ALA 64 N 0.30 -0.25 0.00 -0.56 0.00 -1.99 -1.28 119.26 115.48 1d1d h ALA 64 Ca -0.03 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1d1d h ALA 64 Cb 0.97 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1d1d h ALA 64 CO 0.05 -0.61 0.00 -0.35 0.00 0.00 0.00 179.25 178.33 1d1d n PRO 65 N -5.18 0.75 -0.03 0.00 -0.04 -1.25 -3.36 135.00 125.90 1d1d n PRO 65 Ca -0.09 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.24 1d1d n PRO 65 Cb 0.14 -1.37 -0.08 0.00 -0.04 0.00 0.00 33.50 32.15 1d1d n PRO 65 CO 0.00 0.00 0.00 -0.92 -0.04 0.00 0.00 175.50 174.54 1d1d h TYR 66 N 0.00 0.16 -0.44 0.54 3.20 0.03 -2.49 116.97 117.97 1d1d h TYR 66 Ca 0.00 -0.04 0.03 0.00 3.14 0.00 0.00 58.73 61.86 1d1d h TYR 66 Cb 0.00 -0.04 -0.02 0.00 1.54 0.00 0.00 36.73 38.21 1d1d h TYR 66 CO 0.00 0.53 0.29 0.00 -1.64 0.00 0.00 178.16 177.34 1d1d h ALA 67 N 0.61 1.82 -0.31 1.82 0.00 -1.63 -0.98 119.26 120.58 1d1d h ALA 67 Ca 0.01 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1d1d h ALA 67 Cb 0.49 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1d1d h ALA 67 CO 0.01 0.13 0.15 -0.07 0.00 0.00 0.00 179.25 179.47 1d1d h LEU 68 N 0.47 0.40 -0.81 0.00 3.38 -1.70 0.12 115.31 117.18 1d1d h LEU 68 Ca 0.18 -0.12 0.03 0.00 0.09 0.00 0.00 57.88 58.06 1d1d h LEU 68 Cb 0.12 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 40.71 1d1d h LEU 68 CO -0.04 0.41 0.52 -0.25 0.09 0.00 0.00 178.44 179.17 1d1d h TRP 69 N 0.37 0.97 -0.30 1.13 7.01 -0.76 0.20 115.95 124.58 1d1d h TRP 69 Ca 0.11 0.03 -0.05 0.00 2.11 0.00 0.00 58.89 61.09 1d1d h TRP 69 Cb 0.11 -0.32 -0.02 0.00 -2.10 0.00 0.00 29.16 26.83 1d1d h TRP 69 CO -0.02 0.55 -0.02 0.52 -2.79 0.00 0.00 178.44 176.68 1d1d h MET 70 N 1.01 0.45 -0.16 2.65 2.86 -0.62 1.27 114.93 122.39 1d1d h MET 70 Ca 0.33 -0.09 -0.09 0.00 -2.06 0.00 0.00 59.70 57.78 1d1d h MET 70 Cb 0.02 -0.07 -0.00 0.00 0.06 0.00 0.00 31.60 31.61 1d1d h MET 70 CO -0.12 0.50 -0.27 0.22 1.06 0.00 0.00 176.91 178.30 1d1d h ASP 71 N 0.44 0.51 0.60 1.22 1.82 0.91 0.22 116.42 122.14 1d1d h ASP 71 Ca 0.09 -0.54 -0.15 0.00 -0.39 0.00 0.00 57.03 56.05 1d1d h ASP 71 Cb 0.32 -0.15 -0.02 0.00 0.68 0.00 0.00 39.33 40.17 1d1d h ASP 71 CO 0.01 0.95 -0.67 0.00 -1.61 0.00 0.00 179.24 177.92 1d1d h ALA 72 N 0.58 0.86 -0.03 -0.78 0.00 -0.32 -2.35 119.26 117.22 1d1d h ALA 72 Ca 0.01 -0.60 -0.01 0.00 0.00 0.00 0.00 54.91 54.31 1d1d h ALA 72 Cb 0.85 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 1d1d h ALA 72 CO 0.06 0.82 -0.02 2.35 0.00 0.00 0.00 179.25 182.46 1d1d h TRP 73 N 0.04 0.08 -0.39 0.00 7.01 0.17 0.44 115.95 123.30 1d1d h TRP 73 Ca -0.01 -0.02 0.07 0.00 2.11 0.00 0.00 58.89 61.04 1d1d h TRP 73 Cb 1.19 -0.02 -0.06 0.00 -2.10 0.00 0.00 29.16 28.17 1d1d h TRP 73 CO 0.01 0.50 -0.00 0.78 -2.79 0.00 0.00 178.44 176.94 1d1d h GLY 74 N -0.38 0.38 0.93 2.65 0.00 -0.51 0.50 103.07 106.64 1d1d h GLY 74 Ca 0.01 0.05 -0.09 0.00 0.00 0.00 0.00 47.33 47.30 1d1d h GLY 74 CO 0.01 -0.09 -0.13 -2.08 0.00 0.00 0.00 176.54 174.24 1d1d h VAL 75 N 0.10 1.29 -0.53 4.60 2.07 -1.41 -2.50 116.25 119.88 1d1d h VAL 75 Ca 0.19 -1.23 0.07 0.00 0.82 0.00 0.00 66.70 66.55 1d1d h VAL 75 Cb 0.27 1.40 -0.06 0.00 -1.52 0.00 0.00 31.29 31.38 1d1d h VAL 75 CO -0.32 0.40 0.20 1.56 0.02 0.00 0.00 177.57 179.43 1d1d h GLN 76 N 0.43 0.37 -0.14 1.57 1.08 0.73 0.23 115.11 119.37 1d1d h GLN 76 Ca 0.07 -0.02 0.03 0.00 -1.45 0.00 0.00 58.65 57.28 1d1d h GLN 76 Cb 0.65 -0.08 -0.03 0.00 -0.05 0.00 0.00 27.48 27.97 1d1d h GLN 76 CO 0.04 0.25 -0.05 -0.07 -0.95 0.00 0.00 178.83 178.05 1d1d h LEU 77 N 0.38 -0.16 -1.64 1.46 3.38 0.07 -0.72 115.31 118.08 1d1d h LEU 77 Ca 0.25 0.05 0.01 0.00 0.09 0.00 0.00 57.88 58.28 1d1d h LEU 77 Cb 0.27 0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 1d1d h LEU 77 CO -0.25 -0.06 0.26 1.56 0.09 0.00 0.00 178.44 180.04 1d1d h GLN 78 N -0.02 0.47 -0.51 1.13 4.20 -0.87 -0.65 115.11 118.88 1d1d h GLN 78 Ca 0.07 -0.03 -0.02 0.00 0.06 0.00 0.00 58.65 58.73 1d1d h GLN 78 Cb 0.13 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 27.78 1d1d h GLN 78 CO -0.16 0.31 0.22 1.15 -0.67 0.00 0.00 178.83 179.68 1d1d h THR 79 N 0.49 1.18 -0.13 -0.54 2.02 0.87 0.46 112.91 117.26 1d1d h THR 79 Ca 0.15 -0.54 -0.16 0.00 0.77 0.00 0.00 66.41 66.63 1d1d h THR 79 Cb 0.00 0.56 -0.01 0.00 -1.74 0.00 0.00 68.15 66.96 1d1d h THR 79 CO -0.03 0.22 -0.61 0.58 0.37 0.00 0.00 175.52 176.05 1d1d h VAL 80 N 0.72 1.35 0.01 3.16 2.07 -0.31 0.57 116.25 123.82 1d1d h VAL 80 Ca 0.18 -1.92 -0.00 0.00 0.82 0.00 0.00 66.70 65.77 1d1d h VAL 80 Cb 0.11 1.91 0.00 0.00 -1.52 0.00 0.00 31.29 31.80 1d1d h VAL 80 CO -0.02 0.58 -0.01 0.40 0.02 0.00 0.00 177.57 178.55 1d1d h ILE 81 N 0.32 1.40 -0.53 4.57 1.08 -0.66 -1.61 117.51 122.09 1d1d h ILE 81 Ca -0.01 -1.29 -0.09 0.00 -0.39 0.00 0.00 64.86 63.08 1d1d h ILE 81 Cb 1.14 2.27 -0.02 0.00 -3.07 0.00 0.00 36.82 37.15 1d1d h ILE 81 CO 0.11 0.33 -0.03 0.00 -0.69 0.00 0.00 178.15 177.87 1d1d h ALA 82 N 0.39 0.94 0.00 1.87 0.00 -0.13 -1.29 119.26 121.05 1d1d h ALA 82 Ca -0.00 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.58 1d1d h ALA 82 Cb 0.56 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 1d1d h ALA 82 CO 0.00 0.63 -0.09 0.00 0.00 0.00 0.00 179.25 179.79 1d1d h ALA 83 N 1.10 1.57 0.01 0.00 0.00 0.15 0.46 119.26 122.56 1d1d h ALA 83 Ca 0.15 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1d1d h ALA 83 Cb 0.55 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1d1d h ALA 83 CO 0.03 0.12 -0.00 0.00 0.00 0.00 0.00 179.25 179.39 1d1d h ALA 84 N 1.91 -0.01 -0.16 0.00 0.00 -0.37 -0.39 119.26 120.23 1d1d h ALA 84 Ca -0.00 -0.38 -0.04 0.00 0.00 0.00 0.00 54.91 54.48 1d1d h ALA 84 Cb 0.20 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1d1d h ALA 84 CO 0.01 -0.11 -0.10 0.00 0.00 0.00 0.00 179.25 179.06 1d1d h THR 85 N -0.82 1.16 -0.07 0.00 1.03 -0.79 -2.56 112.91 110.87 1d1d h THR 85 Ca -0.00 -0.70 -0.21 0.00 -0.01 0.00 0.00 66.41 65.49 1d1d h THR 85 Cb 0.77 1.15 0.01 0.00 -1.07 0.00 0.00 68.15 69.02 1d1d h THR 85 CO 0.00 0.22 -0.78 -0.09 -0.01 0.00 0.00 175.52 174.87 1d1d h ARG 86 N 0.24 0.64 -3.63 0.00 2.43 -0.13 -3.43 114.38 110.50 1d1d h ARG 86 Ca 0.05 -0.60 -0.45 0.00 -0.81 0.00 0.00 59.98 58.17 1d1d h ARG 86 Cb 0.33 0.15 -0.39 0.00 -0.42 0.00 0.00 29.97 29.64 1d1d h ARG 86 CO 0.02 1.21 -0.76 -0.51 -1.51 0.00 0.00 179.97 178.41 1d1d s ASP 87 N -7.01 1.85 -0.62 -3.80 1.11 -0.16 -5.03 116.67 103.01 1d1d s ASP 87 Ca -0.11 -0.24 -0.06 0.00 0.18 0.00 0.00 52.55 52.32 1d1d s ASP 87 Cb 0.06 -0.45 -0.13 0.00 1.07 0.00 0.00 42.92 43.47 1d1d s ASP 87 CO 0.88 -0.22 2.66 -0.81 1.18 0.00 0.00 175.17 178.85 1d1d n PRO 88 N 5.14 2.15 -0.16 8.23 -0.04 -1.17 -3.46 135.00 145.68 1d1d n PRO 88 Ca -0.07 -1.27 0.01 0.00 -0.04 0.00 0.00 63.50 62.13 1d1d n PRO 88 Cb 0.49 -2.24 0.01 0.00 -0.04 0.00 0.00 33.50 31.73 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 3.29 0.56 -2.87 0.54 3.00 -1.26 -5.07 116.66 114.85 1d1d n ARG 89 Ca 0.46 -1.01 -0.40 0.00 -0.01 0.00 0.00 57.85 56.89 1d1d n ARG 89 Cb 0.43 -0.67 -0.05 0.00 0.00 0.00 0.00 32.46 32.16 1d1d n ARG 89 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.63 176.62 1d1d s HIS 90 N -0.43 3.84 -0.09 -1.55 3.76 -1.22 -4.95 115.29 114.65 1d1d s HIS 90 Ca 0.03 1.68 0.25 0.00 -0.15 0.00 0.00 55.06 56.87 1d1d s HIS 90 Cb 0.03 -2.90 0.74 0.00 1.11 0.00 0.00 32.58 31.56 1d1d s HIS 90 CO 0.00 0.35 1.75 -1.00 -0.85 0.00 0.00 174.74 174.99 1d1d h PRO 91 N 5.05 0.00 0.00 8.40 0.13 -1.96 -2.67 132.00 140.95 1d1d h PRO 91 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 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 0.69 0.14 0.00 0.00 -0.23 0.00 0.00 178.00 178.60 1d1d h ALA 92 N 1.86 1.00 -3.14 -0.56 0.00 -1.92 -3.41 119.26 113.09 1d1d h ALA 92 Ca -0.00 0.00 -0.63 0.00 0.00 0.00 0.00 54.91 54.28 1d1d h ALA 92 Cb 0.85 0.00 -0.18 0.00 0.00 0.00 0.00 17.79 18.46 1d1d h ALA 92 CO 0.02 0.00 -0.81 0.54 0.00 0.00 0.00 179.25 178.99 1d1d s ASN 93 N -4.66 3.27 0.00 0.00 4.22 -1.01 -4.51 114.94 112.25 1d1d s ASN 93 Ca 0.05 -0.86 0.00 0.00 -2.14 0.00 0.00 52.86 49.91 1d1d s ASN 93 Cb 0.10 -0.23 0.00 0.00 1.28 0.00 0.00 41.25 42.39 1d1d s ASN 93 CO 0.48 0.09 0.00 0.61 -2.04 0.00 0.00 177.10 176.24 1d1d n GLY 94 N 0.28 3.31 1.21 0.45 0.00 -1.26 -4.69 105.19 104.49 1d1d n GLY 94 Ca -0.13 -0.40 -0.00 0.00 0.00 0.00 0.00 46.02 45.49 1d1d n GLY 94 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1d1d n GLN 95 N 0.00 0.02 -1.22 1.61 7.27 -1.26 -4.98 117.38 118.82 1d1d n GLN 95 Ca 0.00 -0.02 0.00 0.00 0.07 0.00 0.00 57.00 57.05 1d1d n GLN 95 Cb 0.00 0.16 0.00 0.00 2.41 0.00 0.00 30.24 32.81 1d1d n GLN 95 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1d1d n GLY 96 N -0.02 -0.19 0.46 1.69 0.00 -1.26 -4.64 105.19 101.23 1d1d n GLY 96 Ca -0.00 -1.09 0.14 0.00 0.00 0.00 0.00 46.02 45.06 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 1.64 0.00 1.61 0.63 -1.26 -4.46 116.66 114.82 1d1d n ARG 97 Ca 0.00 -0.93 0.00 0.00 -0.92 0.00 0.00 57.85 56.00 1d1d n ARG 97 Cb 0.00 -1.48 0.00 0.00 0.45 0.00 0.00 32.46 31.43 1d1d n ARG 97 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1d1d n GLY 98 N 1.17 0.00 0.39 5.14 0.00 -1.26 -5.05 105.19 105.58 1d1d n GLY 98 Ca 0.19 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.05 1d1d n GLY 98 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1d1d h GLU 99 N 0.00 -0.76 -3.34 1.61 4.57 -1.82 -3.49 114.58 111.35 1d1d h GLU 99 Ca 0.00 0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.23 1d1d h GLU 99 Cb 0.00 0.17 0.00 0.00 -0.16 0.00 0.00 28.75 28.76 1d1d h GLU 99 CO 0.00 -0.50 -0.71 -2.13 -1.18 0.00 0.00 179.01 174.48 1d1d n ARG 100 N -5.48 -4.09 -1.37 1.92 0.63 -1.26 -4.95 116.66 102.06 1d1d n ARG 100 Ca -0.10 2.99 -0.29 0.00 -0.92 0.00 0.00 57.85 59.53 1d1d n ARG 100 Cb 0.37 -3.16 0.16 0.00 0.45 0.00 0.00 32.46 30.28 1d1d n ARG 100 CO 0.00 0.00 0.00 -0.08 -2.51 0.00 0.00 177.63 175.04 1d1d s THR 101 N -0.90 2.00 0.02 5.15 -1.32 -1.26 -4.85 115.64 114.47 1d1d s THR 101 Ca 0.00 0.00 0.02 0.00 -1.21 0.00 0.00 61.69 60.50 1d1d s THR 101 Cb 0.00 -2.64 -0.01 0.00 -1.51 0.00 0.00 72.50 68.34 1d1d s THR 101 CO 0.00 0.00 -0.06 0.20 -2.21 0.00 0.00 174.62 172.55 1d1d s ASN 102 N -3.79 0.70 0.17 8.08 -0.87 -1.26 -4.95 114.94 113.02 1d1d s ASN 102 Ca 0.65 -0.34 -0.14 0.00 -1.57 0.00 0.00 52.86 51.45 1d1d s ASN 102 Cb -0.16 -0.01 0.08 0.00 -0.02 0.00 0.00 41.25 41.14 1d1d s ASN 102 CO 0.55 -0.09 1.80 0.25 -2.57 0.00 0.00 177.10 177.04 1d1d h LEU 103 N 5.19 0.41 -1.24 0.60 5.85 -1.96 -0.77 115.31 123.39 1d1d h LEU 103 Ca -0.32 0.01 0.15 0.00 0.84 0.00 0.00 57.88 58.56 1d1d h LEU 103 Cb 1.20 -0.07 -0.07 0.00 0.37 0.00 0.00 40.66 42.08 1d1d h LEU 103 CO 0.45 0.29 0.59 -0.78 -0.34 0.00 0.00 178.44 178.65 1d1d h ASP 104 N 0.52 0.69 -0.84 1.25 3.58 -1.98 0.33 116.42 119.97 1d1d h ASP 104 Ca 0.19 0.05 0.16 0.00 0.42 0.00 0.00 57.03 57.85 1d1d h ASP 104 Cb 0.04 -0.09 -0.06 0.00 1.72 0.00 0.00 39.33 40.94 1d1d h ASP 104 CO -0.10 0.34 0.55 -0.09 -2.88 0.00 0.00 179.24 177.06 1d1d h ARG 105 N 0.72 0.49 0.00 0.28 9.65 -1.55 0.38 114.38 124.35 1d1d h ARG 105 Ca 0.47 -0.03 -0.10 0.00 -1.10 0.00 0.00 59.98 59.21 1d1d h ARG 105 Cb 0.73 -0.11 -0.02 0.00 -1.39 0.00 0.00 29.97 29.18 1d1d h ARG 105 CO -0.23 0.32 -0.96 -0.07 2.80 0.00 0.00 179.97 181.84 1d1d h LEU 106 N 0.50 0.00 -0.30 3.80 3.38 -0.38 -3.33 115.31 118.98 1d1d h LEU 106 Ca 0.42 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.44 1d1d h LEU 106 Cb 0.90 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.60 1d1d h LEU 106 CO -0.16 0.39 0.03 0.11 0.09 0.00 0.00 178.44 178.90 1d1d h LYS 107 N 0.00 0.12 0.00 1.13 1.79 0.17 -3.47 116.57 116.31 1d1d h LYS 107 Ca -0.07 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.39 1d1d h LYS 107 Cb 1.36 -0.03 0.00 0.00 -1.58 0.00 0.00 32.23 31.98 1d1d h LYS 107 CO 0.04 0.08 0.00 0.41 -1.08 0.00 0.00 179.45 178.90 1d1d n GLY 108 N -1.22 1.02 0.89 3.86 0.00 -0.85 -4.95 105.19 103.95 1d1d n GLY 108 Ca -0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 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 2.77 -4.72 0.99 -0.00 -1.26 -3.58 117.00 111.21 1d1d n LEU 109 Ca 0.00 -0.97 -0.38 0.00 -0.00 0.00 0.00 56.01 54.66 1d1d n LEU 109 Cb 0.00 -0.03 0.05 0.00 -0.00 0.00 0.00 43.42 43.44 1d1d n LEU 109 CO 0.00 0.48 0.89 0.00 -0.00 0.00 0.00 177.39 178.76 1d1d n ALA 110 N 1.14 1.23 -1.70 1.96 0.00 -1.26 -4.59 120.51 117.29 1d1d n ALA 110 Ca 0.16 0.08 -0.43 0.00 0.00 0.00 0.00 53.44 53.24 1d1d n ALA 110 Cb 0.55 -2.31 -0.03 0.00 0.00 0.00 0.00 19.45 17.66 1d1d n ALA 110 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1d1d n ASP 111 N -1.19 3.65 0.00 0.00 2.03 -1.26 -0.45 116.55 119.33 1d1d n ASP 111 Ca 0.12 1.08 0.00 0.00 0.52 0.00 0.00 54.79 56.52 1d1d n ASP 111 Cb 0.46 -1.52 0.00 0.00 -0.72 0.00 0.00 41.12 39.33 1d1d n ASP 111 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1d1d n GLY 112 N 3.52 2.34 0.02 0.27 0.00 -1.26 -4.78 105.19 105.29 1d1d n GLY 112 Ca 0.15 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.25 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 -2.00 0.62 -2.56 1.61 2.81 0.41 -4.53 117.12 113.48 1d1d n MET 113 Ca 0.00 -0.16 -0.42 0.00 -1.81 0.00 0.00 57.70 55.31 1d1d n MET 113 Cb 0.00 -1.44 -0.03 0.00 -0.71 0.00 0.00 33.22 31.04 1d1d n MET 113 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 1d1d s VAL 114 N -3.22 4.47 0.00 2.03 1.01 -0.90 -2.56 120.40 121.22 1d1d s VAL 114 Ca -0.07 1.77 0.00 0.00 0.00 0.00 0.00 61.98 63.68 1d1d s VAL 114 Cb 0.11 -4.14 0.00 0.00 0.00 0.00 0.00 36.38 32.36 1d1d s VAL 114 CO 0.77 0.03 0.00 0.61 0.00 0.00 0.00 175.10 176.51 1d1d n GLY 115 N 3.21 0.82 2.59 4.51 0.00 -1.26 -4.98 105.19 110.08 1d1d n GLY 115 Ca 0.09 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.83 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 3.53 -0.02 1.61 -0.87 -1.06 -5.03 114.94 110.41 1d1d s ASN 116 Ca 0.00 -1.29 -0.04 0.00 -1.57 0.00 0.00 52.86 49.96 1d1d s ASN 116 Cb 0.00 -0.46 -0.02 0.00 -0.02 0.00 0.00 41.25 40.75 1d1d s ASN 116 CO 0.00 -0.42 0.31 1.55 -2.57 0.00 0.00 177.10 175.96 1d1d h PRO 117 N 8.33 -0.13 -0.75 -0.60 0.13 -1.94 -1.29 132.00 135.75 1d1d h PRO 117 Ca -0.18 0.01 0.11 0.00 -0.87 0.00 0.00 66.00 65.06 1d1d h PRO 117 Cb 1.03 0.03 -0.08 0.00 0.13 0.00 0.00 31.00 32.11 1d1d h PRO 117 CO 0.43 -0.09 0.38 0.37 -0.23 0.00 0.00 178.00 178.86 1d1d h GLN 118 N -0.44 0.60 -0.66 0.86 -0.00 -1.96 0.16 115.11 113.67 1d1d h GLN 118 Ca -0.01 -0.04 -0.05 0.00 -0.00 0.00 0.00 58.65 58.55 1d1d h GLN 118 Cb 0.11 -0.14 -0.03 0.00 0.00 0.00 0.00 27.48 27.42 1d1d h GLN 118 CO 0.02 0.40 0.23 0.78 0.00 0.00 0.00 178.83 180.26 1d1d h GLY 119 N 0.62 1.07 0.94 2.39 0.00 -1.93 -1.29 103.07 104.88 1d1d h GLY 119 Ca 0.38 -0.59 -0.03 0.00 0.00 0.00 0.00 47.33 47.09 1d1d h GLY 119 CO -0.29 0.56 0.14 -1.61 0.00 0.00 0.00 176.54 175.33 1d1d h GLN 120 N 0.97 0.65 -0.16 4.80 4.15 0.19 0.76 115.11 126.46 1d1d h GLN 120 Ca 0.22 -0.14 -0.04 0.00 0.77 0.00 0.00 58.65 59.47 1d1d h GLN 120 Cb 0.24 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 27.83 1d1d h GLN 120 CO -0.01 0.63 -0.07 0.00 -1.93 0.00 0.00 178.83 177.45 1d1d h ALA 121 N 0.98 1.58 0.00 3.38 0.00 -0.73 0.23 119.26 124.71 1d1d h ALA 121 Ca 0.14 -0.16 -0.08 0.00 0.00 0.00 0.00 54.91 54.80 1d1d h ALA 121 Cb 0.25 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1d1d h ALA 121 CO -0.01 0.31 -0.38 0.00 0.00 0.00 0.00 179.25 179.17 1d1d h ALA 122 N 1.69 0.85 0.18 0.00 0.00 -0.61 -3.17 119.26 118.21 1d1d h ALA 122 Ca 0.05 -0.35 -0.26 0.00 0.00 0.00 0.00 54.91 54.36 1d1d h ALA 122 Cb 0.29 -0.06 0.03 0.00 0.00 0.00 0.00 17.79 18.05 1d1d h ALA 122 CO 0.01 0.47 -1.13 1.25 0.00 0.00 0.00 179.25 179.86 1d1d h LEU 123 N 0.00 0.67 -8.87 0.00 6.46 0.90 -3.43 115.31 111.05 1d1d h LEU 123 Ca -0.00 -0.92 -0.57 0.00 -0.12 0.00 0.00 57.88 56.27 1d1d h LEU 123 Cb 1.09 -0.22 -0.05 0.00 -0.73 0.00 0.00 40.66 40.75 1d1d h LEU 123 CO 0.05 1.54 1.01 -0.76 -0.62 0.00 0.00 178.44 179.67 1d1d s LEU 124 N -7.78 3.74 0.81 2.25 1.43 0.65 -4.96 118.68 114.81 1d1d s LEU 124 Ca -0.11 1.00 -0.16 0.00 -1.03 0.00 0.00 54.13 53.83 1d1d s LEU 124 Cb 0.03 -3.54 -0.14 0.00 0.03 0.00 0.00 46.19 42.57 1d1d s LEU 124 CO 0.89 -1.25 -0.60 -2.11 0.23 0.00 0.00 176.35 173.52 1d1d n ARG 125 N 7.68 0.00 -2.34 1.70 -4.01 -1.26 -4.74 116.66 113.68 1d1d n ARG 125 Ca 0.15 0.00 -0.43 0.00 -1.04 0.00 0.00 57.85 56.54 1d1d n ARG 125 Cb 0.47 -0.92 -0.02 0.00 -3.04 0.00 0.00 32.46 28.95 1d1d n ARG 125 CO 0.00 0.00 0.00 -1.25 -3.04 0.00 0.00 177.63 173.34 1d1d s PRO 126 N -1.63 3.49 0.00 2.89 0.04 -1.26 -3.21 135.00 135.32 1d1d s PRO 126 Ca 0.41 0.84 0.00 0.00 0.04 0.00 0.00 61.00 62.29 1d1d s PRO 126 Cb -0.23 -4.06 0.00 0.00 0.04 0.00 0.00 34.50 30.25 1d1d s PRO 126 CO 0.73 -1.68 0.00 0.41 0.04 0.00 0.00 177.00 176.50 1d1d n GLY 127 N 5.14 1.98 0.36 0.56 0.00 -1.26 -4.98 105.19 107.00 1d1d n GLY 127 Ca 0.16 -0.18 -0.03 0.00 0.00 0.00 0.00 46.02 45.97 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 1.22 -0.91 1.61 4.39 -1.79 -1.74 114.58 117.36 1d1d h GLU 128 Ca 0.00 -0.14 0.01 0.00 0.34 0.00 0.00 59.36 59.56 1d1d h GLU 128 Cb 0.00 -0.24 -0.05 0.00 -0.10 0.00 0.00 28.75 28.37 1d1d h GLU 128 CO 0.00 0.89 0.60 -0.07 -1.16 0.00 0.00 179.01 179.28 1d1d h LEU 129 N 1.22 1.05 -1.02 1.33 3.38 -1.86 -1.05 115.31 118.37 1d1d h LEU 129 Ca 0.31 -0.03 0.01 0.00 0.09 0.00 0.00 57.88 58.26 1d1d h LEU 129 Cb 0.03 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 40.47 1d1d h LEU 129 CO -0.05 0.76 0.64 0.58 0.09 0.00 0.00 178.44 180.46 1d1d h VAL 130 N 1.24 1.25 -0.92 1.22 2.07 -1.65 -0.29 116.25 119.18 1d1d h VAL 130 Ca 0.33 -0.47 0.01 0.00 0.82 0.00 0.00 66.70 67.39 1d1d h VAL 130 Cb -0.14 -0.18 -0.05 0.00 -1.52 0.00 0.00 31.29 29.41 1d1d h VAL 130 CO -0.07 0.25 0.61 0.00 0.02 0.00 0.00 177.57 178.37 1d1d h ALA 131 N 1.38 1.36 -0.49 1.67 0.00 -0.77 0.51 119.26 122.91 1d1d h ALA 131 Ca 0.36 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 55.09 1d1d h ALA 131 Cb -0.14 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.27 1d1d h ALA 131 CO -0.08 0.59 -0.15 0.82 0.00 0.00 0.00 179.25 180.44 1d1d h ILE 132 N 1.23 1.27 -0.17 0.00 2.04 -0.68 0.17 117.51 121.37 1d1d h ILE 132 Ca 0.34 -1.29 -0.04 0.00 1.00 0.00 0.00 64.86 64.87 1d1d h ILE 132 Cb -0.12 1.04 -0.00 0.00 -0.74 0.00 0.00 36.82 37.00 1d1d h ILE 132 CO -0.08 0.45 -0.06 0.74 0.00 0.00 0.00 178.15 179.20 1d1d h THR 133 N 0.83 1.30 -0.15 -0.27 2.02 0.09 0.40 112.91 117.13 1d1d h THR 133 Ca 0.12 -1.06 -0.00 0.00 0.77 0.00 0.00 66.41 66.24 1d1d h THR 133 Cb 0.70 1.64 -0.01 0.00 -1.74 0.00 0.00 68.15 68.74 1d1d h THR 133 CO 0.05 0.31 0.08 0.00 0.37 0.00 0.00 175.52 176.33 1d1d h ALA 134 N 0.71 0.20 -0.38 6.16 0.00 0.07 -0.46 119.26 125.55 1d1d h ALA 134 Ca 0.04 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 1d1d h ALA 134 Cb 0.51 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 1d1d h ALA 134 CO 0.02 -0.25 0.02 0.66 0.00 0.00 0.00 179.25 179.70 1d1d h SER 135 N 0.13 0.56 -0.63 0.00 4.64 -0.64 0.10 113.55 117.71 1d1d h SER 135 Ca 0.05 -0.11 -0.02 0.00 -0.47 0.00 0.00 61.79 61.25 1d1d h SER 135 Cb 0.11 -0.15 -0.03 0.00 -0.31 0.00 0.00 62.40 62.02 1d1d h SER 135 CO -0.01 0.62 0.32 0.00 -0.87 0.00 0.00 176.83 176.89 1d1d h ALA 136 N 1.45 0.81 -0.31 5.18 0.00 0.33 0.25 119.26 126.98 1d1d h ALA 136 Ca 0.12 -0.12 -0.13 0.00 0.00 0.00 0.00 54.91 54.78 1d1d h ALA 136 Cb 0.33 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 1d1d h ALA 136 CO 0.01 0.35 -0.30 -0.07 0.00 0.00 0.00 179.25 179.24 1d1d h LEU 137 N 0.86 0.79 -1.37 0.00 4.07 -0.52 -1.30 115.31 117.85 1d1d h LEU 137 Ca 0.22 -0.47 -0.01 0.00 0.08 0.00 0.00 57.88 57.70 1d1d h LEU 137 Cb 0.09 -0.22 -0.03 0.00 1.08 0.00 0.00 40.66 41.58 1d1d h LEU 137 CO -0.03 1.10 0.32 -0.61 -1.08 0.00 0.00 178.44 178.13 1d1d h GLN 138 N 0.50 0.75 -0.05 1.13 5.75 -0.41 0.86 115.11 123.65 1d1d h GLN 138 Ca 0.05 -0.07 -0.16 0.00 -0.15 0.00 0.00 58.65 58.33 1d1d h GLN 138 Cb 0.87 -0.16 -0.01 0.00 1.07 0.00 0.00 27.48 29.25 1d1d h GLN 138 CO 0.07 0.54 -0.67 0.00 -2.65 0.00 0.00 178.83 176.12 1d1d h ALA 139 N 1.59 0.78 0.37 3.38 0.00 -0.32 -2.01 119.26 123.05 1d1d h ALA 139 Ca 0.20 -0.59 -0.02 0.00 0.00 0.00 0.00 54.91 54.50 1d1d h ALA 139 Cb -0.00 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1d1d h ALA 139 CO -0.04 0.78 -0.18 0.35 0.00 0.00 0.00 179.25 180.17 1d1d h PHE 140 N 0.15 -0.46 -0.23 0.00 3.57 0.02 -2.30 116.94 117.67 1d1d h PHE 140 Ca -0.01 -0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.54 1d1d h PHE 140 Cb 1.20 0.15 -0.01 0.00 2.79 0.00 0.00 35.95 40.09 1d1d h PHE 140 CO 0.02 -0.29 0.28 0.07 -2.23 0.00 0.00 178.31 176.17 1d1d h ARG 141 N -0.80 0.00 -0.32 1.11 -0.00 -0.99 0.13 114.38 113.51 1d1d h ARG 141 Ca -0.05 0.00 -0.12 0.00 -0.00 0.00 0.00 59.98 59.81 1d1d h ARG 141 Cb 0.38 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 30.35 1d1d h ARG 141 CO 0.08 0.00 -0.28 1.49 -0.00 0.00 0.00 179.97 181.27 1d1d h GLU 142 N 0.00 0.75 0.00 0.08 4.81 -1.31 -2.05 114.58 116.86 1d1d h GLU 142 Ca 0.11 -0.38 -0.01 0.00 -0.13 0.00 0.00 59.36 58.95 1d1d h GLU 142 Cb 0.67 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 30.06 1d1d h GLU 142 CO -0.00 1.00 -0.04 0.28 -0.73 0.00 0.00 179.01 179.52 1d1d h VAL 143 N 0.51 0.08 -0.16 0.32 2.07 -0.20 -0.48 116.25 118.39 1d1d h VAL 143 Ca 0.06 -0.75 -0.18 0.00 0.82 0.00 0.00 66.70 66.64 1d1d h VAL 143 Cb 0.84 1.69 0.01 0.00 -1.52 0.00 0.00 31.29 32.31 1d1d h VAL 143 CO 0.07 0.04 -0.61 0.00 0.02 0.00 0.00 177.57 177.08 1d1d h ALA 144 N 1.96 0.29 -0.01 1.67 0.00 -0.89 -3.28 119.26 119.00 1d1d h ALA 144 Ca -0.00 -0.54 -0.13 0.00 0.00 0.00 0.00 54.91 54.23 1d1d h ALA 144 Cb 0.69 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.46 1d1d h ALA 144 CO 0.00 0.55 -0.52 -0.09 0.00 0.00 0.00 179.25 179.19 1d1d h ARG 145 N 0.38 0.36 -3.20 0.00 2.43 -1.17 -3.46 114.38 109.73 1d1d h ARG 145 Ca -0.03 -0.38 0.32 0.00 -0.81 0.00 0.00 59.98 59.07 1d1d h ARG 145 Cb 1.24 0.11 -0.16 0.00 -0.42 0.00 0.00 29.97 30.75 1d1d h ARG 145 CO 0.13 1.06 -1.01 -0.11 -1.51 0.00 0.00 179.97 178.53 1d1d n LEU 146 N -4.28 -0.87 0.00 3.80 7.94 -0.21 -5.05 117.00 118.33 1d1d n LEU 146 Ca -0.10 2.01 0.00 0.00 -1.11 0.00 0.00 56.01 56.81 1d1d n LEU 146 Cb 0.63 -3.45 0.00 0.00 0.53 0.00 0.00 43.42 41.14 1d1d n LEU 146 CO 0.45 -2.18 0.00 0.00 -1.11 0.00 0.00 177.39 174.55 1d1d n ALA 147 N -3.82 0.00 -3.90 1.96 0.00 -1.26 -5.05 120.51 108.43 1d1d n ALA 147 Ca -0.07 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.04 1d1d n ALA 147 Cb 0.63 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.93 1d1d n ALA 147 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 1d1d s GLU 148 N 0.00 2.35 -0.02 0.00 -1.05 -1.26 -5.09 118.70 113.63 1d1d s GLU 148 Ca 0.00 -1.30 -0.30 0.00 -0.15 0.00 0.00 54.97 53.22 1d1d s GLU 148 Cb 0.00 -2.99 -0.04 0.00 -0.44 0.00 0.00 34.13 30.66 1d1d s GLU 148 CO 0.00 -0.57 1.20 -1.25 0.95 0.00 0.00 175.26 175.59 1d1d s PRO 149 N 1.17 4.38 0.11 -4.83 0.04 -1.26 -5.03 135.00 129.58 1d1d s PRO 149 Ca -0.07 1.71 0.03 0.00 0.04 0.00 0.00 61.00 62.71 1d1d s PRO 149 Cb -0.20 -3.49 -0.04 0.00 0.04 0.00 0.00 34.50 30.81 1d1d s PRO 149 CO -0.04 -0.38 0.14 0.00 0.04 0.00 0.00 177.00 176.76 1d1d s ALA 150 N 1.84 3.69 0.00 8.56 0.00 -1.26 -5.02 121.76 129.56 1d1d s ALA 150 Ca 0.57 -1.05 0.00 0.00 0.00 0.00 0.00 51.96 51.48 1d1d s ALA 150 Cb -0.26 -1.52 0.00 0.00 0.00 0.00 0.00 23.12 21.34 1d1d s ALA 150 CO 0.25 0.67 0.00 0.41 0.00 0.00 0.00 175.76 177.08 1d1d n GLY 151 N 0.08 -1.30 0.10 0.00 0.00 -1.26 -4.98 105.19 97.84 1d1d n GLY 151 Ca -0.08 0.57 -0.15 0.00 0.00 0.00 0.00 46.02 46.36 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 0.21 0.00 1.61 0.13 -1.98 -3.12 132.00 128.86 1d1d h PRO 152 Ca 0.00 -0.21 0.00 0.00 -0.87 0.00 0.00 66.00 64.92 1d1d h PRO 152 Cb 0.00 0.05 0.00 0.00 0.13 0.00 0.00 31.00 31.18 1d1d h PRO 152 CO 0.00 0.91 -1.82 -2.67 -0.23 0.00 0.00 178.00 174.19 1d1d n TRP 153 N -4.49 0.00 0.09 1.56 2.14 -1.26 -4.17 117.44 111.31 1d1d n TRP 153 Ca -0.09 0.00 0.03 0.00 2.07 0.00 0.00 57.50 59.51 1d1d n TRP 153 Cb 0.50 -0.41 0.41 0.00 -0.81 0.00 0.00 31.31 31.00 1d1d n TRP 153 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 1d1d h ALA 154 N 2.02 1.59 0.00 -1.67 0.00 -1.94 0.11 119.26 119.36 1d1d h ALA 154 Ca 0.00 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 1d1d h ALA 154 Cb 0.89 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.57 1d1d h ALA 154 CO 0.00 0.31 -0.02 0.22 0.00 0.00 0.00 179.25 179.76 1d1d h ASP 155 N 0.32 0.00 -3.24 0.00 1.82 -1.71 -3.43 116.42 110.19 1d1d h ASP 155 Ca 0.07 0.00 -0.59 0.00 -0.39 0.00 0.00 57.03 56.13 1d1d h ASP 155 Cb 0.22 0.00 -0.08 0.00 0.68 0.00 0.00 39.33 40.15 1d1d h ASP 155 CO 0.00 0.02 0.53 -0.63 -1.61 0.00 0.00 179.24 177.56 1d1d s ILE 156 N -3.22 4.81 -0.05 2.25 1.01 0.03 -5.03 121.20 120.99 1d1d s ILE 156 Ca 0.07 1.70 0.02 0.00 0.00 0.00 0.00 60.65 62.44 1d1d s ILE 156 Cb 0.05 -4.17 0.01 0.00 0.01 0.00 0.00 42.46 38.37 1d1d s ILE 156 CO 0.67 -0.08 -0.10 0.42 0.00 0.00 0.00 174.94 175.85 1d1d s THR 157 N 2.77 0.93 0.09 2.92 -4.23 -1.26 -4.93 115.64 111.93 1d1d s THR 157 Ca 0.38 -0.37 -0.31 0.00 -1.18 0.00 0.00 61.69 60.21 1d1d s THR 157 Cb -0.16 -0.87 -0.07 0.00 1.34 0.00 0.00 72.50 72.75 1d1d s THR 157 CO 0.08 0.31 1.30 -1.58 -0.54 0.00 0.00 174.62 174.19 1d1d s GLN 158 N 0.67 4.37 0.27 3.99 2.00 -1.26 -5.02 119.66 124.68 1d1d s GLN 158 Ca -0.13 1.93 0.11 0.00 -2.00 0.00 0.00 55.36 55.27 1d1d s GLN 158 Cb -0.15 -3.30 -0.05 0.00 0.80 0.00 0.00 33.01 30.31 1d1d s GLN 158 CO 0.02 -0.36 -0.10 0.20 -0.50 0.00 0.00 175.29 174.56 1d1d s GLY 159 N 1.11 1.76 0.47 2.59 0.00 -1.26 -4.34 107.32 107.64 1d1d s GLY 159 Ca 0.62 -1.74 0.26 0.00 0.00 0.00 0.00 44.72 43.86 1d1d s GLY 159 CO 0.30 -1.82 1.77 -0.56 0.00 0.00 0.00 173.10 172.79 1d1d h PRO 160 N 2.12 0.00 0.00 2.90 0.13 -1.99 -2.83 132.00 132.33 1d1d h PRO 160 Ca -0.43 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.67 1d1d h PRO 160 Cb 1.25 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.38 1d1d h PRO 160 CO 0.60 0.08 -0.50 0.77 -0.23 0.00 0.00 178.00 178.72 1d1d h SER 161 N 0.00 0.00 -3.04 1.44 0.02 -2.01 -3.45 113.55 106.50 1d1d h SER 161 Ca -0.00 0.00 -0.65 0.00 -0.84 0.00 0.00 61.79 60.30 1d1d h SER 161 Cb 0.82 0.00 -0.12 0.00 0.14 0.00 0.00 62.40 63.24 1d1d h SER 161 CO 0.01 0.13 -0.53 -0.70 -1.14 0.00 0.00 176.83 174.60 1d1d s GLU 162 N -3.19 3.61 0.23 3.45 2.56 -1.07 -5.05 118.70 119.24 1d1d s GLU 162 Ca 0.03 -0.26 -0.32 0.00 0.00 0.00 0.00 54.97 54.43 1d1d s GLU 162 Cb 0.07 -3.15 -0.13 0.00 2.00 0.00 0.00 34.13 32.92 1d1d s GLU 162 CO 0.73 0.56 1.56 0.43 -0.56 0.00 0.00 175.26 177.97 1d1d n SER 163 N 2.66 3.36 0.03 -1.70 7.64 -1.26 -4.51 113.62 119.85 1d1d n SER 163 Ca -0.18 1.11 -0.10 0.00 1.01 0.00 0.00 58.87 60.71 1d1d n SER 163 Cb 0.54 -1.50 -0.04 0.00 -1.01 0.00 0.00 64.21 62.20 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 5.26 -0.33 -0.47 1.43 3.57 -1.95 0.58 116.94 125.02 1d1d h PHE 164 Ca -0.45 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.04 1d1d h PHE 164 Cb 1.24 0.16 -0.02 0.00 2.79 0.00 0.00 35.95 40.12 1d1d h PHE 164 CO 0.60 -0.19 0.20 -0.24 -2.23 0.00 0.00 178.31 176.44 1d1d h VAL 165 N -0.19 1.20 -0.34 1.41 3.04 -1.96 0.56 116.25 119.97 1d1d h VAL 165 Ca 0.06 -0.62 0.04 0.00 -1.01 0.00 0.00 66.70 65.18 1d1d h VAL 165 Cb 0.28 0.73 -0.04 0.00 -2.01 0.00 0.00 31.29 30.25 1d1d h VAL 165 CO -0.17 0.23 0.10 -0.78 -1.01 0.00 0.00 177.57 175.94 1d1d h ASP 166 N 0.62 0.09 -0.46 3.17 3.58 -1.79 0.57 116.42 122.19 1d1d h ASP 166 Ca 0.16 0.04 -0.10 0.00 0.42 0.00 0.00 57.03 57.55 1d1d h ASP 166 Cb 0.18 0.04 -0.01 0.00 1.72 0.00 0.00 39.33 41.25 1d1d h ASP 166 CO -0.01 0.09 -0.10 0.15 -2.88 0.00 0.00 179.24 176.48 1d1d h PHE 167 N 0.24 0.99 -0.86 0.28 3.57 0.50 -2.59 116.94 119.07 1d1d h PHE 167 Ca 0.16 -0.21 0.09 0.00 3.53 0.00 0.00 57.97 61.54 1d1d h PHE 167 Cb 0.15 -0.24 -0.07 0.00 2.79 0.00 0.00 35.95 38.57 1d1d h PHE 167 CO -0.15 0.97 0.51 0.00 -2.23 0.00 0.00 178.31 177.41 1d1d h ALA 168 N 0.88 1.24 -0.33 2.41 0.00 0.76 0.74 119.26 124.96 1d1d h ALA 168 Ca 0.12 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 1d1d h ALA 168 Cb 0.65 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 1d1d h ALA 168 CO 0.04 0.16 0.19 -0.91 0.00 0.00 0.00 179.25 178.74 1d1d h ASN 169 N 0.87 0.40 -0.79 0.00 2.35 -0.68 0.41 115.58 118.13 1d1d h ASN 169 Ca 0.41 -0.06 0.04 0.00 -0.55 0.00 0.00 56.30 56.14 1d1d h ASN 169 Cb 0.34 -0.10 -0.05 0.00 0.05 0.00 0.00 38.32 38.57 1d1d h ASN 169 CO -0.23 0.34 0.52 0.03 -1.65 0.00 0.00 177.43 176.44 1d1d h ARG 170 N 0.42 0.94 -0.13 0.81 2.47 -0.76 0.38 114.38 118.51 1d1d h ARG 170 Ca 0.12 -0.06 -0.08 0.00 -1.26 0.00 0.00 59.98 58.70 1d1d h ARG 170 Cb 0.02 -0.21 -0.00 0.00 -1.65 0.00 0.00 29.97 28.13 1d1d h ARG 170 CO -0.02 0.62 -0.23 1.25 0.56 0.00 0.00 179.97 182.15 1d1d h LEU 171 N 0.97 0.43 -1.30 3.04 6.46 -0.18 -1.14 115.31 123.58 1d1d h LEU 171 Ca 0.32 -0.54 0.01 0.00 -0.12 0.00 0.00 57.88 57.54 1d1d h LEU 171 Cb 0.05 -0.12 -0.04 0.00 -0.73 0.00 0.00 40.66 39.83 1d1d h LEU 171 CO -0.09 0.89 0.47 0.40 -0.62 0.00 0.00 178.44 179.49 1d1d h ILE 172 N -0.02 1.18 -0.46 4.05 2.04 0.51 0.44 117.51 125.26 1d1d h ILE 172 Ca 0.01 -0.33 -0.12 0.00 1.00 0.00 0.00 64.86 65.41 1d1d h ILE 172 Cb 0.81 0.13 -0.01 0.00 -0.74 0.00 0.00 36.82 37.01 1d1d h ILE 172 CO 0.05 0.18 -0.20 0.11 0.00 0.00 0.00 178.15 178.29 1d1d h LYS 173 N 0.97 0.93 -0.10 2.37 6.56 -0.15 0.40 116.57 127.55 1d1d h LYS 173 Ca 0.26 -0.38 -0.02 0.00 -1.06 0.00 0.00 60.65 59.45 1d1d h LYS 173 Cb -0.11 -0.04 -0.00 0.00 -0.57 0.00 0.00 32.23 31.51 1d1d h LYS 173 CO -0.06 1.04 -0.03 0.00 -2.06 0.00 0.00 179.45 178.35 1d1d h ALA 174 N 0.95 0.13 -0.21 3.86 0.00 0.08 -1.03 119.26 123.04 1d1d h ALA 174 Ca 0.11 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 1d1d h ALA 174 Cb 0.76 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 1d1d h ALA 174 CO 0.06 -0.13 0.11 0.28 0.00 0.00 0.00 179.25 179.57 1d1d h VAL 175 N -0.15 1.11 -0.62 0.00 2.07 -0.07 -1.78 116.25 116.81 1d1d h VAL 175 Ca 0.02 -0.31 0.10 0.00 0.82 0.00 0.00 66.70 67.33 1d1d h VAL 175 Cb 0.44 0.94 -0.04 0.00 -1.52 0.00 0.00 31.29 31.11 1d1d h VAL 175 CO 0.01 0.11 0.42 -0.33 0.02 0.00 0.00 177.57 177.80 1d1d h GLU 176 N 0.23 0.42 -1.00 1.57 5.08 -0.16 0.14 114.58 120.87 1d1d h GLU 176 Ca 0.07 -0.03 -0.50 0.00 -1.00 0.00 0.00 59.36 57.91 1d1d h GLU 176 Cb 0.08 -0.10 -0.30 0.00 0.50 0.00 0.00 28.75 28.93 1d1d h GLU 176 CO -0.01 0.28 0.63 0.41 -1.00 0.00 0.00 179.01 179.32 1d1d n GLY 177 N -1.51 4.39 3.45 -3.84 0.00 -0.40 -4.93 105.19 102.35 1d1d n GLY 177 Ca 0.10 -1.05 -0.22 0.00 0.00 0.00 0.00 46.02 44.86 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 -1.20 2.80 -0.90 1.61 1.04 0.50 -4.97 113.70 112.58 1d1d s SER 178 Ca 0.55 -1.24 -0.16 0.00 0.48 0.00 0.00 55.95 55.58 1d1d s SER 178 Cb 0.46 -0.18 0.18 0.00 0.10 0.00 0.00 66.02 66.58 1d1d s SER 178 CO 0.11 -0.39 0.98 -1.81 0.98 0.00 0.00 173.24 173.10 1d1d s ASP 179 N -3.48 6.73 0.20 7.02 1.01 -1.26 -4.99 116.67 121.90 1d1d s ASP 179 Ca 0.31 -2.41 0.09 0.00 0.71 0.00 0.00 52.55 51.26 1d1d s ASP 179 Cb 0.05 -2.31 -0.04 0.00 1.01 0.00 0.00 42.92 41.63 1d1d s ASP 179 CO 0.13 -0.81 -0.18 -0.76 0.21 0.00 0.00 175.17 173.75 1d1d s LEU 180 N 1.42 2.49 0.81 1.23 1.43 -1.26 -5.15 118.68 119.66 1d1d s LEU 180 Ca 0.27 -0.93 -0.12 0.00 -1.03 0.00 0.00 54.13 52.32 1d1d s LEU 180 Cb -0.07 -0.88 0.08 0.00 0.03 0.00 0.00 46.19 45.35 1d1d s LEU 180 CO -0.09 -0.03 1.10 -2.16 0.23 0.00 0.00 176.35 175.40 1d1d s PRO 181 N -3.09 1.95 -1.20 1.29 0.04 -1.26 -4.91 135.00 127.82 1d1d s PRO 181 Ca 0.20 0.59 -0.20 0.00 0.04 0.00 0.00 61.00 61.63 1d1d s PRO 181 Cb -0.05 -1.91 -0.02 0.00 0.04 0.00 0.00 34.50 32.56 1d1d s PRO 181 CO 0.08 -1.70 1.90 -0.35 0.04 0.00 0.00 177.00 176.98 1d1d n PRO 182 N -3.48 2.34 0.00 0.56 -0.04 -1.26 -2.33 135.00 130.79 1d1d n PRO 182 Ca 0.07 -2.68 0.00 0.00 -0.04 0.00 0.00 63.50 60.84 1d1d n PRO 182 Cb 0.57 -3.46 0.00 0.00 -0.04 0.00 0.00 33.50 30.57 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 9.99 0.00 0.04 3.54 7.64 -1.26 -4.94 113.62 128.63 1d1d n SER 183 Ca 0.48 0.00 0.13 0.00 1.01 0.00 0.00 58.87 60.50 1d1d n SER 183 Cb 0.44 0.00 0.53 0.00 -1.01 0.00 0.00 64.21 64.18 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 2.29 -2.11 -0.43 0.00 -0.98 -4.12 120.51 115.16 1d1d n ALA 184 Ca 0.00 -0.07 -0.42 0.00 0.00 0.00 0.00 53.44 52.95 1d1d n ALA 184 Cb 0.00 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 17.99 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 -1.80 3.67 0.00 0.00 1.74 -1.24 -2.63 116.66 116.41 1d1d n ARG 185 Ca 0.06 -3.28 0.00 0.00 -0.77 0.00 0.00 57.85 53.86 1d1d n ARG 185 Cb 0.37 -2.92 0.00 0.00 -1.02 0.00 0.00 32.46 28.89 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 3.83 0.00 0.15 7.54 0.00 -1.26 -4.91 120.51 125.86 1d1d n ALA 186 Ca 0.48 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.94 1d1d n ALA 186 Cb 0.34 0.00 0.18 0.00 0.00 0.00 0.00 19.45 19.97 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 -0.40 0.00 0.13 -1.72 -2.17 132.00 127.85 1d1d h PRO 187 Ca 0.00 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.02 1d1d h PRO 187 Cb 0.00 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.12 1d1d h PRO 187 CO 0.00 0.52 -0.17 0.28 -0.23 0.00 0.00 178.00 178.40 1d1d h VAL 188 N 0.00 1.28 -0.11 1.56 2.07 -1.81 1.24 116.25 120.48 1d1d h VAL 188 Ca -0.01 -1.29 -0.03 0.00 0.82 0.00 0.00 66.70 66.19 1d1d h VAL 188 Cb 1.15 1.27 -0.00 0.00 -1.52 0.00 0.00 31.29 32.19 1d1d h VAL 188 CO 0.07 0.43 -0.06 0.40 0.02 0.00 0.00 177.57 178.43 1d1d h ILE 189 N 0.63 1.32 -0.45 4.57 2.04 -1.76 0.45 117.51 124.31 1d1d h ILE 189 Ca 0.09 -1.10 -0.10 0.00 1.00 0.00 0.00 64.86 64.75 1d1d h ILE 189 Cb 0.71 1.83 -0.02 0.00 -0.74 0.00 0.00 36.82 38.60 1d1d h ILE 189 CO 0.05 0.31 -0.11 0.40 0.00 0.00 0.00 178.15 178.81 1d1d h ILE 190 N -0.13 1.26 -0.49 -0.67 2.04 -1.34 -2.11 117.51 116.07 1d1d h ILE 190 Ca 0.02 -1.19 -0.12 0.00 1.00 0.00 0.00 64.86 64.57 1d1d h ILE 190 Cb 0.52 1.03 -0.01 0.00 -0.74 0.00 0.00 36.82 37.62 1d1d h ILE 190 CO 0.02 0.41 -0.16 -0.78 0.00 0.00 0.00 178.15 177.63 1d1d h ASP 191 N 0.74 1.00 -0.79 1.72 3.58 0.17 -2.50 116.42 120.33 1d1d h ASP 191 Ca 0.12 -0.38 0.07 0.00 0.42 0.00 0.00 57.03 57.27 1d1d h ASP 191 Cb 0.61 -0.27 -0.06 0.00 1.72 0.00 0.00 39.33 41.32 1d1d h ASP 191 CO 0.04 1.15 0.47 0.00 -2.88 0.00 0.00 179.24 178.01 1d1d h PHE 193 N 0.83 -0.10 -0.22 0.00 0.04 -1.07 0.10 116.94 116.54 1d1d h PHE 193 Ca 0.36 0.01 0.00 0.00 2.80 0.00 0.00 57.97 61.14 1d1d h PHE 193 Cb 0.24 0.05 0.00 0.00 2.20 0.00 0.00 35.95 38.43 1d1d h PHE 193 CO -0.05 -0.06 0.00 2.89 -0.60 0.00 0.00 178.31 180.48 1d1d n ARG 194 N -5.15 1.79 0.00 1.51 1.85 -0.72 -0.46 116.66 115.48 1d1d n ARG 194 Ca -0.06 -0.90 0.00 0.00 -1.00 0.00 0.00 57.85 55.90 1d1d n ARG 194 Cb 0.09 -1.38 -0.00 0.00 -1.05 0.00 0.00 32.46 30.11 1d1d n ARG 194 CO 0.00 0.00 0.00 0.94 -0.01 0.00 0.00 177.63 178.56 1d1d n GLN 195 N 0.19 2.77 0.17 2.89 0.00 0.21 -4.89 117.38 118.71 1d1d n GLN 195 Ca 0.08 -0.27 0.00 0.00 -0.00 0.00 0.00 57.00 56.81 1d1d n GLN 195 Cb 0.32 -0.77 0.00 0.00 0.00 0.00 0.00 30.24 29.79 1d1d n GLN 195 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.06 178.23 1d1d n LYS 196 N -0.47 0.00 -0.99 3.69 3.00 0.22 -4.99 118.16 118.63 1d1d n LYS 196 Ca 0.00 0.00 -0.32 0.00 -0.00 0.00 0.00 58.31 57.99 1d1d n LYS 196 Cb 0.00 0.00 0.02 0.00 0.00 0.00 0.00 35.03 35.05 1d1d n LYS 196 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 1d1d n SER 197 N -3.40 -3.88 -4.11 3.14 3.41 0.40 -4.80 113.62 104.37 1d1d n SER 197 Ca 0.00 0.41 -0.36 0.00 -0.26 0.00 0.00 58.87 58.66 1d1d n SER 197 Cb 0.00 -0.70 0.09 0.00 -0.26 0.00 0.00 64.21 63.35 1d1d n SER 197 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1d1d n GLN 198 N 1.60 -0.72 0.07 4.33 3.00 -1.26 -4.55 117.38 119.85 1d1d n GLN 198 Ca 0.04 -0.20 -0.09 0.00 -0.01 0.00 0.00 57.00 56.73 1d1d n GLN 198 Cb 0.43 -1.30 0.01 0.00 0.00 0.00 0.00 30.24 29.38 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 -1.48 0.29 0.05 -1.09 0.13 -1.96 -0.43 132.00 127.51 1d1d h PRO 199 Ca -0.45 -0.28 -0.00 0.00 -0.87 0.00 0.00 66.00 64.40 1d1d h PRO 199 Cb 1.37 0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.57 1d1d h PRO 199 CO 0.28 0.96 -0.02 0.38 -0.23 0.00 0.00 178.00 179.37 1d1d h ASP 200 N 0.18 -0.06 -0.08 1.44 3.04 -1.99 1.04 116.42 120.00 1d1d h ASP 200 Ca -0.04 -0.08 -0.13 0.00 -3.24 0.00 0.00 57.03 53.54 1d1d h ASP 200 Cb 1.43 0.01 -0.01 0.00 -1.04 0.00 0.00 39.33 39.72 1d1d h ASP 200 CO 0.13 0.04 -0.37 0.40 -2.04 0.00 0.00 179.24 177.40 1d1d h ILE 201 N -0.15 1.29 -0.52 4.15 1.08 -1.90 -2.60 117.51 118.86 1d1d h ILE 201 Ca -0.01 -1.51 -0.10 0.00 -0.39 0.00 0.00 64.86 62.85 1d1d h ILE 201 Cb 0.13 1.49 -0.02 0.00 -3.07 0.00 0.00 36.82 35.35 1d1d h ILE 201 CO 0.01 0.48 -0.08 -0.61 -0.69 0.00 0.00 178.15 177.26 1d1d h GLN 202 N 0.49 0.95 -0.70 2.37 4.15 -0.71 -2.44 115.11 119.23 1d1d h GLN 202 Ca 0.05 -0.33 -0.02 0.00 0.77 0.00 0.00 58.65 59.12 1d1d h GLN 202 Cb 0.86 -0.07 -0.03 0.00 0.21 0.00 0.00 27.48 28.45 1d1d h GLN 202 CO 0.07 0.99 0.35 1.96 -1.93 0.00 0.00 178.83 180.28 1d1d h GLN 203 N 0.86 0.98 -0.48 1.69 1.08 0.14 0.41 115.11 119.78 1d1d h GLN 203 Ca 0.14 -0.12 -0.03 0.00 -1.45 0.00 0.00 58.65 57.19 1d1d h GLN 203 Cb 0.62 -0.19 -0.02 0.00 -0.05 0.00 0.00 27.48 27.84 1d1d h GLN 203 CO 0.04 0.74 0.17 1.25 -0.95 0.00 0.00 178.83 180.08 1d1d h LEU 204 N 0.98 0.69 -0.26 1.46 6.46 -1.14 0.35 115.31 123.85 1d1d h LEU 204 Ca 0.24 -0.19 -0.06 0.00 -0.12 0.00 0.00 57.88 57.75 1d1d h LEU 204 Cb 0.07 -0.18 -0.01 0.00 -0.73 0.00 0.00 40.66 39.81 1d1d h LEU 204 CO -0.04 0.70 -0.08 0.40 -0.62 0.00 0.00 178.44 178.80 1d1d h ILE 205 N 0.64 1.29 -0.36 4.05 2.04 -0.93 0.04 117.51 124.28 1d1d h ILE 205 Ca 0.16 -1.12 -0.02 0.00 1.00 0.00 0.00 64.86 64.88 1d1d h ILE 205 Cb 0.24 1.47 -0.02 0.00 -0.74 0.00 0.00 36.82 37.78 1d1d h ILE 205 CO -0.01 0.35 0.15 0.03 0.00 0.00 0.00 178.15 178.68 1d1d h ARG 206 N 0.27 0.50 -0.16 2.37 2.47 0.03 0.15 114.38 120.01 1d1d h ARG 206 Ca 0.06 -0.06 0.00 0.00 -1.26 0.00 0.00 59.98 58.73 1d1d h ARG 206 Cb 0.57 -0.10 0.00 0.00 -1.65 0.00 0.00 29.97 28.79 1d1d h ARG 206 CO 0.03 0.41 0.00 0.00 0.56 0.00 0.00 179.97 180.97 1d1d n ALA 207 N -2.48 2.52 -0.77 0.04 0.00 0.12 -4.93 120.51 115.01 1d1d n ALA 207 Ca 0.02 -0.53 -0.31 0.00 0.00 0.00 0.00 53.44 52.62 1d1d n ALA 207 Cb 0.13 -1.09 0.16 0.00 0.00 0.00 0.00 19.45 18.65 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 -1.79 1.57 0.59 0.00 0.00 0.52 -4.98 121.76 117.67 1d1d s ALA 208 Ca 0.32 0.58 -0.15 0.00 0.00 0.00 0.00 51.96 52.71 1d1d s ALA 208 Cb 0.18 -3.44 -0.04 0.00 0.00 0.00 0.00 23.12 19.82 1d1d s ALA 208 CO 0.26 -2.64 1.05 -1.25 0.00 0.00 0.00 175.76 173.18 1d1d s PRO 209 N -4.64 3.35 -0.09 0.00 0.04 -1.26 -4.94 135.00 127.47 1d1d s PRO 209 Ca 0.67 1.15 0.07 0.00 0.04 0.00 0.00 61.00 62.93 1d1d s PRO 209 Cb -0.23 -2.04 0.36 0.00 0.04 0.00 0.00 34.50 32.64 1d1d s PRO 209 CO 0.57 -0.78 1.10 0.43 0.04 0.00 0.00 177.00 178.37 1d1d n SER 210 N -2.08 2.92 -0.00 6.66 7.64 -1.26 -3.40 113.62 124.09 1d1d n SER 210 Ca 0.08 -2.35 0.08 0.00 1.01 0.00 0.00 58.87 57.70 1d1d n SER 210 Cb 0.53 -0.52 -0.09 0.00 -1.01 0.00 0.00 64.21 63.12 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 0.00 -3.87 0.44 -1.04 -1.26 -4.95 114.28 103.93 1d1d n THR 211 Ca 0.12 -0.11 -0.12 0.00 -2.04 0.00 0.00 64.05 61.90 1d1d n THR 211 Cb 0.61 0.99 -0.14 0.00 -1.82 0.00 0.00 70.33 69.97 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 -2.80 1.94 -0.37 -4.42 0.05 -1.22 -5.04 118.68 106.82 1d1d s LEU 212 Ca 0.06 0.02 0.11 0.00 0.05 0.00 0.00 54.13 54.37 1d1d s LEU 212 Cb 0.13 0.06 0.40 0.00 -2.05 0.00 0.00 46.19 44.72 1d1d s LEU 212 CO 0.68 -0.01 1.44 0.35 -0.55 0.00 0.00 176.35 178.26 1d1d n THR 213 N 3.03 0.00 -4.40 5.48 -2.24 -1.26 -4.72 114.28 110.18 1d1d n THR 213 Ca -0.12 -1.27 -0.22 0.00 -2.27 0.00 0.00 64.05 60.16 1d1d n THR 213 Cb 0.60 1.00 -0.11 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 0.17 2.10 -0.64 4.28 -4.23 -1.26 -4.32 115.64 111.73 1d1d s THR 214 Ca 0.16 -2.18 -0.06 0.00 -1.18 0.00 0.00 61.69 58.43 1d1d s THR 214 Cb 0.42 -2.09 -0.13 0.00 1.34 0.00 0.00 72.50 72.04 1d1d s THR 214 CO -0.11 -0.39 2.66 -0.81 -0.54 0.00 0.00 174.62 175.43 1d1d n PRO 215 N -0.20 2.18 0.21 3.99 -0.04 -1.26 -2.70 135.00 137.17 1d1d n PRO 215 Ca -0.09 -1.29 0.00 0.00 -0.04 0.00 0.00 63.50 62.08 1d1d n PRO 215 Cb 0.59 -2.26 0.00 0.00 -0.04 0.00 0.00 33.50 31.79 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 3.18 -1.53 0.12 0.55 0.00 -1.26 -4.90 105.19 101.35 1d1d n GLY 216 Ca 0.46 0.29 -0.03 0.00 0.00 0.00 0.00 46.02 46.74 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 0.03 -0.40 1.61 3.07 -1.97 -0.80 114.58 116.11 1d1d h GLU 217 Ca 0.00 -0.02 -0.03 0.00 -0.50 0.00 0.00 59.36 58.81 1d1d h GLU 217 Cb 0.00 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 27.90 1d1d h GLU 217 CO 0.00 0.71 0.13 0.82 -1.40 0.00 0.00 179.01 179.27 1d1d h ILE 218 N 0.02 1.21 0.01 3.13 5.03 -1.87 0.43 117.51 125.47 1d1d h ILE 218 Ca -0.01 -0.70 -0.00 0.00 -0.12 0.00 0.00 64.86 64.03 1d1d h ILE 218 Cb 1.24 0.92 0.00 0.00 -3.03 0.00 0.00 36.82 35.94 1d1d h ILE 218 CO 0.09 0.25 -0.00 0.40 -0.68 0.00 0.00 178.15 178.21 1d1d h ILE 219 N 0.50 1.41 -0.45 -0.67 2.04 -1.78 -1.26 117.51 117.31 1d1d h ILE 219 Ca 0.13 -1.27 0.10 0.00 1.00 0.00 0.00 64.86 64.82 1d1d h ILE 219 Cb 0.25 2.27 -0.02 0.00 -0.74 0.00 0.00 36.82 38.59 1d1d h ILE 219 CO -0.00 0.33 0.31 0.50 0.00 0.00 0.00 178.15 179.28 1d1d h LYS 220 N -0.56 0.14 -0.02 2.37 3.64 -1.07 0.28 116.57 121.35 1d1d h LYS 220 Ca -0.00 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.35 1d1d h LYS 220 Cb 0.55 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.33 1d1d h LYS 220 CO 0.00 0.09 -0.06 -0.92 -2.27 0.00 0.00 179.45 176.30 1d1d h TYR 221 N 0.15 0.10 0.10 1.91 3.20 0.02 0.39 116.97 122.84 1d1d h TYR 221 Ca 0.21 -0.04 -0.00 0.00 3.14 0.00 0.00 58.73 62.04 1d1d h TYR 221 Cb 0.64 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 38.89 1d1d h TYR 221 CO -0.00 0.66 -0.05 0.28 -1.64 0.00 0.00 178.16 177.41 1d1d h VAL 222 N -0.48 0.94 -0.92 1.81 2.07 -0.19 0.40 116.25 119.88 1d1d h VAL 222 Ca -0.00 -0.11 0.02 0.00 0.82 0.00 0.00 66.70 67.43 1d1d h VAL 222 Cb 0.65 1.01 -0.05 0.00 -1.52 0.00 0.00 31.29 31.39 1d1d h VAL 222 CO 0.01 0.03 0.61 -0.07 0.02 0.00 0.00 177.57 178.17 1d1d h LEU 223 N -0.18 1.03 -0.87 2.57 3.38 -0.57 0.42 115.31 121.10 1d1d h LEU 223 Ca -0.01 -0.02 -0.08 0.00 0.09 0.00 0.00 57.88 57.86 1d1d h LEU 223 Cb 0.14 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 1d1d h LEU 223 CO 0.02 0.72 -0.03 -0.78 0.09 0.00 0.00 178.44 178.46 1d1d h ASP 224 N 1.20 0.78 -0.29 -0.43 3.58 -0.35 -2.53 116.42 118.39 1d1d h ASP 224 Ca 0.35 -0.20 -0.16 0.00 0.42 0.00 0.00 57.03 57.44 1d1d h ASP 224 Cb -0.06 -0.21 -0.00 0.00 1.72 0.00 0.00 39.33 40.78 1d1d h ASP 224 CO -0.09 0.87 -0.43 -0.09 -2.88 0.00 0.00 179.24 176.61 1d1d h ARG 225 N 0.75 0.80 -0.45 0.28 9.65 0.13 -3.17 114.38 122.36 1d1d h ARG 225 Ca 0.14 -0.48 0.09 0.00 -1.10 0.00 0.00 59.98 58.63 1d1d h ARG 225 Cb 0.50 0.04 -0.07 0.00 -1.39 0.00 0.00 29.97 29.05 1d1d h ARG 225 CO 0.03 1.11 -0.00 1.96 2.80 0.00 0.00 179.97 185.86 1d1d h GLN 226 N 0.56 0.11 0.00 0.20 4.20 0.06 -3.47 115.11 116.76 1d1d h GLN 226 Ca 0.03 -0.01 0.19 0.00 0.06 0.00 0.00 58.65 58.92 1d1d h GLN 226 Cb 1.03 -0.02 -0.05 0.00 0.30 0.00 0.00 27.48 28.74 1d1d h GLN 226 CO 0.10 0.07 -0.25 1.17 -0.67 0.00 0.00 178.83 179.25 1d1d n LYS 227 N -5.22 -1.41 0.01 1.46 4.81 -0.98 -4.54 118.16 112.29 1d1d n LYS 227 Ca 0.04 0.93 -0.22 0.00 -0.87 0.00 0.00 58.31 58.19 1d1d n LYS 227 Cb 0.24 -1.72 -0.14 0.00 0.02 0.00 0.00 35.03 33.43 1d1d n LYS 227 CO 0.00 0.00 0.00 -0.84 1.17 0.00 0.00 177.40 177.73 1d1d h ILE 228 N -0.65 0.67 -1.98 3.15 3.07 -1.91 -3.51 117.51 116.35 1d1d h ILE 228 Ca 0.01 -2.35 0.12 0.00 1.55 0.00 0.00 64.86 64.19 1d1d h ILE 228 Cb 0.64 2.53 -0.07 0.00 -0.27 0.00 0.00 36.82 39.65 1d1d h ILE 228 CO 0.00 0.88 -0.64 0.00 -1.05 0.00 0.00 178.15 177.35 1d1d n ALA 229 N -3.00 -1.78 1.50 0.16 0.00 -1.26 -5.29 120.51 110.84 1d1d n ALA 229 Ca -0.31 0.42 0.12 0.00 0.00 0.00 0.00 53.44 53.67 1d1d n ALA 229 Cb 1.04 -0.94 0.71 0.00 0.00 0.00 0.00 19.45 20.26 1d1d n ALA 229 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15