#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 0.71 0.08 5.87 2.01 -1.26 -5.12 115.64 117.93 1d1d s THR 12 Ca 0.00 -0.26 -0.30 0.00 0.31 0.00 0.00 61.69 61.43 1d1d s THR 12 Cb 0.00 -0.68 -0.06 0.00 0.01 0.00 0.00 72.50 71.77 1d1d s THR 12 CO 0.00 0.25 1.16 -2.16 -0.69 0.00 0.00 174.62 173.18 1d1d s PRO 13 N 0.60 4.48 -0.57 4.92 0.04 -1.26 -4.93 135.00 138.28 1d1d s PRO 13 Ca -0.09 1.73 -0.26 0.00 0.04 0.00 0.00 61.00 62.41 1d1d s PRO 13 Cb -0.12 -3.34 -0.05 0.00 0.04 0.00 0.00 34.50 31.02 1d1d s PRO 13 CO 0.01 -0.16 2.16 -1.17 0.04 0.00 0.00 177.00 177.87 1d1d s LEU 14 N 0.73 3.33 -0.13 -3.56 2.96 -1.26 -4.93 118.68 115.81 1d1d s LEU 14 Ca 0.56 0.66 -0.02 0.00 -0.22 0.00 0.00 54.13 55.11 1d1d s LEU 14 Cb -0.29 -2.52 -0.03 0.00 0.50 0.00 0.00 46.19 43.86 1d1d s LEU 14 CO 0.30 -2.71 -0.06 -0.70 -1.32 0.00 0.00 176.35 171.86 1d1d s GLU 15 N 7.73 3.39 0.21 1.98 2.56 -1.26 -5.00 118.70 128.31 1d1d s GLU 15 Ca 0.83 -0.56 0.07 0.00 0.00 0.00 0.00 54.97 55.32 1d1d s GLU 15 Cb -0.15 -2.78 0.13 0.00 2.00 0.00 0.00 34.13 33.34 1d1d s GLU 15 CO 0.22 0.34 1.48 -1.00 -0.56 0.00 0.00 175.26 175.74 1d1d h PRO 16 N 6.33 0.06 -0.12 4.30 0.13 -1.97 0.13 132.00 140.86 1d1d h PRO 16 Ca -0.34 -0.06 -0.06 0.00 -0.87 0.00 0.00 66.00 64.67 1d1d h PRO 16 Cb 1.19 0.02 -0.00 0.00 0.13 0.00 0.00 31.00 32.34 1d1d h PRO 16 CO 0.59 0.80 -0.17 1.57 -0.23 0.00 0.00 178.00 180.55 1d1d h LYS 17 N 0.04 0.32 -0.13 0.86 2.10 -1.98 0.70 116.57 118.48 1d1d h LYS 17 Ca -0.02 -0.19 -0.05 0.00 -2.00 0.00 0.00 60.65 58.40 1d1d h LYS 17 Cb 1.35 0.02 -0.00 0.00 -0.90 0.00 0.00 32.23 32.69 1d1d h LYS 17 CO 0.11 0.76 -0.11 -0.07 -2.00 0.00 0.00 179.45 178.14 1d1d h LEU 18 N -0.10 0.32 -1.33 7.07 3.38 -1.97 -1.52 115.31 121.17 1d1d h LEU 18 Ca 0.01 -0.46 0.05 0.00 0.09 0.00 0.00 57.88 57.57 1d1d h LEU 18 Cb 0.73 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.34 1d1d h LEU 18 CO 0.04 0.72 0.49 0.40 0.09 0.00 0.00 178.44 180.18 1d1d h ILE 19 N -0.07 1.07 -0.52 1.22 2.04 -0.78 0.18 117.51 120.65 1d1d h ILE 19 Ca 0.02 -0.29 -0.11 0.00 1.00 0.00 0.00 64.86 65.48 1d1d h ILE 19 Cb 0.62 0.15 -0.02 0.00 -0.74 0.00 0.00 36.82 36.84 1d1d h ILE 19 CO 0.03 0.15 -0.13 0.74 0.00 0.00 0.00 178.15 178.94 1d1d h THR 20 N 0.84 1.27 -0.04 -0.27 2.02 -0.67 0.69 112.91 116.75 1d1d h THR 20 Ca 0.31 -1.28 -0.01 0.00 0.77 0.00 0.00 66.41 66.20 1d1d h THR 20 Cb 0.16 1.01 -0.00 0.00 -1.74 0.00 0.00 68.15 67.57 1d1d h THR 20 CO -0.10 0.45 -0.01 0.03 0.37 0.00 0.00 175.52 176.26 1d1d h ARG 21 N 0.87 0.08 -0.46 6.66 3.08 -0.09 0.28 114.38 124.80 1d1d h ARG 21 Ca 0.13 -0.03 -0.08 0.00 0.07 0.00 0.00 59.98 60.07 1d1d h ARG 21 Cb 0.69 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.72 1d1d h ARG 21 CO 0.05 0.42 -0.03 1.25 -1.07 0.00 0.00 179.97 180.59 1d1d h LEU 22 N -0.27 0.81 -1.45 3.04 6.46 -0.67 -2.32 115.31 120.91 1d1d h LEU 22 Ca 0.01 -0.32 -0.04 0.00 -0.12 0.00 0.00 57.88 57.40 1d1d h LEU 22 Cb 0.39 -0.22 -0.01 0.00 -0.73 0.00 0.00 40.66 40.09 1d1d h LEU 22 CO 0.00 0.94 -0.11 0.00 -0.62 0.00 0.00 178.44 178.65 1d1d h ALA 23 N 0.90 1.55 -0.24 1.25 0.00 0.45 -1.96 119.26 121.21 1d1d h ALA 23 Ca 0.13 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1d1d h ALA 23 Cb 0.54 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1d1d h ALA 23 CO 0.03 0.32 0.14 0.22 0.00 0.00 0.00 179.25 179.96 1d1d h ASP 24 N 0.21 0.30 -0.62 0.00 1.82 0.10 -1.69 116.42 116.54 1d1d h ASP 24 Ca 0.04 -0.08 -0.02 0.00 -0.39 0.00 0.00 57.03 56.58 1d1d h ASP 24 Cb 0.34 -0.08 -0.03 0.00 0.68 0.00 0.00 39.33 40.24 1d1d h ASP 24 CO 0.02 0.29 0.31 0.74 -1.61 0.00 0.00 179.24 178.99 1d1d h THR 25 N 0.29 1.21 -0.53 2.25 2.02 -1.00 0.21 112.91 117.36 1d1d h THR 25 Ca 0.09 -0.60 0.03 0.00 0.77 0.00 0.00 66.41 66.70 1d1d h THR 25 Cb 0.05 0.39 -0.04 0.00 -1.74 0.00 0.00 68.15 66.82 1d1d h THR 25 CO -0.01 0.25 0.31 0.58 0.37 0.00 0.00 175.52 177.01 1d1d h VAL 26 N 0.91 1.03 -0.05 3.16 2.07 -0.80 1.71 116.25 124.27 1d1d h VAL 26 Ca 0.22 -0.21 -0.01 0.00 0.82 0.00 0.00 66.70 67.53 1d1d h VAL 26 Cb 0.10 0.37 -0.00 0.00 -1.52 0.00 0.00 31.29 30.24 1d1d h VAL 26 CO -0.03 0.11 -0.01 -0.09 0.02 0.00 0.00 177.57 177.57 1d1d h ARG 27 N 0.60 0.11 0.00 1.57 2.43 -0.69 0.55 114.38 118.94 1d1d h ARG 27 Ca 0.22 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.35 1d1d h ARG 27 Cb 0.06 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.60 1d1d h ARG 27 CO -0.11 0.44 0.00 1.79 -1.51 0.00 0.00 179.97 180.58 1d1d h THR 28 N -0.24 0.00 0.00 0.20 1.35 -0.61 -1.31 112.91 112.30 1d1d h THR 28 Ca 0.01 -0.38 0.00 0.00 -0.55 0.00 0.00 66.41 65.49 1d1d h THR 28 Cb 0.40 1.34 0.00 0.00 -1.73 0.00 0.00 68.15 68.17 1d1d h THR 28 CO 0.01 0.00 -1.11 0.29 -0.25 0.00 0.00 175.52 174.46 1d1d n LYS 29 N -2.98 0.29 -0.48 4.72 4.76 0.58 -5.05 118.16 120.00 1d1d n LYS 29 Ca 0.00 -0.02 0.00 0.00 -2.87 0.00 0.00 58.31 55.42 1d1d n LYS 29 Cb 0.25 -1.58 0.00 0.00 -1.84 0.00 0.00 35.03 31.86 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 1.37 -3.72 0.23 0.72 0.00 0.19 -4.09 105.19 99.89 1d1d n GLY 30 Ca 0.02 -0.86 0.16 0.00 0.00 0.00 0.00 46.02 45.33 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 0.74 0.00 -0.85 0.99 3.38 -1.83 -0.20 115.31 117.54 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 -2.73 1.57 -3.99 1.13 5.12 -1.26 -4.83 116.66 111.67 1d1d n ARG 32 Ca 0.00 -0.84 -0.33 0.00 -1.93 0.00 0.00 57.85 54.75 1d1d n ARG 32 Cb 0.22 -1.41 -0.06 0.00 -1.16 0.00 0.00 32.46 30.05 1d1d n ARG 32 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 1d1d s SER 33 N -1.71 6.07 -0.57 0.55 0.15 -0.09 -4.98 113.70 113.11 1d1d s SER 33 Ca 0.34 0.26 -0.06 0.00 0.70 0.00 0.00 55.95 57.19 1d1d s SER 33 Cb 0.18 -1.84 -0.14 0.00 -1.71 0.00 0.00 66.02 62.51 1d1d s SER 33 CO 0.28 0.27 2.67 -0.81 1.20 0.00 0.00 173.24 176.85 1d1d n PRO 34 N 1.05 2.10 0.00 5.44 -0.04 -1.26 -2.88 135.00 139.40 1d1d n PRO 34 Ca -0.12 -1.23 0.00 0.00 -0.04 0.00 0.00 63.50 62.11 1d1d n PRO 34 Cb 0.53 -2.21 0.00 0.00 -0.04 0.00 0.00 33.50 31.77 1d1d n PRO 34 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 1d1d n ILE 35 N 3.24 0.00 -0.28 0.52 5.41 -1.26 -4.78 119.36 122.21 1d1d n ILE 35 Ca 0.45 0.00 -0.00 0.00 1.00 0.00 0.00 62.75 64.20 1d1d n ILE 35 Cb 0.45 -0.06 0.12 0.00 -0.71 0.00 0.00 39.64 39.44 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 1.02 -0.52 1.39 2.02 -1.72 0.64 112.91 115.74 1d1d h THR 36 Ca 0.00 -0.30 -0.01 0.00 0.77 0.00 0.00 66.41 66.87 1d1d h THR 36 Cb 0.00 0.07 -0.02 0.00 -1.74 0.00 0.00 68.15 66.46 1d1d h THR 36 CO 0.00 0.16 0.29 0.24 0.37 0.00 0.00 175.52 176.58 1d1d h MET 37 N 0.87 0.72 -0.28 6.66 2.86 -1.89 0.41 114.93 124.29 1d1d h MET 37 Ca 0.35 -0.08 -0.09 0.00 -2.06 0.00 0.00 59.70 57.82 1d1d h MET 37 Cb 0.17 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 31.68 1d1d h MET 37 CO -0.17 0.55 -0.17 0.00 1.06 0.00 0.00 176.91 178.18 1d1d h ALA 38 N 1.13 0.40 -0.26 6.32 0.00 -1.66 -0.23 119.26 124.96 1d1d h ALA 38 Ca 0.18 -0.34 0.01 0.00 0.00 0.00 0.00 54.91 54.76 1d1d h ALA 38 Cb 0.04 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1d1d h ALA 38 CO -0.03 0.31 0.16 0.93 0.00 0.00 0.00 179.25 180.62 1d1d h GLU 39 N 0.34 0.32 -0.38 0.00 5.08 0.54 0.26 114.58 120.74 1d1d h GLU 39 Ca 0.06 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 1d1d h GLU 39 Cb 0.70 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.86 1d1d h GLU 39 CO 0.05 0.21 0.21 0.28 -1.00 0.00 0.00 179.01 178.76 1d1d h VAL 40 N 0.33 1.14 0.00 3.13 2.07 -0.13 -1.03 116.25 121.76 1d1d h VAL 40 Ca 0.10 -0.35 -0.02 0.00 0.82 0.00 0.00 66.70 67.25 1d1d h VAL 40 Cb -0.02 0.69 -0.00 0.00 -1.52 0.00 0.00 31.29 30.43 1d1d h VAL 40 CO -0.03 0.14 -0.07 -0.33 0.02 0.00 0.00 177.57 177.30 1d1d h GLU 41 N 0.49 0.00 0.43 1.57 5.08 -0.60 0.48 114.58 122.02 1d1d h GLU 41 Ca 0.13 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.47 1d1d h GLU 41 Cb 0.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.29 1d1d h GLU 41 CO -0.02 0.07 -0.20 0.00 -1.00 0.00 0.00 179.01 177.86 1d1d h ALA 42 N 1.93 -0.57 -0.11 3.43 0.00 0.85 1.65 119.26 126.43 1d1d h ALA 42 Ca -0.00 -0.18 -0.12 0.00 0.00 0.00 0.00 54.91 54.62 1d1d h ALA 42 Cb 0.24 0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1d1d h ALA 42 CO 0.01 -0.71 -0.38 1.37 0.00 0.00 0.00 179.25 179.53 1d1d h LEU 43 N -0.79 0.53 0.00 0.00 8.10 -1.15 -2.90 115.31 119.10 1d1d h LEU 43 Ca -0.06 -0.61 0.00 0.00 0.11 0.00 0.00 57.88 57.32 1d1d h LEU 43 Cb 0.54 -0.16 0.00 0.00 -0.44 0.00 0.00 40.66 40.61 1d1d h LEU 43 CO 0.10 1.05 0.00 0.23 -4.11 0.00 0.00 178.44 175.71 1d1d n MET 44 N -4.33 0.06 -0.58 0.17 2.81 0.17 -3.58 117.12 111.83 1d1d n MET 44 Ca -0.08 0.16 0.45 0.00 -1.81 0.00 0.00 57.70 56.43 1d1d n MET 44 Cb 0.53 -1.50 0.70 0.00 -0.71 0.00 0.00 33.22 32.24 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 -1.45 0.06 -4.94 7.83 2.88 0.56 -4.25 113.62 114.30 1d1d n SER 45 Ca 0.05 1.00 -0.20 0.00 -1.33 0.00 0.00 58.87 58.39 1d1d n SER 45 Cb 0.20 -0.49 -0.01 0.00 -0.75 0.00 0.00 64.21 63.15 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 -4.00 5.74 0.28 -3.46 1.04 -1.23 -5.06 113.70 107.00 1d1d s SER 46 Ca -0.05 -0.29 -0.29 0.00 0.48 0.00 0.00 55.95 55.79 1d1d s SER 46 Cb 0.25 -1.14 -0.09 0.00 0.10 0.00 0.00 66.02 65.14 1d1d s SER 46 CO 0.78 -0.41 1.08 -2.16 0.98 0.00 0.00 173.24 173.51 1d1d s PRO 47 N -4.11 4.65 0.28 4.02 0.04 -1.26 -4.94 135.00 133.68 1d1d s PRO 47 Ca 0.44 1.76 0.03 0.00 0.04 0.00 0.00 61.00 63.27 1d1d s PRO 47 Cb -0.08 -3.18 -0.04 0.00 0.04 0.00 0.00 34.50 31.24 1d1d s PRO 47 CO 0.30 0.24 0.19 -0.48 0.04 0.00 0.00 177.00 177.28 1d1d s LEU 48 N -1.45 1.52 0.58 -3.56 0.05 -1.26 -4.98 118.68 109.58 1d1d s LEU 48 Ca 0.44 -1.57 -0.08 0.00 0.05 0.00 0.00 54.13 52.97 1d1d s LEU 48 Cb -0.31 0.38 -0.03 0.00 -2.05 0.00 0.00 46.19 44.18 1d1d s LEU 48 CO 0.40 -0.93 0.93 -0.76 -0.55 0.00 0.00 176.35 175.44 1d1d s LEU 49 N -3.30 3.33 0.20 1.48 1.43 -1.26 -4.69 118.68 115.87 1d1d s LEU 49 Ca 0.38 1.12 0.07 0.00 -1.03 0.00 0.00 54.13 54.67 1d1d s LEU 49 Cb 0.05 -4.07 0.12 0.00 0.03 0.00 0.00 46.19 42.31 1d1d s LEU 49 CO 0.19 -0.85 1.47 1.55 0.23 0.00 0.00 176.35 178.94 1d1d h PRO 50 N -0.15 0.09 0.14 1.29 0.13 -1.94 -1.68 132.00 129.88 1d1d h PRO 50 Ca -0.45 -0.09 -0.01 0.00 -0.87 0.00 0.00 66.00 64.58 1d1d h PRO 50 Cb 1.21 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1d1d h PRO 50 CO 0.62 0.82 -0.07 1.25 -0.23 0.00 0.00 178.00 180.39 1d1d h HIS 51 N 0.05 -0.18 -0.13 1.56 2.76 -1.94 -2.75 115.15 114.53 1d1d h HIS 51 Ca -0.02 -0.00 -0.04 0.00 -2.20 0.00 0.00 60.37 58.10 1d1d h HIS 51 Cb 1.36 0.06 -0.01 0.00 1.55 0.00 0.00 27.41 30.37 1d1d h HIS 51 CO 0.01 0.15 -0.12 0.38 -1.30 0.00 0.00 177.93 177.05 1d1d h ASP 52 N -0.52 0.19 -0.54 3.26 3.04 -1.97 -2.25 116.42 117.62 1d1d h ASP 52 Ca -0.02 -0.04 0.09 0.00 -3.24 0.00 0.00 57.03 53.82 1d1d h ASP 52 Cb 0.41 -0.05 -0.07 0.00 -1.04 0.00 0.00 39.33 38.58 1d1d h ASP 52 CO 0.03 0.34 0.15 0.58 -2.04 0.00 0.00 179.24 178.30 1d1d h VAL 53 N 0.20 0.74 -0.51 4.15 2.07 -1.08 0.41 116.25 122.22 1d1d h VAL 53 Ca 0.04 -0.10 -0.10 0.00 0.82 0.00 0.00 66.70 67.36 1d1d h VAL 53 Cb 0.34 0.41 -0.02 0.00 -1.52 0.00 0.00 31.29 30.51 1d1d h VAL 53 CO 0.02 0.06 -0.07 0.71 0.02 0.00 0.00 177.57 178.31 1d1d h THR 54 N 0.30 1.27 -0.63 2.57 1.35 -1.13 0.17 112.91 116.80 1d1d h THR 54 Ca 0.27 -1.19 0.03 0.00 -0.55 0.00 0.00 66.41 64.97 1d1d h THR 54 Cb 0.36 1.01 -0.04 0.00 -1.73 0.00 0.00 68.15 67.74 1d1d h THR 54 CO -0.32 0.42 0.39 -1.13 -0.25 0.00 0.00 175.52 174.62 1d1d h ASN 55 N 0.80 0.63 -0.08 5.36 -1.24 -0.75 0.51 115.58 120.81 1d1d h ASN 55 Ca 0.14 0.00 -0.02 0.00 0.71 0.00 0.00 56.30 57.13 1d1d h ASN 55 Cb 0.61 -0.13 -0.00 0.00 0.73 0.00 0.00 38.32 39.53 1d1d h ASN 55 CO 0.04 0.44 -0.04 0.25 -1.29 0.00 0.00 177.43 176.82 1d1d h LEU 56 N 0.76 0.18 -1.94 0.34 5.85 -0.03 -2.52 115.31 117.93 1d1d h LEU 56 Ca 0.26 -0.42 0.05 0.00 0.84 0.00 0.00 57.88 58.61 1d1d h LEU 56 Cb 0.03 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.00 1d1d h LEU 56 CO -0.11 0.56 0.15 0.24 -0.34 0.00 0.00 178.44 178.94 1d1d h MET 57 N -0.20 0.07 -0.23 1.25 2.86 -0.21 -0.04 114.93 118.43 1d1d h MET 57 Ca 0.02 -0.00 -0.14 0.00 -2.06 0.00 0.00 59.70 57.51 1d1d h MET 57 Cb 0.49 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.12 1d1d h MET 57 CO 0.01 0.05 -0.44 -0.09 1.06 0.00 0.00 176.91 177.50 1d1d h ARG 58 N 0.07 0.58 -0.31 1.72 2.43 0.23 1.85 114.38 120.95 1d1d h ARG 58 Ca 0.10 -0.31 -0.17 0.00 -0.81 0.00 0.00 59.98 58.78 1d1d h ARG 58 Cb 0.30 0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 29.87 1d1d h ARG 58 CO -0.01 0.91 -0.48 0.28 -1.51 0.00 0.00 179.97 179.16 1d1d h VAL 59 N 0.47 1.28 0.12 0.20 2.07 -0.63 -3.23 116.25 116.52 1d1d h VAL 59 Ca 0.03 -1.67 -0.19 0.00 0.82 0.00 0.00 66.70 65.70 1d1d h VAL 59 Cb 0.96 1.54 0.02 0.00 -1.52 0.00 0.00 31.29 32.29 1d1d h VAL 59 CO 0.09 0.55 -0.82 0.40 0.02 0.00 0.00 177.57 177.80 1d1d h ILE 60 N 0.67 1.48 -3.96 4.57 2.04 -1.04 -3.45 117.51 117.82 1d1d h ILE 60 Ca 0.03 -2.46 -0.69 0.00 1.00 0.00 0.00 64.86 62.75 1d1d h ILE 60 Cb 1.07 3.06 -0.28 0.00 -0.74 0.00 0.00 36.82 39.93 1d1d h ILE 60 CO 0.11 0.70 -0.83 -0.76 0.00 0.00 0.00 178.15 177.37 1d1d s LEU 61 N -7.96 2.36 0.00 1.44 1.02 0.63 -4.91 118.68 111.26 1d1d s LEU 61 Ca -0.13 -0.39 0.00 0.00 0.02 0.00 0.00 54.13 53.63 1d1d s LEU 61 Cb 0.02 -1.46 0.00 0.00 0.02 0.00 0.00 46.19 44.77 1d1d s LEU 61 CO 0.84 0.27 0.00 0.61 0.02 0.00 0.00 176.35 178.09 1d1d n GLY 62 N 2.81 -2.77 0.23 -3.19 0.00 -1.25 -3.56 105.19 97.46 1d1d n GLY 62 Ca -0.17 -1.39 0.14 0.00 0.00 0.00 0.00 46.02 44.60 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 0.34 1.61 0.13 -1.96 -0.88 132.00 131.24 1d1d h PRO 63 Ca 0.00 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.11 1d1d h PRO 63 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1d1d h PRO 63 CO 0.00 0.00 -0.16 0.00 -0.23 0.00 0.00 178.00 177.61 1d1d h ALA 64 N 2.06 -0.45 0.00 -0.56 0.00 -2.00 -3.19 119.26 115.12 1d1d h ALA 64 Ca 0.00 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 1d1d h ALA 64 Cb 0.72 0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.69 1d1d h ALA 64 CO 0.00 -0.53 -0.00 -1.00 0.00 0.00 0.00 179.25 177.72 1d1d h PRO 65 N -0.90 0.00 -0.76 0.00 0.13 -1.90 -3.21 132.00 125.36 1d1d h PRO 65 Ca -0.05 0.00 0.12 0.00 -0.87 0.00 0.00 66.00 65.21 1d1d h PRO 65 Cb 0.53 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 31.57 1d1d h PRO 65 CO 0.08 0.00 0.35 -0.92 -0.23 0.00 0.00 178.00 177.28 1d1d h TYR 66 N 0.00 0.62 -0.33 1.56 3.20 -1.14 0.83 116.97 121.71 1d1d h TYR 66 Ca -0.00 0.03 -0.08 0.00 3.14 0.00 0.00 58.73 61.82 1d1d h TYR 66 Cb 0.76 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.85 1d1d h TYR 66 CO 0.00 0.16 -0.15 0.00 -1.64 0.00 0.00 178.16 176.53 1d1d h ALA 67 N 1.50 1.13 -0.28 1.82 0.00 -1.59 1.16 119.26 123.00 1d1d h ALA 67 Ca 0.40 -0.30 -0.11 0.00 0.00 0.00 0.00 54.91 54.89 1d1d h ALA 67 Cb 0.52 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 1d1d h ALA 67 CO -0.34 0.55 -0.27 -0.07 0.00 0.00 0.00 179.25 179.12 1d1d h LEU 68 N 0.53 0.72 -0.37 0.00 4.07 -0.85 0.38 115.31 119.79 1d1d h LEU 68 Ca 0.09 -0.47 -0.18 0.00 0.08 0.00 0.00 57.88 57.40 1d1d h LEU 68 Cb 0.57 -0.20 -0.00 0.00 1.08 0.00 0.00 40.66 42.10 1d1d h LEU 68 CO 0.04 1.04 -0.55 -0.25 -1.08 0.00 0.00 178.44 177.64 1d1d h TRP 69 N 0.41 0.97 -0.32 1.13 7.01 0.86 -0.67 115.95 125.34 1d1d h TRP 69 Ca 0.05 -0.35 -0.09 0.00 2.11 0.00 0.00 58.89 60.61 1d1d h TRP 69 Cb 0.84 -0.18 -0.02 0.00 -2.10 0.00 0.00 29.16 27.70 1d1d h TRP 69 CO 0.07 1.15 -0.18 0.52 -2.79 0.00 0.00 178.44 177.21 1d1d h MET 70 N 0.59 0.59 -0.14 2.65 2.86 0.15 0.83 114.93 122.47 1d1d h MET 70 Ca 0.01 -0.20 -0.08 0.00 -2.06 0.00 0.00 59.70 57.36 1d1d h MET 70 Cb 1.14 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.76 1d1d h MET 70 CO 0.12 0.74 -0.24 0.22 1.06 0.00 0.00 176.91 178.81 1d1d h ASP 71 N 0.53 0.45 0.06 1.22 3.58 -0.09 0.72 116.42 122.88 1d1d h ASP 71 Ca 0.09 -0.54 -0.13 0.00 0.42 0.00 0.00 57.03 56.86 1d1d h ASP 71 Cb 0.61 -0.13 -0.01 0.00 1.72 0.00 0.00 39.33 41.52 1d1d h ASP 71 CO 0.04 0.91 -0.44 0.00 -2.88 0.00 0.00 179.24 176.87 1d1d h ALA 72 N 0.56 0.89 -0.54 -0.78 0.00 -0.96 -2.24 119.26 116.18 1d1d h ALA 72 Ca 0.01 -0.45 -0.09 0.00 0.00 0.00 0.00 54.91 54.38 1d1d h ALA 72 Cb 0.82 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 1d1d h ALA 72 CO 0.05 0.64 -0.01 2.35 0.00 0.00 0.00 179.25 182.29 1d1d h TRP 73 N 0.38 1.04 -0.14 0.00 7.01 0.75 0.47 115.95 125.46 1d1d h TRP 73 Ca 0.03 -0.18 0.02 0.00 2.11 0.00 0.00 58.89 60.86 1d1d h TRP 73 Cb 0.92 -0.27 -0.02 0.00 -2.10 0.00 0.00 29.16 27.69 1d1d h TRP 73 CO 0.03 0.95 0.02 0.78 -2.79 0.00 0.00 178.44 177.43 1d1d h GLY 74 N 0.83 0.15 0.80 2.65 0.00 -0.57 0.48 103.07 107.41 1d1d h GLY 74 Ca 0.15 -0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.42 1d1d h GLY 74 CO 0.03 -0.01 -0.10 -2.08 0.00 0.00 0.00 176.54 174.38 1d1d h VAL 75 N 0.07 1.31 -0.56 4.60 2.07 -1.26 -2.59 116.25 119.89 1d1d h VAL 75 Ca 0.06 -1.17 0.08 0.00 0.82 0.00 0.00 66.70 66.49 1d1d h VAL 75 Cb 0.07 1.66 -0.06 0.00 -1.52 0.00 0.00 31.29 31.43 1d1d h VAL 75 CO -0.10 0.35 0.20 1.56 0.02 0.00 0.00 177.57 179.61 1d1d h GLN 76 N 0.10 0.38 -0.60 1.57 1.08 0.21 0.68 115.11 118.52 1d1d h GLN 76 Ca 0.04 -0.02 0.07 0.00 -1.45 0.00 0.00 58.65 57.29 1d1d h GLN 76 Cb 0.59 -0.08 -0.06 0.00 -0.05 0.00 0.00 27.48 27.88 1d1d h GLN 76 CO 0.03 0.25 0.29 -0.07 -0.95 0.00 0.00 178.83 178.38 1d1d h LEU 77 N 0.39 0.39 -1.09 1.46 3.38 0.05 -0.32 115.31 119.56 1d1d h LEU 77 Ca 0.27 0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.27 1d1d h LEU 77 Cb 0.31 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 1d1d h LEU 77 CO -0.27 0.25 0.35 1.56 0.09 0.00 0.00 178.44 180.41 1d1d h GLN 78 N 0.53 0.98 -0.60 1.13 4.20 -0.75 -1.64 115.11 118.96 1d1d h GLN 78 Ca 0.28 -0.12 0.03 0.00 0.06 0.00 0.00 58.65 58.89 1d1d h GLN 78 Cb 0.24 -0.19 -0.03 0.00 0.30 0.00 0.00 27.48 27.80 1d1d h GLN 78 CO -0.22 0.75 0.40 0.00 -0.67 0.00 0.00 178.83 179.09 1d1d h THR 79 N 0.98 1.10 -0.20 -0.54 1.03 0.78 0.01 112.91 116.08 1d1d h THR 79 Ca 0.24 -0.25 -0.12 0.00 -0.01 0.00 0.00 66.41 66.27 1d1d h THR 79 Cb 0.08 0.30 -0.01 0.00 -1.07 0.00 0.00 68.15 67.45 1d1d h THR 79 CO -0.03 0.13 -0.39 0.58 -0.01 0.00 0.00 175.52 175.80 1d1d h VAL 80 N 0.74 1.30 -0.11 0.00 2.07 -0.52 0.59 116.25 120.33 1d1d h VAL 80 Ca 0.24 -1.53 -0.02 0.00 0.82 0.00 0.00 66.70 66.21 1d1d h VAL 80 Cb 0.03 1.58 -0.00 0.00 -1.52 0.00 0.00 31.29 31.38 1d1d h VAL 80 CO -0.06 0.47 0.00 0.40 0.02 0.00 0.00 177.57 178.41 1d1d h ILE 81 N 0.37 1.24 -0.24 4.57 1.08 -0.63 0.41 117.51 124.32 1d1d h ILE 81 Ca 0.04 -0.78 -0.14 0.00 -0.39 0.00 0.00 64.86 63.58 1d1d h ILE 81 Cb 0.85 1.55 -0.01 0.00 -3.07 0.00 0.00 36.82 36.15 1d1d h ILE 81 CO 0.07 0.22 -0.44 0.00 -0.69 0.00 0.00 178.15 177.32 1d1d h ALA 82 N 0.75 0.79 -0.59 1.87 0.00 -0.99 -2.08 119.26 119.01 1d1d h ALA 82 Ca 0.03 -0.46 -0.08 0.00 0.00 0.00 0.00 54.91 54.40 1d1d h ALA 82 Cb 0.34 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1d1d h ALA 82 CO 0.00 0.66 0.05 0.00 0.00 0.00 0.00 179.25 179.96 1d1d h ALA 83 N 1.04 0.97 0.04 0.00 0.00 0.36 0.44 119.26 122.11 1d1d h ALA 83 Ca 0.03 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 1d1d h ALA 83 Cb 0.96 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1d1d h ALA 83 CO 0.09 0.64 -0.02 0.00 0.00 0.00 0.00 179.25 179.95 1d1d h ALA 84 N 1.12 -0.05 0.00 0.00 0.00 0.06 0.77 119.26 121.17 1d1d h ALA 84 Ca 0.18 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 1d1d h ALA 84 Cb 0.47 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1d1d h ALA 84 CO 0.02 -0.47 -0.33 0.00 0.00 0.00 0.00 179.25 178.48 1d1d h THR 85 N -0.17 1.15 -0.04 0.00 1.03 -1.17 -2.72 112.91 110.99 1d1d h THR 85 Ca -0.00 -1.15 -0.25 0.00 -0.01 0.00 0.00 66.41 65.00 1d1d h THR 85 Cb 0.15 1.63 0.01 0.00 -1.07 0.00 0.00 68.15 68.88 1d1d h THR 85 CO 0.01 0.32 -0.95 -0.09 -0.01 0.00 0.00 175.52 174.79 1d1d h ARG 86 N 0.00 0.65 -4.79 0.00 2.43 0.40 -3.41 114.38 109.66 1d1d h ARG 86 Ca -0.00 -0.65 -0.68 0.00 -0.81 0.00 0.00 59.98 57.83 1d1d h ARG 86 Cb 0.61 0.17 -0.32 0.00 -0.42 0.00 0.00 29.97 30.01 1d1d h ARG 86 CO 0.04 1.25 -0.70 0.34 -1.51 0.00 0.00 179.97 179.39 1d1d s ASP 87 N -7.20 4.83 -0.61 -3.80 2.15 0.26 -4.99 116.67 107.31 1d1d s ASP 87 Ca -0.09 -1.17 -0.06 0.00 0.43 0.00 0.00 52.55 51.66 1d1d s ASP 87 Cb 0.08 -1.72 -0.13 0.00 -0.30 0.00 0.00 42.92 40.84 1d1d s ASP 87 CO 0.90 -0.24 2.66 -0.81 -0.17 0.00 0.00 175.17 177.52 1d1d n PRO 88 N 4.65 2.15 -1.22 4.34 -0.04 -1.25 -3.02 135.00 140.61 1d1d n PRO 88 Ca -0.14 -1.27 -0.04 0.00 -0.04 0.00 0.00 63.50 62.02 1d1d n PRO 88 Cb 0.44 -2.24 -0.01 0.00 -0.04 0.00 0.00 33.50 31.65 1d1d n PRO 88 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 1d1d n ARG 89 N 3.28 0.24 -2.94 0.54 3.00 -1.26 -5.13 116.66 114.39 1d1d n ARG 89 Ca 0.46 -0.74 -0.40 0.00 -0.00 0.00 0.00 57.85 57.17 1d1d n ARG 89 Cb 0.43 0.45 -0.06 0.00 0.00 0.00 0.00 32.46 33.28 1d1d n ARG 89 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.63 176.05 1d1d s HIS 90 N 0.02 3.87 -0.09 -0.14 2.46 -1.17 -4.95 115.29 115.29 1d1d s HIS 90 Ca 0.02 1.64 0.25 0.00 0.47 0.00 0.00 55.06 57.43 1d1d s HIS 90 Cb 0.08 -2.83 0.73 0.00 -0.13 0.00 0.00 32.58 30.43 1d1d s HIS 90 CO -0.02 0.42 1.74 -1.00 -2.47 0.00 0.00 174.74 173.41 1d1d h PRO 91 N 4.75 0.00 0.00 2.88 0.13 -1.95 -2.57 132.00 135.24 1d1d h PRO 91 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 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 0.68 0.14 -0.01 0.00 -0.23 0.00 0.00 178.00 178.59 1d1d n ALA 92 N -2.15 2.33 -1.90 -0.56 0.00 -1.26 -3.26 120.51 113.72 1d1d n ALA 92 Ca 0.02 -0.09 -0.32 0.00 0.00 0.00 0.00 53.44 53.05 1d1d n ALA 92 Cb 0.48 -1.47 -0.04 0.00 0.00 0.00 0.00 19.45 18.42 1d1d n ALA 92 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1d1d s ASN 93 N -3.26 6.62 0.00 0.00 0.01 -0.97 -4.39 114.94 112.95 1d1d s ASN 93 Ca 0.13 1.50 0.00 0.00 -0.71 0.00 0.00 52.86 53.79 1d1d s ASN 93 Cb 0.18 -2.48 0.00 0.00 0.41 0.00 0.00 41.25 39.36 1d1d s ASN 93 CO 0.54 -0.54 0.00 0.61 -1.51 0.00 0.00 177.10 176.20 1d1d n GLY 94 N -1.48 0.62 2.05 0.66 0.00 -1.26 -4.89 105.19 100.88 1d1d n GLY 94 Ca 0.06 0.56 0.00 0.00 0.00 0.00 0.00 46.02 46.64 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 0.00 0.00 1.61 -0.06 -1.26 -4.69 117.38 112.98 1d1d n GLN 95 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.00 1d1d n GLN 95 Cb 0.00 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.18 1d1d n GLN 95 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1d1d n GLY 96 N 0.71 0.82 0.00 1.69 0.00 -1.26 -4.88 105.19 102.28 1d1d n GLY 96 Ca 0.00 0.43 0.13 0.00 0.00 0.00 0.00 46.02 46.58 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 0.82 -0.06 1.61 0.63 -1.26 -3.59 116.66 114.82 1d1d n ARG 97 Ca 0.00 0.00 -0.12 0.00 -0.92 0.00 0.00 57.85 56.81 1d1d n ARG 97 Cb 0.00 -1.50 -0.04 0.00 0.45 0.00 0.00 32.46 31.37 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 0.66 -0.20 2.66 5.14 0.00 -1.26 -5.07 105.19 107.12 1d1d n GLY 98 Ca 0.20 -0.07 -0.04 0.00 0.00 0.00 0.00 46.02 46.10 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 -3.58 -1.21 -4.30 1.61 1.02 -1.24 -4.95 120.64 108.00 1d1d n GLU 99 Ca -0.22 0.96 -0.30 0.00 -0.02 0.00 0.00 57.16 57.59 1d1d n GLU 99 Cb 0.62 -4.55 -0.17 0.00 -0.02 0.00 0.00 31.44 27.33 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 -3.41 2.36 0.99 3.49 3.00 -1.26 -4.19 118.95 119.93 1d1d s ARG 100 Ca 0.13 -0.60 -0.12 0.00 -1.00 0.00 0.00 55.73 54.14 1d1d s ARG 100 Cb -0.02 -2.06 0.18 0.00 0.00 0.00 0.00 34.95 33.06 1d1d s ARG 100 CO 0.53 -0.13 1.10 -0.08 0.00 0.00 0.00 175.30 176.72 1d1d s THR 101 N 1.18 2.01 -0.03 4.11 -1.32 -1.26 -4.47 115.64 115.87 1d1d s THR 101 Ca -0.02 0.00 -0.03 0.00 -1.21 0.00 0.00 61.69 60.44 1d1d s THR 101 Cb -0.14 -2.56 0.01 0.00 -1.51 0.00 0.00 72.50 68.30 1d1d s THR 101 CO -0.06 -0.01 0.07 0.20 -2.21 0.00 0.00 174.62 172.62 1d1d s ASN 102 N -3.60 -0.06 0.52 8.08 -0.87 -1.26 -5.02 114.94 112.73 1d1d s ASN 102 Ca 0.65 0.12 0.18 0.00 -1.57 0.00 0.00 52.86 52.24 1d1d s ASN 102 Cb -0.18 0.15 1.30 0.00 -0.02 0.00 0.00 41.25 42.51 1d1d s ASN 102 CO 0.57 -0.04 2.13 0.25 -2.57 0.00 0.00 177.10 177.43 1d1d h LEU 103 N 5.94 0.00 -0.78 0.60 5.85 -1.98 0.04 115.31 124.98 1d1d h LEU 103 Ca -0.25 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.43 1d1d h LEU 103 Cb 1.20 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.20 1d1d h LEU 103 CO 0.46 0.00 0.32 -0.78 -0.34 0.00 0.00 178.44 178.10 1d1d h ASP 104 N 0.00 1.07 -0.23 1.25 3.58 -1.98 0.16 116.42 120.27 1d1d h ASP 104 Ca 0.04 -0.17 -0.02 0.00 0.42 0.00 0.00 57.03 57.30 1d1d h ASP 104 Cb 0.15 -0.28 -0.01 0.00 1.72 0.00 0.00 39.33 40.91 1d1d h ASP 104 CO -0.00 0.95 0.07 0.03 -2.88 0.00 0.00 179.24 177.41 1d1d h ARG 105 N 1.13 0.36 0.00 0.28 3.08 -1.41 -1.56 114.38 116.26 1d1d h ARG 105 Ca 0.26 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 60.23 1d1d h ARG 105 Cb 0.20 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.20 1d1d h ARG 105 CO -0.02 0.45 0.00 -0.07 -1.07 0.00 0.00 179.97 179.26 1d1d h LEU 106 N 0.20 0.00 0.39 3.04 3.38 -1.13 -3.07 115.31 118.12 1d1d h LEU 106 Ca 0.07 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 1d1d h LEU 106 Cb 0.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.00 1d1d h LEU 106 CO -0.00 0.00 -0.19 0.11 0.09 0.00 0.00 178.44 178.45 1d1d h LYS 107 N 0.00 -0.51 0.00 1.13 6.56 0.28 -3.47 116.57 120.57 1d1d h LYS 107 Ca 0.00 0.03 0.00 0.00 -1.06 0.00 0.00 60.65 59.62 1d1d h LYS 107 Cb 0.37 0.12 0.00 0.00 -0.57 0.00 0.00 32.23 32.14 1d1d h LYS 107 CO 0.00 -0.33 0.00 0.41 -2.06 0.00 0.00 179.45 177.47 1d1d n GLY 108 N 0.45 2.00 0.15 3.86 0.00 -0.85 -4.94 105.19 105.86 1d1d n GLY 108 Ca -0.07 0.00 0.07 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 1.04 -4.57 0.99 7.94 -1.25 -3.90 117.00 117.26 1d1d n LEU 109 Ca 0.00 -0.62 -0.31 0.00 -1.11 0.00 0.00 56.01 53.97 1d1d n LEU 109 Cb 0.00 0.00 0.19 0.00 0.53 0.00 0.00 43.42 44.14 1d1d n LEU 109 CO 0.00 0.22 0.50 0.00 -1.11 0.00 0.00 177.39 177.00 1d1d n ALA 110 N -0.78 -1.69 -2.27 1.96 0.00 -1.26 -4.77 120.51 111.69 1d1d n ALA 110 Ca 0.04 -0.76 -0.42 0.00 0.00 0.00 0.00 53.44 52.30 1d1d n ALA 110 Cb 0.25 -2.08 -0.03 0.00 0.00 0.00 0.00 19.45 17.60 1d1d n ALA 110 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1d1d s ASP 111 N -2.48 6.89 0.00 0.00 -4.77 -1.26 -1.99 116.67 113.07 1d1d s ASP 111 Ca 0.66 2.06 0.00 0.00 -3.30 0.00 0.00 52.55 51.97 1d1d s ASP 111 Cb -0.23 -2.56 0.00 0.00 -1.09 0.00 0.00 42.92 39.04 1d1d s ASP 111 CO 0.61 -0.69 0.00 0.61 0.70 0.00 0.00 175.17 176.40 1d1d n GLY 112 N 3.58 0.65 0.11 2.12 0.00 -1.26 -4.89 105.19 105.50 1d1d n GLY 112 Ca 0.13 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.01 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 0.67 -3.66 1.61 2.81 -0.84 -3.27 117.12 112.45 1d1d n MET 113 Ca 0.00 0.08 -0.36 0.00 -1.81 0.00 0.00 57.70 55.61 1d1d n MET 113 Cb 0.00 -1.55 -0.07 0.00 -0.71 0.00 0.00 33.22 30.89 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 -2.51 5.36 0.00 2.03 -7.23 -1.23 -4.01 120.40 112.81 1d1d s VAL 114 Ca -0.20 0.39 0.00 0.00 -1.81 0.00 0.00 61.98 60.36 1d1d s VAL 114 Cb 0.07 -3.54 0.00 0.00 0.56 0.00 0.00 36.38 33.47 1d1d s VAL 114 CO 0.74 0.46 0.00 0.61 -0.31 0.00 0.00 175.10 176.60 1d1d n GLY 115 N 3.08 0.72 3.15 2.32 0.00 -1.26 -5.02 105.19 108.18 1d1d n GLY 115 Ca -0.15 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.73 -0.12 0.00 1.61 0.01 -1.26 -5.07 114.94 107.39 1d1d s ASN 116 Ca 0.00 0.76 0.00 0.00 -0.71 0.00 0.00 52.86 52.91 1d1d s ASN 116 Cb 0.00 1.29 0.00 0.00 0.41 0.00 0.00 41.25 42.95 1d1d s ASN 116 CO 0.00 -0.25 0.19 -0.81 -1.51 0.00 0.00 177.10 174.71 1d1d n PRO 117 N 5.38 0.00 -0.23 -0.60 -0.04 -1.26 -1.84 135.00 136.41 1d1d n PRO 117 Ca -0.07 0.25 0.12 0.00 -0.04 0.00 0.00 63.50 63.77 1d1d n PRO 117 Cb 0.50 -0.88 0.41 0.00 -0.04 0.00 0.00 33.50 33.49 1d1d n PRO 117 CO 0.00 0.00 0.00 -0.56 -0.04 0.00 0.00 175.50 174.90 1d1d h GLN 118 N 0.00 0.60 -0.72 0.54 3.07 -1.97 0.68 115.11 117.30 1d1d h GLN 118 Ca 0.00 -0.04 -0.05 0.00 0.09 0.00 0.00 58.65 58.65 1d1d h GLN 118 Cb 0.00 -0.14 -0.03 0.00 0.08 0.00 0.00 27.48 27.39 1d1d h GLN 118 CO 0.00 0.40 0.24 0.78 0.09 0.00 0.00 178.83 180.34 1d1d h GLY 119 N 0.62 1.19 0.91 0.06 0.00 -1.87 0.26 103.07 104.23 1d1d h GLY 119 Ca 0.41 -0.68 -0.06 0.00 0.00 0.00 0.00 47.33 47.01 1d1d h GLY 119 CO -0.17 0.63 -0.00 -1.61 0.00 0.00 0.00 176.54 175.39 1d1d h GLN 120 N 1.07 0.61 -0.58 4.80 4.15 -0.14 0.14 115.11 125.16 1d1d h GLN 120 Ca 0.24 -0.20 -0.10 0.00 0.77 0.00 0.00 58.65 59.36 1d1d h GLN 120 Cb 0.27 -0.05 -0.02 0.00 0.21 0.00 0.00 27.48 27.89 1d1d h GLN 120 CO -0.01 0.73 -0.03 0.00 -1.93 0.00 0.00 178.83 177.59 1d1d h ALA 121 N 0.86 0.84 0.00 3.38 0.00 -1.02 -1.32 119.26 122.00 1d1d h ALA 121 Ca 0.10 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1d1d h ALA 121 Cb 0.46 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1d1d h ALA 121 CO 0.02 0.66 0.00 0.00 0.00 0.00 0.00 179.25 179.93 1d1d h ALA 122 N 1.01 1.00 0.17 0.00 0.00 -0.30 -2.79 119.26 118.36 1d1d h ALA 122 Ca 0.16 0.00 -0.27 0.00 0.00 0.00 0.00 54.91 54.80 1d1d h ALA 122 Cb 0.59 0.00 0.03 0.00 0.00 0.00 0.00 17.79 18.41 1d1d h ALA 122 CO 0.04 0.00 -1.18 1.25 0.00 0.00 0.00 179.25 179.36 1d1d h LEU 123 N 0.00 0.74 -9.32 0.00 6.46 0.35 -3.44 115.31 110.10 1d1d h LEU 123 Ca 0.00 -0.89 -0.58 0.00 -0.12 0.00 0.00 57.88 56.29 1d1d h LEU 123 Cb 0.50 -0.24 -0.08 0.00 -0.73 0.00 0.00 40.66 40.12 1d1d h LEU 123 CO 0.00 1.57 -0.12 -0.76 -0.62 0.00 0.00 178.44 178.51 1d1d s LEU 124 N -7.81 4.27 0.87 2.25 1.43 -0.68 -5.05 118.68 113.97 1d1d s LEU 124 Ca -0.11 0.83 -0.12 0.00 -1.03 0.00 0.00 54.13 53.70 1d1d s LEU 124 Cb 0.04 -2.72 0.09 0.00 0.03 0.00 0.00 46.19 43.62 1d1d s LEU 124 CO 0.90 -0.02 0.95 -2.11 0.23 0.00 0.00 176.35 176.30 1d1d n ARG 125 N 3.73 -0.15 -2.34 1.70 1.85 -1.26 -4.83 116.66 115.35 1d1d n ARG 125 Ca -0.07 0.02 -0.42 0.00 -1.00 0.00 0.00 57.85 56.38 1d1d n ARG 125 Cb 0.52 -2.23 -0.02 0.00 -1.05 0.00 0.00 32.46 29.67 1d1d n ARG 125 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 1d1d s PRO 126 N -4.08 3.44 0.00 2.89 0.04 -1.26 -3.90 135.00 132.13 1d1d s PRO 126 Ca 0.67 0.77 0.00 0.00 0.04 0.00 0.00 61.00 62.48 1d1d s PRO 126 Cb -0.26 -4.08 0.00 0.00 0.04 0.00 0.00 34.50 30.21 1d1d s PRO 126 CO 0.58 -1.75 0.00 0.41 0.04 0.00 0.00 177.00 176.28 1d1d n GLY 127 N 5.18 0.08 0.32 0.56 0.00 -1.26 -4.95 105.19 105.12 1d1d n GLY 127 Ca 0.15 0.16 0.15 0.00 0.00 0.00 0.00 46.02 46.49 1d1d n GLY 127 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1d1d h GLU 128 N 0.00 0.00 -0.57 1.61 9.09 -1.66 -0.44 114.58 122.60 1d1d h GLU 128 Ca 0.00 0.00 0.05 0.00 0.05 0.00 0.00 59.36 59.46 1d1d h GLU 128 Cb 0.00 0.00 -0.05 0.00 -1.65 0.00 0.00 28.75 27.05 1d1d h GLU 128 CO 0.00 0.00 0.30 -0.07 0.05 0.00 0.00 179.01 179.29 1d1d h LEU 129 N 0.00 0.44 -0.60 3.06 3.38 -1.84 0.17 115.31 119.92 1d1d h LEU 129 Ca 0.12 0.03 -0.10 0.00 0.09 0.00 0.00 57.88 58.02 1d1d h LEU 129 Cb 0.51 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 1d1d h LEU 129 CO -0.00 0.30 -0.03 0.58 0.09 0.00 0.00 178.44 179.38 1d1d h VAL 130 N 0.58 1.27 -1.00 1.22 2.07 -1.39 -0.88 116.25 118.11 1d1d h VAL 130 Ca 0.25 -1.19 0.04 0.00 0.82 0.00 0.00 66.70 66.62 1d1d h VAL 130 Cb 0.15 0.83 -0.06 0.00 -1.52 0.00 0.00 31.29 30.69 1d1d h VAL 130 CO -0.17 0.43 0.66 0.00 0.02 0.00 0.00 177.57 178.51 1d1d h ALA 131 N 0.98 1.34 -0.39 1.67 0.00 -0.80 0.51 119.26 122.57 1d1d h ALA 131 Ca 0.17 -0.05 -0.14 0.00 0.00 0.00 0.00 54.91 54.89 1d1d h ALA 131 Cb 0.60 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1d1d h ALA 131 CO 0.04 0.55 -0.30 0.82 0.00 0.00 0.00 179.25 180.35 1d1d h ILE 132 N 1.27 1.28 -0.04 0.00 2.04 -0.31 -0.43 117.51 121.32 1d1d h ILE 132 Ca 0.40 -1.46 -0.00 0.00 1.00 0.00 0.00 64.86 64.80 1d1d h ILE 132 Cb 0.01 1.30 -0.00 0.00 -0.74 0.00 0.00 36.82 37.39 1d1d h ILE 132 CO -0.13 0.49 0.01 0.74 0.00 0.00 0.00 178.15 179.25 1d1d h THR 133 N 0.72 1.22 -0.98 -0.27 2.02 0.17 0.63 112.91 116.42 1d1d h THR 133 Ca 0.08 -0.66 0.01 0.00 0.77 0.00 0.00 66.41 66.61 1d1d h THR 133 Cb 0.86 1.59 -0.05 0.00 -1.74 0.00 0.00 68.15 68.81 1d1d h THR 133 CO 0.08 0.18 0.64 0.00 0.37 0.00 0.00 175.52 176.79 1d1d h ALA 134 N 0.75 1.24 -0.21 6.16 0.00 0.01 0.33 119.26 127.53 1d1d h ALA 134 Ca 0.01 -0.07 -0.15 0.00 0.00 0.00 0.00 54.91 54.70 1d1d h ALA 134 Cb 0.28 -0.40 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1d1d h ALA 134 CO 0.00 0.64 -0.48 0.77 0.00 0.00 0.00 179.25 180.18 1d1d h SER 135 N 1.33 0.61 -0.55 0.00 0.02 -0.87 -0.54 113.55 113.54 1d1d h SER 135 Ca 0.36 -0.30 -0.02 0.00 -0.84 0.00 0.00 61.79 60.99 1d1d h SER 135 Cb -0.14 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.20 1d1d h SER 135 CO -0.08 0.99 0.26 0.00 -1.14 0.00 0.00 176.83 176.87 1d1d h ALA 136 N 1.03 0.71 -0.12 3.77 0.00 0.13 0.54 119.26 125.31 1d1d h ALA 136 Ca 0.02 -0.13 -0.12 0.00 0.00 0.00 0.00 54.91 54.68 1d1d h ALA 136 Cb 1.00 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 1d1d h ALA 136 CO 0.09 0.27 -0.47 -0.07 0.00 0.00 0.00 179.25 179.08 1d1d h LEU 137 N 0.74 0.32 -0.51 0.00 4.07 -0.84 -1.66 115.31 117.43 1d1d h LEU 137 Ca 0.19 -0.15 -0.04 0.00 0.08 0.00 0.00 57.88 57.96 1d1d h LEU 137 Cb 0.12 -0.09 -0.02 0.00 1.08 0.00 0.00 40.66 41.75 1d1d h LEU 137 CO -0.02 0.74 0.15 1.56 -1.08 0.00 0.00 178.44 179.79 1d1d h GLN 138 N 0.24 0.80 -0.17 1.13 4.20 -0.37 -0.54 115.11 120.40 1d1d h GLN 138 Ca 0.01 -0.18 -0.11 0.00 0.06 0.00 0.00 58.65 58.44 1d1d h GLN 138 Cb 0.92 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.57 1d1d h GLN 138 CO 0.08 0.75 -0.37 0.00 -0.67 0.00 0.00 178.83 178.62 1d1d h ALA 139 N 1.01 1.07 0.72 3.87 0.00 -0.74 -2.52 119.26 122.67 1d1d h ALA 139 Ca 0.16 -0.40 -0.04 0.00 0.00 0.00 0.00 54.91 54.64 1d1d h ALA 139 Cb 0.29 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 17.99 1d1d h ALA 139 CO -0.00 0.59 -0.35 0.35 0.00 0.00 0.00 179.25 179.84 1d1d h PHE 140 N 0.30 -0.90 -0.39 0.00 3.04 -0.81 -2.16 116.94 116.03 1d1d h PHE 140 Ca 0.03 -0.02 0.11 0.00 3.98 0.00 0.00 57.97 62.07 1d1d h PHE 140 Cb 0.79 0.30 -0.02 0.00 2.56 0.00 0.00 35.95 39.58 1d1d h PHE 140 CO 0.02 -0.53 0.37 0.07 -2.02 0.00 0.00 178.31 176.22 1d1d h ARG 141 N -1.16 0.00 -0.31 1.11 0.11 -1.12 0.16 114.38 113.17 1d1d h ARG 141 Ca -0.10 0.00 -0.10 0.00 0.10 0.00 0.00 59.98 59.88 1d1d h ARG 141 Cb 0.76 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.84 1d1d h ARG 141 CO 0.16 0.00 -0.19 1.49 0.10 0.00 0.00 179.97 181.53 1d1d h GLU 142 N 0.00 0.68 -0.59 0.08 4.22 -1.11 0.32 114.58 118.19 1d1d h GLU 142 Ca 0.18 -0.32 -0.03 0.00 0.08 0.00 0.00 59.36 59.28 1d1d h GLU 142 Cb 0.93 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.14 1d1d h GLU 142 CO -0.00 0.92 0.24 0.28 -2.18 0.00 0.00 179.01 178.26 1d1d h VAL 143 N 0.44 1.23 0.00 0.32 2.07 -0.08 -1.44 116.25 118.79 1d1d h VAL 143 Ca 0.07 -0.70 -0.04 0.00 0.82 0.00 0.00 66.70 66.85 1d1d h VAL 143 Cb 0.73 0.59 -0.01 0.00 -1.52 0.00 0.00 31.29 31.09 1d1d h VAL 143 CO 0.05 0.27 -0.18 0.00 0.02 0.00 0.00 177.57 177.74 1d1d h ALA 144 N 1.08 0.98 -0.54 1.67 0.00 -1.26 -3.03 119.26 118.17 1d1d h ALA 144 Ca 0.20 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 1d1d h ALA 144 Cb 0.20 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1d1d h ALA 144 CO -0.02 0.22 0.24 -0.09 0.00 0.00 0.00 179.25 179.61 1d1d h ARG 145 N 0.00 0.78 -5.37 0.00 2.43 0.73 -3.42 114.38 109.52 1d1d h ARG 145 Ca -0.00 -0.12 -0.63 0.00 -0.81 0.00 0.00 59.98 58.42 1d1d h ARG 145 Cb 0.80 -0.14 -0.06 0.00 -0.42 0.00 0.00 29.97 30.15 1d1d h ARG 145 CO 0.02 0.66 1.47 1.28 -1.51 0.00 0.00 179.97 181.89 1d1d n LEU 146 N -4.56 0.52 -2.55 3.80 7.99 -0.99 -1.39 117.00 119.82 1d1d n LEU 146 Ca 0.03 0.44 -0.05 0.00 -0.01 0.00 0.00 56.01 56.41 1d1d n LEU 146 Cb 0.13 -0.88 0.01 0.00 -0.11 0.00 0.00 43.42 42.57 1d1d n LEU 146 CO 0.38 -0.72 0.06 0.00 -1.51 0.00 0.00 177.39 175.60 1d1d n ALA 147 N 8.59 -2.93 -3.90 -1.18 0.00 -1.26 -5.01 120.51 114.82 1d1d n ALA 147 Ca 0.58 0.81 -0.33 0.00 0.00 0.00 0.00 53.44 54.50 1d1d n ALA 147 Cb -0.01 -2.73 -0.14 0.00 0.00 0.00 0.00 19.45 16.58 1d1d n ALA 147 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1d1d s GLU 148 N -2.31 1.87 0.14 0.00 -6.30 -0.48 -5.09 118.70 106.52 1d1d s GLU 148 Ca 0.17 -1.70 -0.30 0.00 -2.50 0.00 0.00 54.97 50.64 1d1d s GLU 148 Cb -0.05 -3.26 -0.07 0.00 0.00 0.00 0.00 34.13 30.75 1d1d s GLU 148 CO 0.59 -0.88 1.13 -1.25 0.02 0.00 0.00 175.26 174.87 1d1d s PRO 149 N 1.05 4.54 0.11 4.30 0.04 -1.26 -5.04 135.00 138.73 1d1d s PRO 149 Ca 0.05 1.74 0.03 0.00 0.04 0.00 0.00 61.00 62.86 1d1d s PRO 149 Cb -0.20 -3.30 -0.04 0.00 0.04 0.00 0.00 34.50 31.00 1d1d s PRO 149 CO -0.05 -0.04 0.14 0.00 0.04 0.00 0.00 177.00 177.08 1d1d s ALA 150 N 0.18 3.68 0.00 8.56 0.00 -1.26 -5.02 121.76 127.91 1d1d s ALA 150 Ca 0.52 -1.04 0.00 0.00 0.00 0.00 0.00 51.96 51.44 1d1d s ALA 150 Cb -0.29 -1.52 0.00 0.00 0.00 0.00 0.00 23.12 21.31 1d1d s ALA 150 CO 0.33 0.67 0.00 0.41 0.00 0.00 0.00 175.76 177.18 1d1d n GLY 151 N 0.10 2.46 0.10 0.00 0.00 -1.26 -4.83 105.19 101.76 1d1d n GLY 151 Ca -0.08 -0.44 -0.15 0.00 0.00 0.00 0.00 46.02 45.35 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 0.22 0.00 1.61 0.13 -1.95 -3.12 132.00 128.88 1d1d h PRO 152 Ca 0.00 -0.21 -0.23 0.00 -0.87 0.00 0.00 66.00 64.69 1d1d h PRO 152 Cb 0.00 0.06 -0.04 0.00 0.13 0.00 0.00 31.00 31.14 1d1d h PRO 152 CO 0.00 0.92 -2.18 -2.67 -0.23 0.00 0.00 178.00 173.83 1d1d n TRP 153 N -4.48 0.00 -0.03 1.56 2.14 -1.26 -4.10 117.44 111.27 1d1d n TRP 153 Ca -0.09 0.00 0.11 0.00 2.07 0.00 0.00 57.50 59.59 1d1d n TRP 153 Cb 0.51 -0.78 0.53 0.00 -0.81 0.00 0.00 31.31 30.76 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 1.28 2.03 0.00 -1.67 0.00 -1.93 0.48 119.26 119.46 1d1d h ALA 154 Ca -0.33 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.52 1d1d h ALA 154 Cb 1.74 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.45 1d1d h ALA 154 CO 0.02 -0.14 -0.21 -0.44 0.00 0.00 0.00 179.25 178.48 1d1d h ASP 155 N 0.34 0.00 -3.02 0.00 5.19 -1.71 -3.43 116.42 113.78 1d1d h ASP 155 Ca 0.23 0.00 -0.57 0.00 -0.62 0.00 0.00 57.03 56.07 1d1d h ASP 155 Cb 0.46 0.00 -0.05 0.00 0.18 0.00 0.00 39.33 39.93 1d1d h ASP 155 CO -0.05 0.21 0.82 -0.63 -3.12 0.00 0.00 179.24 176.46 1d1d s ILE 156 N -3.12 4.47 -0.04 0.35 1.01 0.17 -5.01 121.20 119.04 1d1d s ILE 156 Ca 0.06 1.78 0.02 0.00 0.00 0.00 0.00 60.65 62.51 1d1d s ILE 156 Cb 0.06 -4.15 0.01 0.00 0.01 0.00 0.00 42.46 38.39 1d1d s ILE 156 CO 0.70 -0.13 -0.10 0.42 0.00 0.00 0.00 174.94 175.83 1d1d s THR 157 N 3.15 0.87 0.00 2.92 -4.23 -1.26 -4.94 115.64 112.15 1d1d s THR 157 Ca 0.50 -0.39 -0.30 0.00 -1.18 0.00 0.00 61.69 60.32 1d1d s THR 157 Cb -0.19 -0.79 -0.06 0.00 1.34 0.00 0.00 72.50 72.80 1d1d s THR 157 CO 0.12 0.28 1.50 -1.58 -0.54 0.00 0.00 174.62 174.40 1d1d s GLN 158 N 0.33 4.24 0.27 3.99 -0.44 -1.24 -5.01 119.66 121.81 1d1d s GLN 158 Ca -0.06 2.08 0.10 0.00 -2.50 0.00 0.00 55.36 54.99 1d1d s GLN 158 Cb -0.11 -3.65 -0.05 0.00 -1.64 0.00 0.00 33.01 27.57 1d1d s GLN 158 CO 0.01 -0.66 -0.07 0.20 0.50 0.00 0.00 175.29 175.27 1d1d s GLY 159 N 2.24 1.75 0.40 2.59 0.00 -1.26 -4.57 107.32 108.46 1d1d s GLY 159 Ca 0.67 -1.74 0.22 0.00 0.00 0.00 0.00 44.72 43.87 1d1d s GLY 159 CO 0.28 -1.81 1.69 -0.56 0.00 0.00 0.00 173.10 172.70 1d1d h PRO 160 N 2.01 0.00 -0.01 2.90 0.13 -1.98 -2.99 132.00 132.07 1d1d h PRO 160 Ca -0.43 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.55 1d1d h PRO 160 Cb 1.25 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.36 1d1d h PRO 160 CO 0.60 0.27 -0.71 0.66 -0.23 0.00 0.00 178.00 178.60 1d1d h SER 161 N 0.00 0.07 -3.14 1.44 4.64 -2.01 -3.43 113.55 111.12 1d1d h SER 161 Ca -0.00 -0.05 -0.65 0.00 -0.47 0.00 0.00 61.79 60.62 1d1d h SER 161 Cb 0.96 -0.02 -0.14 0.00 -0.31 0.00 0.00 62.40 62.89 1d1d h SER 161 CO 0.04 0.75 -0.57 -1.61 -0.87 0.00 0.00 176.83 174.57 1d1d s GLU 162 N -3.44 3.46 0.36 4.77 0.41 -1.13 -5.07 118.70 118.06 1d1d s GLU 162 Ca -0.02 -0.32 -0.27 0.00 -0.41 0.00 0.00 54.97 53.95 1d1d s GLU 162 Cb 0.12 -3.04 -0.12 0.00 -1.78 0.00 0.00 34.13 29.32 1d1d s GLU 162 CO 0.78 0.56 1.33 0.45 -0.49 0.00 0.00 175.26 177.89 1d1d n SER 163 N 2.63 2.94 0.05 -0.19 2.88 -1.26 -4.44 113.62 116.22 1d1d n SER 163 Ca -0.18 1.19 -0.11 0.00 -1.33 0.00 0.00 58.87 58.44 1d1d n SER 163 Cb 0.53 -1.52 -0.04 0.00 -0.75 0.00 0.00 64.21 62.44 1d1d n SER 163 CO 0.00 0.00 0.00 0.15 -1.23 0.00 0.00 175.04 173.96 1d1d h PHE 164 N 2.54 -0.43 -0.67 0.66 3.57 -1.95 0.28 116.94 120.95 1d1d h PHE 164 Ca -0.47 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.05 1d1d h PHE 164 Cb 1.28 0.19 -0.03 0.00 2.79 0.00 0.00 35.95 40.18 1d1d h PHE 164 CO 0.51 -0.24 0.45 -0.24 -2.23 0.00 0.00 178.31 176.55 1d1d h VAL 165 N -0.26 1.17 -0.67 1.41 3.04 -1.96 0.28 116.25 119.26 1d1d h VAL 165 Ca 0.06 -0.31 0.05 0.00 -1.01 0.00 0.00 66.70 65.49 1d1d h VAL 165 Cb 0.34 0.18 -0.05 0.00 -2.01 0.00 0.00 31.29 29.75 1d1d h VAL 165 CO -0.17 0.17 0.38 0.44 -1.01 0.00 0.00 177.57 177.37 1d1d h ASP 166 N 0.91 0.57 -0.47 3.17 5.19 -1.74 -0.16 116.42 123.88 1d1d h ASP 166 Ca 0.25 0.03 -0.12 0.00 -0.62 0.00 0.00 57.03 56.56 1d1d h ASP 166 Cb -0.11 -0.09 -0.01 0.00 0.18 0.00 0.00 39.33 39.30 1d1d h ASP 166 CO -0.05 0.37 -0.16 0.15 -3.12 0.00 0.00 179.24 176.43 1d1d h PHE 167 N 0.70 1.08 -0.72 4.55 3.57 0.39 -2.49 116.94 124.02 1d1d h PHE 167 Ca 0.29 -0.25 0.05 0.00 3.53 0.00 0.00 57.97 61.60 1d1d h PHE 167 Cb 0.16 -0.26 -0.04 0.00 2.79 0.00 0.00 35.95 38.60 1d1d h PHE 167 CO -0.07 1.05 0.47 0.00 -2.23 0.00 0.00 178.31 177.53 1d1d h ALA 168 N 0.87 1.64 -0.05 2.41 0.00 0.38 0.11 119.26 124.62 1d1d h ALA 168 Ca 0.11 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1d1d h ALA 168 Cb 0.73 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 1d1d h ALA 168 CO 0.06 0.26 0.01 -0.91 0.00 0.00 0.00 179.25 178.67 1d1d h ASN 169 N 0.81 0.08 -0.77 0.00 2.35 -0.76 0.39 115.58 117.69 1d1d h ASN 169 Ca 0.30 -0.24 0.03 0.00 -0.55 0.00 0.00 56.30 55.83 1d1d h ASN 169 Cb 0.16 -0.02 -0.04 0.00 0.05 0.00 0.00 38.32 38.46 1d1d h ASN 169 CO -0.09 0.31 0.51 0.03 -1.65 0.00 0.00 177.43 176.53 1d1d h ARG 170 N -0.14 0.94 0.03 0.81 -0.00 -0.87 0.41 114.38 115.56 1d1d h ARG 170 Ca 0.02 -0.06 -0.00 0.00 -0.50 0.00 0.00 59.98 59.44 1d1d h ARG 170 Cb 0.26 -0.21 0.00 0.00 0.00 0.00 0.00 29.97 30.01 1d1d h ARG 170 CO 0.00 0.62 -0.01 1.25 0.00 0.00 0.00 179.97 181.83 1d1d h LEU 171 N 0.97 -0.03 -1.46 3.04 6.46 -0.52 -0.36 115.31 123.40 1d1d h LEU 171 Ca 0.30 -0.47 0.06 0.00 -0.12 0.00 0.00 57.88 57.65 1d1d h LEU 171 Cb 0.01 0.01 -0.04 0.00 -0.73 0.00 0.00 40.66 39.91 1d1d h LEU 171 CO -0.08 0.46 0.43 0.40 -0.62 0.00 0.00 178.44 179.03 1d1d h ILE 172 N -0.54 1.01 -0.30 4.05 2.04 0.26 0.42 117.51 124.45 1d1d h ILE 172 Ca -0.00 -0.23 -0.14 0.00 1.00 0.00 0.00 64.86 65.48 1d1d h ILE 172 Cb 0.50 0.29 -0.01 0.00 -0.74 0.00 0.00 36.82 36.86 1d1d h ILE 172 CO 0.01 0.12 -0.39 0.11 0.00 0.00 0.00 178.15 178.00 1d1d h LYS 173 N 0.67 0.72 -0.42 2.37 1.79 -0.06 0.38 116.57 122.02 1d1d h LYS 173 Ca 0.28 -0.37 -0.14 0.00 -2.18 0.00 0.00 60.65 58.24 1d1d h LYS 173 Cb 0.25 0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 30.90 1d1d h LYS 173 CO -0.09 0.99 -0.27 0.00 -1.08 0.00 0.00 179.45 179.00 1d1d h ALA 174 N 0.97 0.60 -0.34 3.86 0.00 0.85 0.22 119.26 125.42 1d1d h ALA 174 Ca 0.05 -0.41 -0.14 0.00 0.00 0.00 0.00 54.91 54.41 1d1d h ALA 174 Cb 0.93 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.58 1d1d h ALA 174 CO 0.08 0.63 -0.35 0.28 0.00 0.00 0.00 179.25 179.89 1d1d h VAL 175 N 0.76 1.28 -0.43 0.00 2.07 -0.12 -2.43 116.25 117.39 1d1d h VAL 175 Ca 0.09 -1.53 -0.05 0.00 0.82 0.00 0.00 66.70 66.03 1d1d h VAL 175 Cb 0.85 1.48 -0.02 0.00 -1.52 0.00 0.00 31.29 32.08 1d1d h VAL 175 CO 0.08 0.50 0.06 -0.33 0.02 0.00 0.00 177.57 177.90 1d1d h GLU 176 N 0.62 0.66 -0.82 1.57 5.08 -0.10 -1.57 114.58 120.02 1d1d h GLU 176 Ca 0.05 -0.14 -0.13 0.00 -1.00 0.00 0.00 59.36 58.15 1d1d h GLU 176 Cb 0.94 -0.10 -0.08 0.00 0.50 0.00 0.00 28.75 30.01 1d1d h GLU 176 CO 0.09 0.64 0.16 0.41 -1.00 0.00 0.00 179.01 179.31 1d1d n GLY 177 N -0.88 2.95 3.46 -3.84 0.00 0.05 -4.89 105.19 102.04 1d1d n GLY 177 Ca 0.03 -0.67 -0.23 0.00 0.00 0.00 0.00 46.02 45.15 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 -0.54 2.93 -0.81 1.61 1.04 -0.59 -4.99 113.70 112.36 1d1d s SER 178 Ca 0.38 -1.24 -0.15 0.00 0.48 0.00 0.00 55.95 55.42 1d1d s SER 178 Cb 0.30 -0.20 0.19 0.00 0.10 0.00 0.00 66.02 66.41 1d1d s SER 178 CO 0.10 -0.38 0.79 -0.62 0.98 0.00 0.00 173.24 174.11 1d1d s ASP 179 N -3.50 6.67 0.25 7.02 -1.08 -1.26 -4.97 116.67 119.80 1d1d s ASP 179 Ca 0.32 -2.48 0.11 0.00 -0.52 0.00 0.00 52.55 49.98 1d1d s ASP 179 Cb 0.05 -2.24 -0.05 0.00 -1.46 0.00 0.00 42.92 39.22 1d1d s ASP 179 CO 0.14 -0.69 -0.15 -0.76 0.52 0.00 0.00 175.17 174.23 1d1d s LEU 180 N 0.73 2.74 0.96 -1.34 1.43 -1.26 -5.14 118.68 116.80 1d1d s LEU 180 Ca 0.18 -0.86 -0.14 0.00 -1.03 0.00 0.00 54.13 52.29 1d1d s LEU 180 Cb -0.12 -1.32 0.17 0.00 0.03 0.00 0.00 46.19 44.96 1d1d s LEU 180 CO -0.07 0.06 1.16 -2.16 0.23 0.00 0.00 176.35 175.56 1d1d s PRO 181 N -3.29 0.72 0.19 1.29 0.04 -1.26 -4.96 135.00 127.73 1d1d s PRO 181 Ca 0.28 0.13 -0.30 0.00 0.04 0.00 0.00 61.00 61.15 1d1d s PRO 181 Cb -0.06 -1.80 -0.08 0.00 0.04 0.00 0.00 34.50 32.59 1d1d s PRO 181 CO 0.15 -2.45 1.12 -1.25 0.04 0.00 0.00 177.00 174.61 1d1d s PRO 182 N -5.39 4.58 0.00 0.56 0.04 -1.26 -2.62 135.00 130.90 1d1d s PRO 182 Ca 0.66 1.75 0.00 0.00 0.04 0.00 0.00 61.00 63.46 1d1d s PRO 182 Cb -0.12 -3.26 0.00 0.00 0.04 0.00 0.00 34.50 31.15 1d1d s PRO 182 CO 0.54 0.06 0.00 0.45 0.04 0.00 0.00 177.00 178.08 1d1d n SER 183 N 2.30 0.00 0.12 6.66 2.88 -1.26 -4.81 113.62 119.51 1d1d n SER 183 Ca 0.03 0.00 0.12 0.00 -1.33 0.00 0.00 58.87 57.68 1d1d n SER 183 Cb 0.46 0.00 0.07 0.00 -0.75 0.00 0.00 64.21 63.98 1d1d n SER 183 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1d1d h ALA 184 N 0.00 0.60 -1.04 -1.46 0.00 -1.88 -3.40 119.26 112.08 1d1d h ALA 184 Ca 0.00 0.00 -0.73 0.00 0.00 0.00 0.00 54.91 54.18 1d1d h ALA 184 Cb 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 17.79 17.66 1d1d h ALA 184 CO 0.00 0.00 1.99 0.54 0.00 0.00 0.00 179.25 181.78 1d1d n ARG 185 N -2.64 3.34 0.00 0.00 1.74 -1.25 -3.00 116.66 114.86 1d1d n ARG 185 Ca 0.01 -3.46 0.00 0.00 -0.77 0.00 0.00 57.85 53.63 1d1d n ARG 185 Cb 0.52 -3.12 0.00 0.00 -1.02 0.00 0.00 32.46 28.84 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 5.62 0.00 0.13 7.54 0.00 -1.26 -4.87 120.51 127.68 1d1d n ALA 186 Ca 0.42 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.86 1d1d n ALA 186 Cb 0.41 0.00 0.13 0.00 0.00 0.00 0.00 19.45 19.98 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 -1.75 -2.10 132.00 127.87 1d1d h PRO 187 Ca 0.00 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 65.05 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 0.63 -0.05 0.28 -0.23 0.00 0.00 178.00 178.63 1d1d h VAL 188 N 0.00 1.27 -0.08 1.56 2.07 -1.88 1.46 116.25 120.65 1d1d h VAL 188 Ca -0.01 -1.10 -0.02 0.00 0.82 0.00 0.00 66.70 66.39 1d1d h VAL 188 Cb 1.24 1.17 -0.00 0.00 -1.52 0.00 0.00 31.29 32.17 1d1d h VAL 188 CO 0.08 0.37 -0.03 0.40 0.02 0.00 0.00 177.57 178.41 1d1d h ILE 189 N 0.57 1.31 -0.62 4.57 2.04 -1.80 0.15 117.51 123.73 1d1d h ILE 189 Ca 0.11 -0.99 -0.09 0.00 1.00 0.00 0.00 64.86 64.89 1d1d h ILE 189 Cb 0.55 1.79 -0.02 0.00 -0.74 0.00 0.00 36.82 38.40 1d1d h ILE 189 CO 0.03 0.28 0.04 0.40 0.00 0.00 0.00 178.15 178.90 1d1d h ILE 190 N -0.18 1.26 -0.48 -0.67 2.04 -1.31 -2.30 117.51 115.87 1d1d h ILE 190 Ca 0.02 -1.09 -0.05 0.00 1.00 0.00 0.00 64.86 64.73 1d1d h ILE 190 Cb 0.45 0.74 -0.02 0.00 -0.74 0.00 0.00 36.82 37.25 1d1d h ILE 190 CO 0.01 0.40 0.08 -0.78 0.00 0.00 0.00 178.15 177.87 1d1d h ASP 191 N 0.97 0.70 -0.77 1.72 3.58 0.21 -1.89 116.42 120.95 1d1d h ASP 191 Ca 0.18 -0.13 0.06 0.00 0.42 0.00 0.00 57.03 57.56 1d1d h ASP 191 Cb 0.50 -0.18 -0.06 0.00 1.72 0.00 0.00 39.33 41.31 1d1d h ASP 191 CO 0.02 0.72 0.46 0.00 -2.88 0.00 0.00 179.24 177.56 1d1d h PHE 193 N 0.83 -0.06 -0.16 0.00 0.04 -1.06 -1.62 116.94 114.91 1d1d h PHE 193 Ca 0.34 -0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.11 1d1d h PHE 193 Cb 0.20 0.02 0.00 0.00 2.20 0.00 0.00 35.95 38.36 1d1d h PHE 193 CO -0.05 0.02 0.00 2.89 -0.60 0.00 0.00 178.31 180.56 1d1d n ARG 194 N -5.09 1.67 -0.10 1.51 1.85 -0.80 -2.70 116.66 113.00 1d1d n ARG 194 Ca -0.08 -0.70 -0.12 0.00 -1.00 0.00 0.00 57.85 55.96 1d1d n ARG 194 Cb 0.08 -1.41 -0.14 0.00 -1.05 0.00 0.00 32.46 29.94 1d1d n ARG 194 CO 0.00 0.00 0.00 1.04 -0.01 0.00 0.00 177.63 178.66 1d1d n GLN 195 N 0.09 0.83 -2.71 2.89 6.02 0.22 -4.87 117.38 119.85 1d1d n GLN 195 Ca 0.06 0.04 -0.05 0.00 -0.01 0.00 0.00 57.00 57.04 1d1d n GLN 195 Cb 0.31 -1.48 0.04 0.00 1.02 0.00 0.00 30.24 30.13 1d1d n GLN 195 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.06 177.22 1d1d n LYS 196 N -2.85 0.36 -4.13 -1.09 4.81 -1.00 -5.06 118.16 109.20 1d1d n LYS 196 Ca -0.34 -1.28 -0.10 0.00 -0.87 0.00 0.00 58.31 55.72 1d1d n LYS 196 Cb 1.06 -0.70 -0.10 0.00 0.02 0.00 0.00 35.03 35.32 1d1d n LYS 196 CO 0.00 0.00 0.00 -1.54 1.17 0.00 0.00 177.40 177.03 1d1d s SER 197 N 0.09 0.25 1.02 3.14 1.04 -1.10 -3.62 113.70 114.52 1d1d s SER 197 Ca 0.28 -1.19 -0.22 0.00 0.48 0.00 0.00 55.95 55.30 1d1d s SER 197 Cb 0.14 0.33 -0.11 0.00 0.10 0.00 0.00 66.02 66.47 1d1d s SER 197 CO -0.12 -0.77 -0.92 0.00 0.98 0.00 0.00 173.24 172.41 1d1d n GLN 198 N -0.13 -0.30 0.03 4.02 3.00 -1.26 -4.56 117.38 118.17 1d1d n GLN 198 Ca -0.05 -0.08 -0.17 0.00 -0.01 0.00 0.00 57.00 56.69 1d1d n GLN 198 Cb 0.64 -1.19 -0.07 0.00 0.00 0.00 0.00 30.24 29.61 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 -1.23 0.66 0.01 -1.09 0.13 -1.99 -0.48 132.00 128.01 1d1d h PRO 199 Ca -0.43 -0.65 -0.00 0.00 -0.87 0.00 0.00 66.00 64.05 1d1d h PRO 199 Cb 1.36 0.17 0.00 0.00 0.13 0.00 0.00 31.00 32.65 1d1d h PRO 199 CO 0.26 1.25 -0.01 -0.44 -0.23 0.00 0.00 178.00 178.83 1d1d h ASP 200 N 0.40 -0.02 -0.41 1.44 3.32 -1.97 1.37 116.42 120.55 1d1d h ASP 200 Ca -0.09 -0.27 -0.01 0.00 0.02 0.00 0.00 57.03 56.68 1d1d h ASP 200 Cb 1.57 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 41.10 1d1d h ASP 200 CO 0.18 0.26 0.22 0.40 -1.72 0.00 0.00 179.24 178.58 1d1d h ILE 201 N -0.29 1.16 -0.26 0.35 1.08 -1.91 0.25 117.51 117.89 1d1d h ILE 201 Ca -0.00 -0.42 -0.04 0.00 -0.39 0.00 0.00 64.86 64.02 1d1d h ILE 201 Cb 0.28 0.68 -0.01 0.00 -3.07 0.00 0.00 36.82 34.70 1d1d h ILE 201 CO 0.00 0.17 0.02 -0.61 -0.69 0.00 0.00 178.15 177.04 1d1d h GLN 202 N 0.53 0.44 -0.41 2.37 5.75 -0.97 -1.97 115.11 120.85 1d1d h GLN 202 Ca 0.14 -0.13 -0.00 0.00 -0.15 0.00 0.00 58.65 58.51 1d1d h GLN 202 Cb 0.07 -0.05 -0.02 0.00 1.07 0.00 0.00 27.48 28.55 1d1d h GLN 202 CO -0.02 0.58 0.24 0.37 -2.65 0.00 0.00 178.83 177.35 1d1d h GLN 203 N 0.24 0.55 -0.01 1.69 5.75 0.21 0.28 115.11 123.83 1d1d h GLN 203 Ca 0.08 -0.05 -0.00 0.00 -0.15 0.00 0.00 58.65 58.53 1d1d h GLN 203 Cb 0.37 -0.12 -0.00 0.00 1.07 0.00 0.00 27.48 28.80 1d1d h GLN 203 CO 0.01 0.40 0.00 1.25 -2.65 0.00 0.00 178.83 177.84 1d1d h LEU 204 N 0.57 0.02 -0.77 -2.39 6.46 -0.18 0.41 115.31 119.43 1d1d h LEU 204 Ca 0.15 -0.21 -0.06 0.00 -0.12 0.00 0.00 57.88 57.64 1d1d h LEU 204 Cb -0.00 -0.00 -0.03 0.00 -0.73 0.00 0.00 40.66 39.89 1d1d h LEU 204 CO -0.03 0.23 0.24 0.40 -0.62 0.00 0.00 178.44 178.66 1d1d h ILE 205 N -0.19 1.26 -0.64 4.05 5.03 -0.77 0.73 117.51 126.97 1d1d h ILE 205 Ca 0.00 -0.91 -0.06 0.00 -0.12 0.00 0.00 64.86 63.77 1d1d h ILE 205 Cb 0.22 0.42 -0.03 0.00 -3.03 0.00 0.00 36.82 34.40 1d1d h ILE 205 CO -0.00 0.36 0.15 0.03 -0.68 0.00 0.00 178.15 178.01 1d1d h ARG 206 N 1.12 1.01 0.00 2.37 -0.00 -0.22 -1.52 114.38 117.15 1d1d h ARG 206 Ca 0.24 -0.23 0.00 0.00 -0.50 0.00 0.00 59.98 59.49 1d1d h ARG 206 Cb 0.30 -0.14 0.00 0.00 0.00 0.00 0.00 29.97 30.13 1d1d h ARG 206 CO -0.01 0.90 -0.23 0.00 0.00 0.00 0.00 179.97 180.63 1d1d n ALA 207 N -2.46 2.71 -0.88 0.04 0.00 0.14 -4.88 120.51 115.19 1d1d n ALA 207 Ca 0.05 -0.17 -0.31 0.00 0.00 0.00 0.00 53.44 53.01 1d1d n ALA 207 Cb 0.25 -1.33 0.15 0.00 0.00 0.00 0.00 19.45 18.52 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 -3.05 1.54 0.61 0.00 0.00 0.25 -4.99 121.76 116.11 1d1d s ALA 208 Ca 0.11 0.40 -0.15 0.00 0.00 0.00 0.00 51.96 52.32 1d1d s ALA 208 Cb 0.16 -3.37 -0.03 0.00 0.00 0.00 0.00 23.12 19.88 1d1d s ALA 208 CO 0.62 -2.55 1.05 -1.25 0.00 0.00 0.00 175.76 173.63 1d1d s PRO 209 N -4.73 3.30 0.00 0.00 0.04 -1.26 -4.93 135.00 127.43 1d1d s PRO 209 Ca 0.65 1.13 0.05 0.00 0.04 0.00 0.00 61.00 62.87 1d1d s PRO 209 Cb -0.21 -2.03 0.21 0.00 0.04 0.00 0.00 34.50 32.50 1d1d s PRO 209 CO 0.58 -0.82 1.15 0.43 0.04 0.00 0.00 177.00 178.38 1d1d n SER 210 N -2.21 0.52 -0.05 6.66 7.64 -1.26 -3.00 113.62 121.93 1d1d n SER 210 Ca 0.08 -1.94 0.12 0.00 1.01 0.00 0.00 58.87 58.14 1d1d n SER 210 Cb 0.53 -0.06 0.17 0.00 -1.01 0.00 0.00 64.21 63.84 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 -0.24 0.00 -4.13 0.44 -1.04 -1.26 -4.84 114.28 103.20 1d1d n THR 211 Ca 0.05 -0.03 -0.35 0.00 -2.04 0.00 0.00 64.05 61.69 1d1d n THR 211 Cb 0.09 0.47 -0.10 0.00 -1.82 0.00 0.00 70.33 68.97 1d1d n THR 211 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1d1d s LEU 212 N -2.92 3.71 -0.25 -4.42 1.43 -1.16 -4.95 118.68 110.12 1d1d s LEU 212 Ca 0.12 0.08 0.10 0.00 -1.03 0.00 0.00 54.13 53.40 1d1d s LEU 212 Cb 0.17 -1.91 0.30 0.00 0.03 0.00 0.00 46.19 44.78 1d1d s LEU 212 CO 0.71 0.22 1.31 0.35 0.23 0.00 0.00 176.35 179.18 1d1d n THR 213 N 3.20 0.00 -4.14 5.49 -2.24 -1.26 -4.96 114.28 110.37 1d1d n THR 213 Ca -0.17 -0.74 -0.14 0.00 -2.27 0.00 0.00 64.05 60.73 1d1d n THR 213 Cb 0.53 0.86 -0.11 0.00 -2.10 0.00 0.00 70.33 69.50 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 0.10 0.82 -0.66 4.28 -4.23 -1.26 -4.32 115.64 110.37 1d1d s THR 214 Ca 0.07 -1.42 -0.06 0.00 -1.18 0.00 0.00 61.69 59.09 1d1d s THR 214 Cb 0.33 -1.09 -0.13 0.00 1.34 0.00 0.00 72.50 72.95 1d1d s THR 214 CO -0.10 -0.47 2.65 -0.81 -0.54 0.00 0.00 174.62 175.36 1d1d n PRO 215 N 0.93 2.19 0.01 3.99 -0.04 -1.26 -2.85 135.00 137.98 1d1d n PRO 215 Ca -0.19 -1.30 0.00 0.00 -0.04 0.00 0.00 63.50 61.97 1d1d n PRO 215 Cb 0.56 -2.27 0.00 0.00 -0.04 0.00 0.00 33.50 31.76 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 -0.65 0.18 0.55 0.00 -1.26 -4.92 105.19 102.28 1d1d n GLY 216 Ca 0.47 0.09 -0.06 0.00 0.00 0.00 0.00 46.02 46.52 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 0.29 0.04 1.61 5.08 -1.95 0.66 114.58 120.30 1d1d h GLU 217 Ca 0.00 -0.19 -0.00 0.00 -1.00 0.00 0.00 59.36 58.16 1d1d h GLU 217 Cb 0.00 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.28 1d1d h GLU 217 CO 0.00 0.79 -0.02 0.82 -1.00 0.00 0.00 179.01 179.61 1d1d h ILE 218 N 0.22 1.14 -0.21 3.13 1.08 -1.89 0.43 117.51 121.41 1d1d h ILE 218 Ca -0.00 -0.58 -0.17 0.00 -0.39 0.00 0.00 64.86 63.72 1d1d h ILE 218 Cb 1.10 1.53 0.00 0.00 -3.07 0.00 0.00 36.82 36.38 1d1d h ILE 218 CO 0.09 0.15 -0.54 0.40 -0.69 0.00 0.00 178.15 177.56 1d1d h ILE 219 N -0.30 1.30 -0.84 -0.67 2.04 -1.80 0.17 117.51 117.41 1d1d h ILE 219 Ca -0.01 -1.75 0.03 0.00 1.00 0.00 0.00 64.86 64.13 1d1d h ILE 219 Cb 0.28 1.84 -0.05 0.00 -0.74 0.00 0.00 36.82 38.15 1d1d h ILE 219 CO 0.01 0.56 0.55 0.50 0.00 0.00 0.00 178.15 179.77 1d1d h LYS 220 N 0.46 1.05 -0.06 2.37 3.64 0.38 0.43 116.57 124.83 1d1d h LYS 220 Ca -0.01 -0.06 -0.11 0.00 -1.27 0.00 0.00 60.65 59.20 1d1d h LYS 220 Cb 1.15 -0.24 0.01 0.00 -0.41 0.00 0.00 32.23 32.74 1d1d h LYS 220 CO 0.12 0.69 -0.40 -0.92 -2.27 0.00 0.00 179.45 176.66 1d1d h TYR 221 N 1.08 0.53 -0.64 1.91 3.20 -0.01 -1.01 116.97 122.03 1d1d h TYR 221 Ca 0.32 -0.24 0.00 0.00 3.14 0.00 0.00 58.73 61.96 1d1d h TYR 221 Cb -0.03 -0.08 -0.03 0.00 1.54 0.00 0.00 36.73 38.13 1d1d h TYR 221 CO -0.00 1.01 0.42 0.28 -1.64 0.00 0.00 178.16 178.22 1d1d h VAL 222 N -0.10 1.17 -0.63 1.81 2.07 -0.47 0.22 116.25 120.32 1d1d h VAL 222 Ca -0.03 -0.31 -0.09 0.00 0.82 0.00 0.00 66.70 67.09 1d1d h VAL 222 Cb 1.07 0.24 -0.02 0.00 -1.52 0.00 0.00 31.29 31.05 1d1d h VAL 222 CO 0.08 0.16 0.05 -0.07 0.02 0.00 0.00 177.57 177.82 1d1d h LEU 223 N 0.86 1.04 -1.26 2.57 3.38 -0.19 0.63 115.31 122.34 1d1d h LEU 223 Ca 0.23 -0.27 -0.05 0.00 0.09 0.00 0.00 57.88 57.88 1d1d h LEU 223 Cb -0.09 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.37 1d1d h LEU 223 CO -0.05 1.06 0.01 -0.78 0.09 0.00 0.00 178.44 178.77 1d1d h ASP 224 N 0.99 0.47 0.23 -0.43 1.82 -0.35 -2.21 116.42 116.94 1d1d h ASP 224 Ca 0.19 -0.08 -0.32 0.00 -0.39 0.00 0.00 57.03 56.42 1d1d h ASP 224 Cb 0.50 -0.12 0.03 0.00 0.68 0.00 0.00 39.33 40.42 1d1d h ASP 224 CO 0.02 0.53 -1.39 -0.09 -1.61 0.00 0.00 179.24 176.71 1d1d h ARG 225 N 0.49 0.57 -0.36 0.28 1.12 0.05 -3.32 114.38 113.20 1d1d h ARG 225 Ca 0.11 -0.88 0.08 0.00 -1.11 0.00 0.00 59.98 58.17 1d1d h ARG 225 Cb 0.31 0.32 -0.08 0.00 -0.01 0.00 0.00 29.97 30.51 1d1d h ARG 225 CO 0.01 1.41 -0.15 1.96 -3.11 0.00 0.00 179.97 180.09 1d1d h GLN 226 N 0.19 -0.08 -6.47 0.20 4.20 0.63 -3.39 115.11 110.39 1d1d h GLN 226 Ca -0.23 0.01 -0.53 0.00 0.06 0.00 0.00 58.65 57.95 1d1d h GLN 226 Cb 2.07 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 29.87 1d1d h GLN 226 CO 0.26 -0.05 0.48 -1.59 -0.67 0.00 0.00 178.83 177.25 1d1d s LYS 227 N -6.17 4.50 -0.05 1.46 -2.85 -0.87 -5.03 119.74 110.73 1d1d s LYS 227 Ca -0.14 1.63 0.02 0.00 -1.00 0.00 0.00 55.97 56.47 1d1d s LYS 227 Cb 0.14 -3.38 0.02 0.00 -2.06 0.00 0.00 37.83 32.54 1d1d s LYS 227 CO 0.70 -0.14 -0.08 0.42 0.10 0.00 0.00 175.35 176.35 1d1d s ILE 228 N 0.89 0.80 0.08 3.79 1.01 -1.26 -4.89 121.20 121.62 1d1d s ILE 228 Ca 0.55 -0.29 0.03 0.00 0.00 0.00 0.00 60.65 60.94 1d1d s ILE 228 Cb -0.26 -0.76 -0.03 0.00 0.01 0.00 0.00 42.46 41.41 1d1d s ILE 228 CO 0.29 0.28 -0.08 0.00 0.00 0.00 0.00 174.94 175.43 1d1d s ALA 229 N 0.72 0.88 -2.00 9.38 0.00 -1.26 -5.23 121.76 124.25 1d1d s ALA 229 Ca -0.12 -1.07 0.24 0.00 0.00 0.00 0.00 51.96 51.01 1d1d s ALA 229 Cb -0.14 0.07 1.43 0.00 0.00 0.00 0.00 23.12 24.48 1d1d s ALA 229 CO 0.02 -0.08 1.80 -0.35 0.00 0.00 0.00 175.76 177.15