#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 5.03 0.39 -0.99 2.01 -1.26 -4.94 115.64 115.88 1d1d s THR 12 Ca 0.00 -0.13 -0.24 0.00 0.31 0.00 0.00 61.69 61.62 1d1d s THR 12 Cb 0.00 -3.24 -0.09 0.00 0.01 0.00 0.00 72.50 69.18 1d1d s THR 12 CO 0.00 0.48 1.06 -2.16 -0.69 0.00 0.00 174.62 173.31 1d1d s PRO 13 N -1.39 4.18 0.78 4.92 0.04 -1.26 -5.01 135.00 137.26 1d1d s PRO 13 Ca 0.19 1.54 -0.13 0.00 0.04 0.00 0.00 61.00 62.64 1d1d s PRO 13 Cb -0.12 -2.57 0.07 0.00 0.04 0.00 0.00 34.50 31.92 1d1d s PRO 13 CO 0.09 -0.14 1.19 -0.48 0.04 0.00 0.00 177.00 177.71 1d1d s LEU 14 N -2.59 3.18 -0.08 -3.56 2.34 -1.26 -4.96 118.68 111.75 1d1d s LEU 14 Ca 0.57 2.30 -0.26 0.00 0.06 0.00 0.00 54.13 56.80 1d1d s LEU 14 Cb -0.23 -4.58 -0.03 0.00 -0.56 0.00 0.00 46.19 40.79 1d1d s LEU 14 CO 0.29 -2.49 0.84 -1.83 -1.06 0.00 0.00 176.35 172.09 1d1d s GLU 15 N -4.15 4.43 0.31 1.48 1.03 -1.26 -4.94 118.70 115.61 1d1d s GLU 15 Ca 0.72 1.11 0.16 0.00 0.03 0.00 0.00 54.97 56.98 1d1d s GLU 15 Cb -0.27 -3.49 0.40 0.00 -0.80 0.00 0.00 34.13 29.96 1d1d s GLU 15 CO 0.49 -0.10 1.60 -1.00 -1.33 0.00 0.00 175.26 174.92 1d1d h PRO 16 N 6.95 0.00 -0.14 -4.83 0.13 -1.98 -3.04 132.00 129.09 1d1d h PRO 16 Ca -0.37 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 64.79 1d1d h PRO 16 Cb 1.18 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.29 1d1d h PRO 16 CO 0.78 0.50 -0.03 1.57 -0.23 0.00 0.00 178.00 180.59 1d1d h LYS 17 N 0.00 0.01 -0.55 0.86 2.10 -1.99 0.67 116.57 117.67 1d1d h LYS 17 Ca -0.00 -0.00 -0.05 0.00 -2.00 0.00 0.00 60.65 58.59 1d1d h LYS 17 Cb 1.13 -0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 32.44 1d1d h LYS 17 CO 0.06 0.01 0.14 -0.07 -2.00 0.00 0.00 179.45 177.59 1d1d h LEU 18 N 0.01 0.78 -0.91 7.07 3.38 -1.98 -1.83 115.31 121.83 1d1d h LEU 18 Ca 0.06 -0.14 -0.07 0.00 0.09 0.00 0.00 57.88 57.82 1d1d h LEU 18 Cb 0.09 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 1d1d h LEU 18 CO -0.13 0.77 -0.01 0.40 0.09 0.00 0.00 178.44 179.55 1d1d h ILE 19 N 0.81 1.24 -0.77 1.22 2.04 -1.16 -2.30 117.51 118.60 1d1d h ILE 19 Ca 0.18 -1.01 0.01 0.00 1.00 0.00 0.00 64.86 65.03 1d1d h ILE 19 Cb 0.29 0.89 -0.04 0.00 -0.74 0.00 0.00 36.82 37.22 1d1d h ILE 19 CO -0.00 0.36 0.51 0.74 0.00 0.00 0.00 178.15 179.75 1d1d h THR 20 N 0.74 1.20 -0.12 -0.27 2.02 0.11 0.65 112.91 117.25 1d1d h THR 20 Ca 0.14 -0.36 -0.01 0.00 0.77 0.00 0.00 66.41 66.95 1d1d h THR 20 Cb 0.46 0.07 -0.00 0.00 -1.74 0.00 0.00 68.15 66.93 1d1d h THR 20 CO 0.02 0.19 0.02 0.03 0.37 0.00 0.00 175.52 176.15 1d1d h ARG 21 N 1.05 0.19 -0.57 6.66 3.08 -1.02 0.43 114.38 124.19 1d1d h ARG 21 Ca 0.28 -0.05 -0.10 0.00 0.07 0.00 0.00 59.98 60.18 1d1d h ARG 21 Cb -0.12 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 29.89 1d1d h ARG 21 CO -0.06 0.38 -0.03 1.25 -1.07 0.00 0.00 179.97 180.44 1d1d h LEU 22 N -0.03 1.02 -1.17 3.04 6.46 -1.03 -2.25 115.31 121.35 1d1d h LEU 22 Ca 0.04 -0.32 -0.07 0.00 -0.12 0.00 0.00 57.88 57.41 1d1d h LEU 22 Cb 0.28 -0.28 -0.02 0.00 -0.73 0.00 0.00 40.66 39.92 1d1d h LEU 22 CO 0.00 1.09 -0.12 0.00 -0.62 0.00 0.00 178.44 178.80 1d1d h ALA 23 N 0.96 1.31 -0.64 1.25 0.00 0.45 -2.28 119.26 120.31 1d1d h ALA 23 Ca 0.16 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1d1d h ALA 23 Cb 0.59 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 1d1d h ALA 23 CO 0.04 0.46 0.32 -0.44 0.00 0.00 0.00 179.25 179.63 1d1d h ASP 24 N 0.41 0.82 -0.74 0.00 3.32 0.36 -1.84 116.42 118.75 1d1d h ASP 24 Ca 0.08 -0.12 -0.01 0.00 0.02 0.00 0.00 57.03 57.00 1d1d h ASP 24 Cb 0.46 -0.21 -0.04 0.00 0.22 0.00 0.00 39.33 39.76 1d1d h ASP 24 CO 0.03 0.71 0.44 0.74 -1.72 0.00 0.00 179.24 179.43 1d1d h THR 25 N 0.87 1.21 -0.71 0.35 2.02 -0.87 -0.98 112.91 114.80 1d1d h THR 25 Ca 0.22 -0.49 -0.02 0.00 0.77 0.00 0.00 66.41 66.88 1d1d h THR 25 Cb 0.10 0.17 -0.03 0.00 -1.74 0.00 0.00 68.15 66.65 1d1d h THR 25 CO -0.03 0.23 0.36 0.58 0.37 0.00 0.00 175.52 177.03 1d1d h VAL 26 N 1.04 1.23 -0.14 3.16 2.07 -0.96 1.07 116.25 123.72 1d1d h VAL 26 Ca 0.27 -0.61 -0.01 0.00 0.82 0.00 0.00 66.70 67.17 1d1d h VAL 26 Cb -0.02 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 30.07 1d1d h VAL 26 CO -0.05 0.26 0.06 -0.09 0.02 0.00 0.00 177.57 177.77 1d1d h ARG 27 N 0.99 0.20 0.00 1.57 2.43 -0.55 1.39 114.38 120.41 1d1d h ARG 27 Ca 0.25 -0.03 -0.10 0.00 -0.81 0.00 0.00 59.98 59.28 1d1d h ARG 27 Cb 0.08 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.59 1d1d h ARG 27 CO -0.03 0.27 -0.48 1.79 -1.51 0.00 0.00 179.97 180.00 1d1d h THR 28 N 0.08 1.28 0.00 0.20 1.35 -0.90 -2.25 112.91 112.68 1d1d h THR 28 Ca 0.05 -1.69 0.00 0.00 -0.55 0.00 0.00 66.41 64.21 1d1d h THR 28 Cb 0.14 1.93 0.00 0.00 -1.73 0.00 0.00 68.15 68.49 1d1d h THR 28 CO -0.01 0.47 -0.39 0.29 -0.25 0.00 0.00 175.52 175.64 1d1d n LYS 29 N -3.87 0.22 -0.08 4.72 4.76 0.37 -5.01 118.16 119.27 1d1d n LYS 29 Ca -0.01 0.10 0.00 0.00 -2.87 0.00 0.00 58.31 55.53 1d1d n LYS 29 Cb 0.52 -1.68 0.00 0.00 -1.84 0.00 0.00 35.03 32.03 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 1.36 0.56 0.23 0.72 0.00 0.47 -4.50 105.19 104.04 1d1d n GLY 30 Ca 0.04 -1.12 0.08 0.00 0.00 0.00 0.00 46.02 45.02 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 -0.87 0.99 5.85 -1.69 0.22 115.31 119.81 1d1d h LEU 31 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1d1d h LEU 31 Cb 0.00 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.03 1d1d h LEU 31 CO 0.00 0.20 -0.01 -1.14 -0.34 0.00 0.00 178.44 177.15 1d1d n ARG 32 N -4.01 1.57 -2.32 1.25 0.63 -1.26 -4.80 116.66 107.72 1d1d n ARG 32 Ca -0.02 -0.87 -0.25 0.00 -0.92 0.00 0.00 57.85 55.79 1d1d n ARG 32 Cb 0.28 -1.48 0.06 0.00 0.45 0.00 0.00 32.46 31.76 1d1d n ARG 32 CO 0.00 0.00 0.00 -1.54 -2.51 0.00 0.00 177.63 173.58 1d1d s SER 33 N -2.02 5.02 0.21 6.15 1.04 0.06 -5.00 113.70 119.16 1d1d s SER 33 Ca 0.38 0.41 0.07 0.00 0.48 0.00 0.00 55.95 57.29 1d1d s SER 33 Cb 0.21 -1.16 0.13 0.00 0.10 0.00 0.00 66.02 65.30 1d1d s SER 33 CO 0.35 -1.43 1.47 1.55 0.98 0.00 0.00 173.24 176.16 1d1d h PRO 34 N -0.41 0.07 -0.20 4.02 0.13 -1.87 -3.00 132.00 130.75 1d1d h PRO 34 Ca -0.44 -0.07 0.06 0.00 -0.87 0.00 0.00 66.00 64.68 1d1d h PRO 34 Cb 1.30 0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.44 1d1d h PRO 34 CO 0.59 0.80 0.39 0.82 -0.23 0.00 0.00 178.00 180.37 1d1d h ILE 35 N 0.04 0.18 -0.04 -3.56 1.08 -1.86 0.14 117.51 113.49 1d1d h ILE 35 Ca -0.02 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.45 1d1d h ILE 35 Cb 1.35 0.65 -0.00 0.00 -3.07 0.00 0.00 36.82 35.75 1d1d h ILE 35 CO 0.11 0.00 0.00 0.74 -0.69 0.00 0.00 178.15 178.31 1d1d h THR 36 N 0.00 1.22 -0.41 -0.27 2.02 -1.71 0.21 112.91 113.97 1d1d h THR 36 Ca 0.09 -0.68 -0.06 0.00 0.77 0.00 0.00 66.41 66.54 1d1d h THR 36 Cb 0.87 1.61 -0.02 0.00 -1.74 0.00 0.00 68.15 68.87 1d1d h THR 36 CO -0.00 0.18 0.01 0.24 0.37 0.00 0.00 175.52 176.32 1d1d h MET 37 N -0.20 0.66 0.12 6.66 2.86 -0.93 0.40 114.93 124.50 1d1d h MET 37 Ca 0.01 -0.15 -0.01 0.00 -2.06 0.00 0.00 59.70 57.49 1d1d h MET 37 Cb 0.29 -0.09 0.00 0.00 0.06 0.00 0.00 31.60 31.86 1d1d h MET 37 CO 0.00 0.67 -0.06 0.00 1.06 0.00 0.00 176.91 178.58 1d1d h ALA 38 N 1.39 -0.16 -0.24 6.32 0.00 -1.26 0.30 119.26 125.60 1d1d h ALA 38 Ca 0.13 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 1d1d h ALA 38 Cb 0.37 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1d1d h ALA 38 CO 0.01 -0.39 0.14 0.93 0.00 0.00 0.00 179.25 179.95 1d1d h GLU 39 N -0.57 0.33 -0.52 0.00 3.07 -0.42 0.40 114.58 116.87 1d1d h GLU 39 Ca -0.02 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.81 1d1d h GLU 39 Cb 0.45 -0.07 -0.03 0.00 -0.84 0.00 0.00 28.75 28.27 1d1d h GLU 39 CO 0.03 0.28 0.32 0.28 -1.40 0.00 0.00 179.01 178.52 1d1d h VAL 40 N 0.29 1.15 0.00 3.13 2.07 -0.22 -0.82 116.25 121.84 1d1d h VAL 40 Ca 0.09 -0.31 -0.03 0.00 0.82 0.00 0.00 66.70 67.26 1d1d h VAL 40 Cb 0.04 0.43 -0.00 0.00 -1.52 0.00 0.00 31.29 30.23 1d1d h VAL 40 CO -0.02 0.15 -0.16 -0.33 0.02 0.00 0.00 177.57 177.23 1d1d h GLU 41 N 0.69 0.00 0.46 1.57 5.08 -0.02 0.23 114.58 122.60 1d1d h GLU 41 Ca 0.19 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.52 1d1d h GLU 41 Cb -0.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.22 1d1d h GLU 41 CO -0.04 0.16 -0.22 0.00 -1.00 0.00 0.00 179.01 177.91 1d1d h ALA 42 N 1.84 -0.62 -0.07 3.43 0.00 0.13 1.66 119.26 125.64 1d1d h ALA 42 Ca -0.00 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.67 1d1d h ALA 42 Cb 0.49 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1d1d h ALA 42 CO 0.02 -0.79 -0.24 1.37 0.00 0.00 0.00 179.25 179.61 1d1d h LEU 43 N -0.73 0.33 -0.21 0.00 -0.00 -1.30 -2.95 115.31 110.44 1d1d h LEU 43 Ca -0.06 -0.63 0.00 0.00 -0.00 0.00 0.00 57.88 57.19 1d1d h LEU 43 Cb 0.53 -0.10 0.00 0.00 -0.00 0.00 0.00 40.66 41.09 1d1d h LEU 43 CO 0.10 0.90 0.00 0.23 -0.00 0.00 0.00 178.44 179.68 1d1d n MET 44 N -4.50 0.05 -0.61 0.17 2.81 0.80 -3.34 117.12 112.51 1d1d n MET 44 Ca -0.08 0.33 0.46 0.00 -1.81 0.00 0.00 57.70 56.60 1d1d n MET 44 Cb 0.45 -1.60 0.72 0.00 -0.71 0.00 0.00 33.22 32.08 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 -1.70 0.03 -4.80 7.83 2.88 0.57 -4.26 113.62 114.17 1d1d n SER 45 Ca 0.03 0.96 -0.22 0.00 -1.33 0.00 0.00 58.87 58.31 1d1d n SER 45 Cb 0.16 -0.48 -0.05 0.00 -0.75 0.00 0.00 64.21 63.10 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 -3.95 4.98 0.44 -3.46 1.04 -1.21 -5.07 113.70 106.46 1d1d s SER 46 Ca -0.05 -0.66 -0.22 0.00 0.48 0.00 0.00 55.95 55.50 1d1d s SER 46 Cb 0.25 -0.81 -0.09 0.00 0.10 0.00 0.00 66.02 65.48 1d1d s SER 46 CO 0.79 -0.37 1.05 -2.16 0.98 0.00 0.00 173.24 173.53 1d1d s PRO 47 N -3.94 3.99 0.27 4.02 0.04 -1.26 -4.94 135.00 133.18 1d1d s PRO 47 Ca 0.40 1.45 -0.08 0.00 0.04 0.00 0.00 61.00 62.81 1d1d s PRO 47 Cb -0.04 -2.33 -0.01 0.00 0.04 0.00 0.00 34.50 32.17 1d1d s PRO 47 CO 0.25 -0.28 0.44 -0.48 0.04 0.00 0.00 177.00 176.96 1d1d s LEU 48 N -3.04 0.63 0.81 -3.56 0.05 -1.26 -4.99 118.68 107.32 1d1d s LEU 48 Ca 0.62 -1.16 -0.12 0.00 0.05 0.00 0.00 54.13 53.52 1d1d s LEU 48 Cb -0.19 1.52 0.08 0.00 -2.05 0.00 0.00 46.19 45.54 1d1d s LEU 48 CO 0.24 -1.16 1.10 -0.76 -0.55 0.00 0.00 176.35 175.22 1d1d s LEU 49 N -3.10 2.55 0.20 1.48 2.01 -1.26 -4.72 118.68 115.84 1d1d s LEU 49 Ca 0.27 1.28 0.06 0.00 0.01 0.00 0.00 54.13 55.75 1d1d s LEU 49 Cb 0.00 -3.87 0.10 0.00 0.01 0.00 0.00 46.19 42.43 1d1d s LEU 49 CO 0.13 -2.03 1.46 1.55 1.01 0.00 0.00 176.35 178.47 1d1d h PRO 50 N -1.13 0.11 -0.44 1.29 0.13 -1.93 -2.83 132.00 127.20 1d1d h PRO 50 Ca -0.47 -0.11 -0.11 0.00 -0.87 0.00 0.00 66.00 64.44 1d1d h PRO 50 Cb 1.27 0.03 -0.01 0.00 0.13 0.00 0.00 31.00 32.42 1d1d h PRO 50 CO 0.59 0.84 -0.17 1.25 -0.23 0.00 0.00 178.00 180.28 1d1d h HIS 51 N 0.07 1.01 -0.20 1.56 2.76 -1.93 -2.58 115.15 115.84 1d1d h HIS 51 Ca -0.02 -0.24 -0.04 0.00 -2.20 0.00 0.00 60.37 57.87 1d1d h HIS 51 Cb 1.37 -0.24 -0.01 0.00 1.55 0.00 0.00 27.41 30.08 1d1d h HIS 51 CO 0.01 1.02 -0.07 -0.44 -1.30 0.00 0.00 177.93 177.15 1d1d h ASP 52 N 0.72 0.29 -0.53 3.26 3.32 -1.94 -1.44 116.42 120.10 1d1d h ASP 52 Ca 0.10 -0.05 0.02 0.00 0.02 0.00 0.00 57.03 57.12 1d1d h ASP 52 Cb 0.72 -0.08 -0.03 0.00 0.22 0.00 0.00 39.33 40.17 1d1d h ASP 52 CO 0.06 0.40 0.33 0.58 -1.72 0.00 0.00 179.24 178.89 1d1d h VAL 53 N 0.30 1.09 -0.20 -1.35 2.07 -1.21 1.01 116.25 117.96 1d1d h VAL 53 Ca 0.07 -0.23 -0.04 0.00 0.82 0.00 0.00 66.70 67.32 1d1d h VAL 53 Cb 0.32 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 30.44 1d1d h VAL 53 CO 0.01 0.12 -0.01 0.71 0.02 0.00 0.00 177.57 178.42 1d1d h THR 54 N 0.67 1.26 -0.32 2.57 1.35 -1.18 0.46 112.91 117.72 1d1d h THR 54 Ca 0.21 -0.92 -0.04 0.00 -0.55 0.00 0.00 66.41 65.11 1d1d h THR 54 Cb -0.02 1.47 -0.02 0.00 -1.73 0.00 0.00 68.15 67.85 1d1d h THR 54 CO -0.07 0.28 0.02 -0.55 -0.25 0.00 0.00 175.52 174.94 1d1d h ASN 55 N 0.11 0.45 0.16 5.36 -1.07 -0.89 0.40 115.58 120.09 1d1d h ASN 55 Ca 0.05 -0.08 -0.01 0.00 0.07 0.00 0.00 56.30 56.34 1d1d h ASN 55 Cb 0.42 -0.12 0.00 0.00 -2.07 0.00 0.00 38.32 36.56 1d1d h ASN 55 CO 0.01 0.51 -0.07 0.25 0.07 0.00 0.00 177.43 178.20 1d1d h LEU 56 N 0.47 -0.18 -0.48 6.14 5.85 0.13 -2.43 115.31 124.82 1d1d h LEU 56 Ca 0.11 -0.37 0.04 0.00 0.84 0.00 0.00 57.88 58.50 1d1d h LEU 56 Cb 0.28 0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.32 1d1d h LEU 56 CO 0.01 0.35 0.24 0.24 -0.34 0.00 0.00 178.44 178.94 1d1d h MET 57 N -0.80 0.45 -0.73 1.25 2.86 0.13 -0.16 114.93 117.93 1d1d h MET 57 Ca -0.02 -0.03 0.08 0.00 -2.06 0.00 0.00 59.70 57.67 1d1d h MET 57 Cb 0.53 -0.10 -0.05 0.00 0.06 0.00 0.00 31.60 32.04 1d1d h MET 57 CO 0.03 0.30 0.48 -0.09 1.06 0.00 0.00 176.91 178.69 1d1d h ARG 58 N 0.46 0.68 -0.17 1.72 2.43 -0.27 2.06 114.38 121.29 1d1d h ARG 58 Ca 0.21 -0.04 -0.15 0.00 -0.81 0.00 0.00 59.98 59.18 1d1d h ARG 58 Cb 0.12 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.51 1d1d h ARG 58 CO -0.15 0.45 -0.54 0.28 -1.51 0.00 0.00 179.97 178.49 1d1d h VAL 59 N 0.70 1.33 0.07 0.20 2.07 -0.70 -3.18 116.25 116.73 1d1d h VAL 59 Ca 0.33 -1.80 -0.18 0.00 0.82 0.00 0.00 66.70 65.86 1d1d h VAL 59 Cb 0.36 1.79 0.02 0.00 -1.52 0.00 0.00 31.29 31.94 1d1d h VAL 59 CO -0.11 0.55 -0.76 0.40 0.02 0.00 0.00 177.57 177.67 1d1d h ILE 60 N 0.39 1.44 -4.19 4.57 2.04 0.82 -3.45 117.51 119.13 1d1d h ILE 60 Ca 0.01 -2.30 -0.59 0.00 1.00 0.00 0.00 64.86 62.98 1d1d h ILE 60 Cb 1.07 2.84 -0.30 0.00 -0.74 0.00 0.00 36.82 39.69 1d1d h ILE 60 CO 0.10 0.66 -0.85 -1.48 0.00 0.00 0.00 178.15 176.59 1d1d s LEU 61 N -8.11 2.00 0.95 1.44 2.34 0.68 -4.96 118.68 113.01 1d1d s LEU 61 Ca -0.13 -0.37 -0.12 0.00 0.06 0.00 0.00 54.13 53.57 1d1d s LEU 61 Cb 0.03 -1.04 0.15 0.00 -0.56 0.00 0.00 46.19 44.77 1d1d s LEU 61 CO 0.84 0.21 0.29 0.61 -1.06 0.00 0.00 176.35 177.24 1d1d n GLY 62 N 2.82 -2.32 0.22 -3.48 0.00 -1.25 -3.74 105.19 97.44 1d1d n GLY 62 Ca -0.16 -0.73 0.14 0.00 0.00 0.00 0.00 46.02 45.27 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 -2.63 0.00 0.54 1.61 0.13 -1.96 -2.15 132.00 127.55 1d1d h PRO 63 Ca -0.21 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.90 1d1d h PRO 63 Cb 0.66 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.80 1d1d h PRO 63 CO 0.13 0.00 -0.26 0.00 -0.23 0.00 0.00 178.00 177.64 1d1d h ALA 64 N 2.09 -0.73 0.00 -0.56 0.00 -1.98 -3.07 119.26 115.01 1d1d h ALA 64 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1d1d h ALA 64 Cb 0.71 0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1d1d h ALA 64 CO 0.00 -0.68 0.00 -0.35 0.00 0.00 0.00 179.25 178.22 1d1d n PRO 65 N -5.20 0.65 0.07 0.00 -0.04 -1.23 -3.01 135.00 126.24 1d1d n PRO 65 Ca -0.09 0.02 -0.21 0.00 -0.04 0.00 0.00 63.50 63.18 1d1d n PRO 65 Cb 0.28 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.11 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 0.82 -0.84 0.54 3.20 -1.31 -2.97 116.97 116.41 1d1d h TYR 66 Ca 0.00 -0.53 -0.02 0.00 3.14 0.00 0.00 58.73 61.33 1d1d h TYR 66 Cb 0.05 -0.06 -0.04 0.00 1.54 0.00 0.00 36.73 38.22 1d1d h TYR 66 CO 0.00 1.38 0.45 0.00 -1.64 0.00 0.00 178.16 178.34 1d1d h ALA 67 N 0.23 1.21 -0.65 1.82 0.00 -1.45 -0.27 119.26 120.16 1d1d h ALA 67 Ca -0.16 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.59 1d1d h ALA 67 Cb 1.74 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 19.17 1d1d h ALA 67 CO 0.20 0.63 0.30 -0.07 0.00 0.00 0.00 179.25 180.31 1d1d h LEU 68 N 1.17 0.83 -0.80 0.00 4.07 -1.68 -0.36 115.31 118.54 1d1d h LEU 68 Ca 0.29 -0.09 -0.11 0.00 0.08 0.00 0.00 57.88 58.05 1d1d h LEU 68 Cb 0.05 -0.21 -0.01 0.00 1.08 0.00 0.00 40.66 41.56 1d1d h LEU 68 CO -0.05 0.71 -0.28 -0.25 -1.08 0.00 0.00 178.44 177.50 1d1d h TRP 69 N 0.91 0.67 -0.45 1.13 7.01 -1.10 -1.94 115.95 122.18 1d1d h TRP 69 Ca 0.22 -0.16 -0.03 0.00 2.11 0.00 0.00 58.89 61.04 1d1d h TRP 69 Cb 0.11 -0.16 -0.02 0.00 -2.10 0.00 0.00 29.16 26.99 1d1d h TRP 69 CO 0.01 0.81 0.16 0.52 -2.79 0.00 0.00 178.44 177.15 1d1d h MET 70 N 0.51 0.68 -0.56 2.65 2.86 0.30 1.30 114.93 122.67 1d1d h MET 70 Ca 0.07 -0.13 -0.01 0.00 -2.06 0.00 0.00 59.70 57.56 1d1d h MET 70 Cb 0.74 -0.11 -0.03 0.00 0.06 0.00 0.00 31.60 32.27 1d1d h MET 70 CO 0.06 0.64 0.30 0.22 1.06 0.00 0.00 176.91 179.18 1d1d h ASP 71 N 0.59 0.71 0.55 1.22 1.82 -0.91 0.44 116.42 120.84 1d1d h ASP 71 Ca 0.15 -0.11 -0.15 0.00 -0.39 0.00 0.00 57.03 56.53 1d1d h ASP 71 Cb 0.22 -0.18 -0.02 0.00 0.68 0.00 0.00 39.33 40.03 1d1d h ASP 71 CO -0.01 0.61 -0.68 0.00 -1.61 0.00 0.00 179.24 177.56 1d1d h ALA 72 N 1.13 0.83 -0.17 -0.78 0.00 -1.07 -2.51 119.26 116.68 1d1d h ALA 72 Ca 0.20 -0.60 -0.03 0.00 0.00 0.00 0.00 54.91 54.48 1d1d h ALA 72 Cb 0.07 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1d1d h ALA 72 CO -0.03 0.81 0.01 2.35 0.00 0.00 0.00 179.25 182.39 1d1d h TRP 73 N 0.08 0.32 -0.67 0.00 7.01 0.24 0.34 115.95 123.27 1d1d h TRP 73 Ca -0.01 -0.05 0.06 0.00 2.11 0.00 0.00 58.89 60.99 1d1d h TRP 73 Cb 1.21 -0.08 -0.05 0.00 -2.10 0.00 0.00 29.16 28.13 1d1d h TRP 73 CO 0.01 0.49 0.37 0.78 -2.79 0.00 0.00 178.44 177.31 1d1d h GLY 74 N 0.06 0.98 0.90 2.65 0.00 -0.07 0.45 103.07 108.02 1d1d h GLY 74 Ca 0.05 -0.26 -0.08 0.00 0.00 0.00 0.00 47.33 47.04 1d1d h GLY 74 CO 0.01 0.16 -0.11 -2.08 0.00 0.00 0.00 176.54 174.52 1d1d h VAL 75 N 0.69 1.29 -0.43 4.60 2.07 -1.27 -1.91 116.25 121.29 1d1d h VAL 75 Ca 0.30 -1.19 0.02 0.00 0.82 0.00 0.00 66.70 66.65 1d1d h VAL 75 Cb 0.17 1.45 -0.03 0.00 -1.52 0.00 0.00 31.29 31.37 1d1d h VAL 75 CO -0.18 0.38 0.24 1.56 0.02 0.00 0.00 177.57 179.59 1d1d h GLN 76 N 0.34 0.46 -0.38 1.57 1.08 0.38 -0.82 115.11 117.74 1d1d h GLN 76 Ca 0.07 -0.03 0.04 0.00 -1.45 0.00 0.00 58.65 57.28 1d1d h GLN 76 Cb 0.62 -0.10 -0.04 0.00 -0.05 0.00 0.00 27.48 27.91 1d1d h GLN 76 CO 0.04 0.31 0.17 -0.07 -0.95 0.00 0.00 178.83 178.33 1d1d h LEU 77 N 0.48 0.23 -1.97 1.46 3.38 -0.04 0.02 115.31 118.86 1d1d h LEU 77 Ca 0.18 0.03 0.04 0.00 0.09 0.00 0.00 57.88 58.21 1d1d h LEU 77 Cb 0.04 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 1d1d h LEU 77 CO -0.10 0.17 0.11 1.56 0.09 0.00 0.00 178.44 180.28 1d1d h GLN 78 N 0.36 0.03 -0.34 1.13 4.20 -0.72 0.18 115.11 119.95 1d1d h GLN 78 Ca 0.17 -0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.80 1d1d h GLN 78 Cb 0.10 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.86 1d1d h GLN 78 CO -0.14 0.02 -0.10 0.00 -0.67 0.00 0.00 178.83 177.94 1d1d h THR 79 N 0.03 1.24 -0.18 -0.54 1.03 0.43 0.41 112.91 115.33 1d1d h THR 79 Ca 0.07 -1.04 -0.11 0.00 -0.01 0.00 0.00 66.41 65.32 1d1d h THR 79 Cb 0.25 1.09 0.00 0.00 -1.07 0.00 0.00 68.15 68.42 1d1d h THR 79 CO -0.00 0.35 -0.31 0.58 -0.01 0.00 0.00 175.52 176.12 1d1d h VAL 80 N 0.54 1.34 -0.05 0.00 2.07 -0.54 0.60 116.25 120.22 1d1d h VAL 80 Ca 0.10 -1.55 -0.01 0.00 0.82 0.00 0.00 66.70 66.07 1d1d h VAL 80 Cb 0.50 1.90 -0.00 0.00 -1.52 0.00 0.00 31.29 32.17 1d1d h VAL 80 CO 0.03 0.47 0.01 0.40 0.02 0.00 0.00 177.57 178.50 1d1d h ILE 81 N 0.18 1.20 -0.24 4.57 5.03 -1.11 0.43 117.51 127.57 1d1d h ILE 81 Ca 0.01 -0.61 -0.07 0.00 -0.12 0.00 0.00 64.86 64.07 1d1d h ILE 81 Cb 0.90 1.52 -0.01 0.00 -3.03 0.00 0.00 36.82 36.20 1d1d h ILE 81 CO 0.07 0.17 -0.17 0.00 -0.68 0.00 0.00 178.15 177.53 1d1d h ALA 82 N 0.78 1.26 -0.27 1.87 0.00 -0.21 0.24 119.26 122.93 1d1d h ALA 82 Ca 0.02 -0.28 -0.06 0.00 0.00 0.00 0.00 54.91 54.58 1d1d h ALA 82 Cb 0.26 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1d1d h ALA 82 CO 0.00 0.49 -0.08 0.00 0.00 0.00 0.00 179.25 179.66 1d1d h ALA 83 N 1.44 0.37 0.08 0.00 0.00 0.55 0.50 119.26 122.20 1d1d h ALA 83 Ca 0.07 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.69 1d1d h ALA 83 Cb 0.53 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1d1d h ALA 83 CO 0.03 0.20 -0.04 0.00 0.00 0.00 0.00 179.25 179.44 1d1d h ALA 84 N 0.77 -0.10 -0.04 0.00 0.00 0.21 0.39 119.26 120.48 1d1d h ALA 84 Ca 0.07 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1d1d h ALA 84 Cb 0.56 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1d1d h ALA 84 CO 0.03 -0.42 -0.09 0.00 0.00 0.00 0.00 179.25 178.77 1d1d h THR 85 N -0.38 1.09 -0.01 0.00 1.03 -0.51 -2.13 112.91 112.01 1d1d h THR 85 Ca -0.01 -0.41 -0.26 0.00 -0.01 0.00 0.00 66.41 65.72 1d1d h THR 85 Cb 0.33 1.16 0.02 0.00 -1.07 0.00 0.00 68.15 68.58 1d1d h THR 85 CO 0.02 0.12 -1.02 0.03 -0.01 0.00 0.00 175.52 174.66 1d1d h ARG 86 N 0.06 0.67 -3.78 0.00 3.08 0.32 -3.43 114.38 111.30 1d1d h ARG 86 Ca 0.01 -0.71 -0.46 0.00 0.07 0.00 0.00 59.98 58.89 1d1d h ARG 86 Cb 0.20 0.20 -0.38 0.00 0.08 0.00 0.00 29.97 30.07 1d1d h ARG 86 CO 0.01 1.30 -0.77 0.16 -1.07 0.00 0.00 179.97 179.60 1d1d s ASP 87 N -7.26 1.83 -0.63 7.04 1.47 0.14 -5.03 116.67 114.23 1d1d s ASP 87 Ca -0.09 -0.20 -0.06 0.00 1.18 0.00 0.00 52.55 53.38 1d1d s ASP 87 Cb 0.07 -0.53 -0.13 0.00 -0.34 0.00 0.00 42.92 41.99 1d1d s ASP 87 CO 0.91 -0.19 2.67 -0.81 0.68 0.00 0.00 175.17 178.43 1d1d n PRO 88 N 5.10 2.17 -0.23 2.11 -0.04 -1.19 -3.51 135.00 139.40 1d1d n PRO 88 Ca -0.08 -1.28 0.02 0.00 -0.04 0.00 0.00 63.50 62.11 1d1d n PRO 88 Cb 0.50 -2.25 0.02 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 0.52 -3.39 0.54 5.12 -1.26 -5.03 116.66 116.46 1d1d n ARG 89 Ca 0.46 -1.15 -0.38 0.00 -1.93 0.00 0.00 57.85 54.85 1d1d n ARG 89 Cb 0.43 -0.71 -0.06 0.00 -1.16 0.00 0.00 32.46 30.96 1d1d n ARG 89 CO 0.00 0.00 0.00 -1.01 -1.93 0.00 0.00 177.63 174.69 1d1d s HIS 90 N -0.55 3.74 -0.09 -1.55 3.76 -1.23 -4.97 115.29 114.40 1d1d s HIS 90 Ca 0.05 1.10 0.25 0.00 -0.15 0.00 0.00 55.06 56.31 1d1d s HIS 90 Cb 0.04 -2.40 0.72 0.00 1.11 0.00 0.00 32.58 32.05 1d1d s HIS 90 CO 0.00 0.57 1.74 -1.00 -0.85 0.00 0.00 174.74 175.21 1d1d h PRO 91 N 4.85 0.00 0.00 8.40 0.13 -1.97 -2.60 132.00 140.80 1d1d h PRO 91 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 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 0.64 0.15 -0.02 0.00 -0.23 0.00 0.00 178.00 178.53 1d1d n ALA 92 N -2.16 2.33 -2.44 -0.56 0.00 -1.26 -4.76 120.51 111.67 1d1d n ALA 92 Ca 0.02 -0.06 -0.27 0.00 0.00 0.00 0.00 53.44 53.13 1d1d n ALA 92 Cb 0.48 -1.46 -0.12 0.00 0.00 0.00 0.00 19.45 18.36 1d1d n ALA 92 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1d1d s ASN 93 N -3.99 3.50 0.00 0.00 4.22 -0.98 -3.75 114.94 113.93 1d1d s ASN 93 Ca 0.12 -0.85 0.00 0.00 -2.14 0.00 0.00 52.86 49.99 1d1d s ASN 93 Cb 0.15 -0.29 0.00 0.00 1.28 0.00 0.00 41.25 42.39 1d1d s ASN 93 CO 0.58 0.12 0.00 0.61 -2.04 0.00 0.00 177.10 176.37 1d1d n GLY 94 N 0.23 -0.31 0.81 0.45 0.00 -1.26 -4.62 105.19 100.49 1d1d n GLY 94 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.71 0.00 -0.48 1.61 7.27 -1.26 -4.91 117.38 118.90 1d1d n GLN 95 Ca 0.00 0.00 -0.28 0.00 0.07 0.00 0.00 57.00 56.79 1d1d n GLN 95 Cb 0.00 0.00 0.22 0.00 2.41 0.00 0.00 30.24 32.87 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 -1.20 -2.76 0.00 1.69 0.00 -1.26 -4.79 105.19 96.87 1d1d n GLY 96 Ca 0.00 -1.12 0.16 0.00 0.00 0.00 0.00 46.02 45.05 1d1d n GLY 96 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1d1d n ARG 97 N -3.66 0.99 -0.06 1.61 3.00 -1.26 -3.30 116.66 113.98 1d1d n ARG 97 Ca 0.05 0.00 -0.13 0.00 -0.01 0.00 0.00 57.85 57.76 1d1d n ARG 97 Cb 0.54 -1.49 -0.05 0.00 0.00 0.00 0.00 32.46 31.47 1d1d n ARG 97 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1d1d n GLY 98 N 0.97 -0.20 0.22 -0.13 0.00 -1.26 -4.68 105.19 100.12 1d1d n GLY 98 Ca 0.23 -0.06 -0.00 0.00 0.00 0.00 0.00 46.02 46.19 1d1d n GLY 98 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1d1d h GLU 99 N -0.40 0.09 -3.72 1.61 4.39 -1.91 -3.43 114.58 111.21 1d1d h GLU 99 Ca -0.31 -0.01 -0.43 0.00 0.34 0.00 0.00 59.36 58.95 1d1d h GLU 99 Cb 1.29 -0.02 0.06 0.00 -0.10 0.00 0.00 28.75 29.98 1d1d h GLU 99 CO -0.18 0.06 -0.25 -2.13 -1.16 0.00 0.00 179.01 175.36 1d1d n ARG 100 N -5.29 0.00 -1.21 2.33 0.63 -1.21 -4.16 116.66 107.75 1d1d n ARG 100 Ca 0.08 0.00 -0.29 0.00 -0.92 0.00 0.00 57.85 56.72 1d1d n ARG 100 Cb 0.32 -0.69 0.18 0.00 0.45 0.00 0.00 32.46 32.72 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 -0.48 1.98 0.00 5.15 -1.32 -1.25 -4.90 115.64 114.83 1d1d s THR 101 Ca 0.43 0.00 -0.23 0.00 -1.21 0.00 0.00 61.69 60.69 1d1d s THR 101 Cb -0.62 -2.53 0.05 0.00 -1.51 0.00 0.00 72.50 67.89 1d1d s THR 101 CO 0.35 0.00 0.51 0.20 -2.21 0.00 0.00 174.62 173.47 1d1d s ASN 102 N -3.55 -0.43 0.23 8.08 -0.87 -1.26 -4.94 114.94 112.20 1d1d s ASN 102 Ca 0.66 0.30 -0.06 0.00 -1.57 0.00 0.00 52.86 52.19 1d1d s ASN 102 Cb -0.18 0.46 0.33 0.00 -0.02 0.00 0.00 41.25 41.84 1d1d s ASN 102 CO 0.57 -0.62 1.81 0.25 -2.57 0.00 0.00 177.10 176.54 1d1d h LEU 103 N 3.12 0.62 -0.57 0.60 5.85 -1.98 0.20 115.31 123.16 1d1d h LEU 103 Ca -0.29 0.04 -0.03 0.00 0.84 0.00 0.00 57.88 58.44 1d1d h LEU 103 Cb 1.18 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 42.10 1d1d h LEU 103 CO 0.40 0.38 0.25 -0.78 -0.34 0.00 0.00 178.44 178.35 1d1d h ASP 104 N 0.75 0.77 -0.33 1.25 3.58 -1.97 0.33 116.42 120.80 1d1d h ASP 104 Ca 0.36 -0.15 0.01 0.00 0.42 0.00 0.00 57.03 57.66 1d1d h ASP 104 Cb 0.28 -0.20 -0.02 0.00 1.72 0.00 0.00 39.33 41.12 1d1d h ASP 104 CO -0.22 0.71 0.21 -0.09 -2.88 0.00 0.00 179.24 176.97 1d1d h ARG 105 N 0.78 0.42 0.00 0.28 2.43 -1.52 0.14 114.38 116.91 1d1d h ARG 105 Ca 0.19 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.34 1d1d h ARG 105 Cb 0.17 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.62 1d1d h ARG 105 CO -0.02 0.28 0.00 -0.07 -1.51 0.00 0.00 179.97 178.65 1d1d h LEU 106 N 0.43 0.00 0.13 3.80 3.38 -0.35 -2.85 115.31 119.85 1d1d h LEU 106 Ca 0.12 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.84 1d1d h LEU 106 Cb -0.03 0.00 0.03 0.00 0.09 0.00 0.00 40.66 40.74 1d1d h LEU 106 CO -0.04 0.00 -1.06 0.11 0.09 0.00 0.00 178.44 177.54 1d1d h LYS 107 N 0.00 0.49 0.00 1.13 6.56 0.15 -3.46 116.57 121.43 1d1d h LYS 107 Ca 0.00 -0.70 0.00 0.00 -1.06 0.00 0.00 60.65 58.89 1d1d h LYS 107 Cb 0.51 0.24 0.00 0.00 -0.57 0.00 0.00 32.23 32.41 1d1d h LYS 107 CO 0.00 1.31 0.00 0.41 -2.06 0.00 0.00 179.45 179.11 1d1d n GLY 108 N 1.47 1.61 1.12 3.86 0.00 0.30 -4.95 105.19 108.59 1d1d n GLY 108 Ca -0.14 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.00 1d1d n GLY 108 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1d1d n LEU 109 N 0.00 3.35 -4.69 0.99 7.94 -1.05 -3.03 117.00 120.51 1d1d n LEU 109 Ca 0.00 -1.45 -0.33 0.00 -1.11 0.00 0.00 56.01 53.12 1d1d n LEU 109 Cb 0.00 -0.25 0.14 0.00 0.53 0.00 0.00 43.42 43.84 1d1d n LEU 109 CO 0.00 0.73 0.75 0.00 -1.11 0.00 0.00 177.39 177.75 1d1d s ALA 110 N -1.50 1.74 0.05 1.96 0.00 -1.26 -4.65 121.76 118.10 1d1d s ALA 110 Ca 0.39 0.78 -0.33 0.00 0.00 0.00 0.00 51.96 52.80 1d1d s ALA 110 Cb 0.23 -3.48 -0.12 0.00 0.00 0.00 0.00 23.12 19.74 1d1d s ALA 110 CO 0.31 -2.42 1.78 -3.47 0.00 0.00 0.00 175.76 171.96 1d1d n ASP 111 N -3.54 3.51 0.00 0.00 2.03 -1.26 0.74 116.55 118.03 1d1d n ASP 111 Ca 0.13 1.01 0.00 0.00 0.52 0.00 0.00 54.79 56.45 1d1d n ASP 111 Cb 0.51 -1.44 0.00 0.00 -0.72 0.00 0.00 41.12 39.47 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 4.05 0.71 0.05 0.27 0.00 -1.26 -4.80 105.19 104.21 1d1d n GLY 112 Ca 0.20 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.31 1d1d n GLY 112 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1d1d n MET 113 N -2.05 0.68 -3.25 1.61 1.56 0.23 -4.65 117.12 111.24 1d1d n MET 113 Ca 0.00 -0.10 -0.39 0.00 -0.27 0.00 0.00 57.70 56.94 1d1d n MET 113 Cb 0.02 -1.41 -0.07 0.00 2.15 0.00 0.00 33.22 33.91 1d1d n MET 113 CO 0.00 0.00 0.00 0.08 -0.73 0.00 0.00 175.97 175.32 1d1d s VAL 114 N -2.78 5.10 0.00 1.12 1.01 -1.12 -3.66 120.40 120.08 1d1d s VAL 114 Ca 0.08 0.91 0.00 0.00 0.00 0.00 0.00 61.98 62.98 1d1d s VAL 114 Cb 0.15 -3.83 0.00 0.00 0.00 0.00 0.00 36.38 32.70 1d1d s VAL 114 CO 0.77 0.16 0.00 0.61 0.00 0.00 0.00 175.10 176.64 1d1d n GLY 115 N 4.02 0.78 2.93 4.51 0.00 -1.26 -5.01 105.19 111.17 1d1d n GLY 115 Ca -0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.67 1d1d n GLY 115 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1d1d s ASN 116 N -2.70 4.31 0.00 1.61 3.84 -1.24 -5.02 114.94 115.75 1d1d s ASN 116 Ca 0.00 -1.71 0.00 0.00 0.21 0.00 0.00 52.86 51.36 1d1d s ASN 116 Cb 0.00 -1.31 0.00 0.00 -0.55 0.00 0.00 41.25 39.39 1d1d s ASN 116 CO 0.00 -0.34 0.23 -0.81 -2.79 0.00 0.00 177.10 173.39 1d1d n PRO 117 N 4.53 0.00 -0.16 0.43 -0.04 -1.26 -1.66 135.00 136.83 1d1d n PRO 117 Ca -0.03 0.42 -0.02 0.00 -0.04 0.00 0.00 63.50 63.82 1d1d n PRO 117 Cb 0.43 -1.04 0.07 0.00 -0.04 0.00 0.00 33.50 32.91 1d1d n PRO 117 CO 0.00 0.00 0.00 0.37 -0.04 0.00 0.00 175.50 175.83 1d1d h GLN 118 N 0.00 0.26 -0.69 0.54 -0.00 -1.95 0.18 115.11 113.45 1d1d h GLN 118 Ca 0.00 -0.02 0.03 0.00 -0.00 0.00 0.00 58.65 58.66 1d1d h GLN 118 Cb 0.00 -0.06 -0.04 0.00 0.00 0.00 0.00 27.48 27.38 1d1d h GLN 118 CO 0.00 0.17 0.46 0.78 0.00 0.00 0.00 178.83 180.24 1d1d h GLY 119 N 0.27 0.95 0.95 2.39 0.00 -1.95 0.56 103.07 106.24 1d1d h GLY 119 Ca 0.25 -0.33 -0.06 0.00 0.00 0.00 0.00 47.33 47.19 1d1d h GLY 119 CO -0.31 0.30 0.05 -1.61 0.00 0.00 0.00 176.54 174.97 1d1d h GLN 120 N 0.85 0.72 -0.35 4.80 4.15 -0.09 0.26 115.11 125.44 1d1d h GLN 120 Ca 0.27 -0.20 -0.08 0.00 0.77 0.00 0.00 58.65 59.41 1d1d h GLN 120 Cb 0.04 -0.08 -0.02 0.00 0.21 0.00 0.00 27.48 27.63 1d1d h GLN 120 CO -0.07 0.76 -0.12 0.00 -1.93 0.00 0.00 178.83 177.47 1d1d h ALA 121 N 0.92 1.14 0.00 3.38 0.00 -0.33 0.51 119.26 124.88 1d1d h ALA 121 Ca 0.13 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1d1d h ALA 121 Cb 0.41 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1d1d h ALA 121 CO 0.01 0.54 0.00 0.00 0.00 0.00 0.00 179.25 179.80 1d1d h ALA 122 N 1.32 1.00 0.15 0.00 0.00 -0.56 -3.06 119.26 118.11 1d1d h ALA 122 Ca 0.10 0.00 -0.31 0.00 0.00 0.00 0.00 54.91 54.70 1d1d h ALA 122 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1d1d h ALA 122 CO 0.03 0.00 -1.53 -0.07 0.00 0.00 0.00 179.25 177.68 1d1d h LEU 123 N 0.00 0.49 -9.46 0.00 3.38 0.73 -3.45 115.31 107.01 1d1d h LEU 123 Ca 0.00 -0.64 -0.56 0.00 0.09 0.00 0.00 57.88 56.76 1d1d h LEU 123 Cb 0.75 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 41.29 1d1d h LEU 123 CO 0.00 1.53 0.03 -0.76 0.09 0.00 0.00 178.44 179.33 1d1d s LEU 124 N -7.13 4.38 0.85 1.67 1.43 0.05 -5.04 118.68 114.89 1d1d s LEU 124 Ca -0.10 1.18 -0.14 0.00 -1.03 0.00 0.00 54.13 54.05 1d1d s LEU 124 Cb 0.06 -3.00 0.02 0.00 0.03 0.00 0.00 46.19 43.30 1d1d s LEU 124 CO 0.87 0.01 0.60 -2.11 0.23 0.00 0.00 176.35 175.95 1d1d n ARG 125 N 3.14 -0.01 -2.35 1.70 -4.01 -1.26 -4.84 116.66 109.03 1d1d n ARG 125 Ca -0.04 0.05 -0.43 0.00 -1.04 0.00 0.00 57.85 56.39 1d1d n ARG 125 Cb 0.51 -1.96 -0.02 0.00 -3.04 0.00 0.00 32.46 27.95 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 -3.44 3.51 0.00 2.89 0.04 -1.26 -3.24 135.00 133.51 1d1d s PRO 126 Ca 0.63 0.86 0.00 0.00 0.04 0.00 0.00 61.00 62.52 1d1d s PRO 126 Cb -0.27 -4.05 0.00 0.00 0.04 0.00 0.00 34.50 30.22 1d1d s PRO 126 CO 0.61 -1.65 0.00 0.41 0.04 0.00 0.00 177.00 176.41 1d1d n GLY 127 N 5.13 3.20 0.32 0.56 0.00 -1.26 -4.96 105.19 108.17 1d1d n GLY 127 Ca 0.16 -0.43 0.07 0.00 0.00 0.00 0.00 46.02 45.82 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 0.44 -0.60 1.61 -0.00 -1.85 -1.01 114.58 113.17 1d1d h GLU 128 Ca 0.00 -0.03 0.01 0.00 -0.00 0.00 0.00 59.36 59.34 1d1d h GLU 128 Cb 0.00 -0.10 -0.03 0.00 -0.00 0.00 0.00 28.75 28.62 1d1d h GLU 128 CO 0.00 0.29 0.40 -0.07 -0.00 0.00 0.00 179.01 179.63 1d1d h LEU 129 N 0.45 0.69 -1.02 3.06 3.38 -1.84 -1.45 115.31 118.57 1d1d h LEU 129 Ca 0.18 -0.02 0.01 0.00 0.09 0.00 0.00 57.88 58.15 1d1d h LEU 129 Cb 0.16 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 40.69 1d1d h LEU 129 CO -0.04 0.50 0.66 0.58 0.09 0.00 0.00 178.44 180.22 1d1d h VAL 130 N 0.81 1.24 -0.86 1.22 2.07 -1.49 -0.19 116.25 119.06 1d1d h VAL 130 Ca 0.22 -0.46 0.07 0.00 0.82 0.00 0.00 66.70 67.35 1d1d h VAL 130 Cb -0.09 -0.21 -0.06 0.00 -1.52 0.00 0.00 31.29 29.41 1d1d h VAL 130 CO -0.05 0.24 0.53 0.00 0.02 0.00 0.00 177.57 178.31 1d1d h ALA 131 N 1.38 1.19 -0.53 1.67 0.00 -0.87 0.54 119.26 122.65 1d1d h ALA 131 Ca 0.37 -0.00 -0.11 0.00 0.00 0.00 0.00 54.91 55.16 1d1d h ALA 131 Cb -0.13 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.41 1d1d h ALA 131 CO -0.09 0.26 -0.12 0.82 0.00 0.00 0.00 179.25 180.13 1d1d h ILE 132 N 0.96 1.27 -0.07 0.00 2.04 -0.52 0.94 117.51 122.13 1d1d h ILE 132 Ca 0.38 -1.27 -0.00 0.00 1.00 0.00 0.00 64.86 64.96 1d1d h ILE 132 Cb 0.19 1.00 -0.00 0.00 -0.74 0.00 0.00 36.82 37.27 1d1d h ILE 132 CO -0.18 0.45 0.03 0.74 0.00 0.00 0.00 178.15 179.18 1d1d h THR 133 N 0.88 1.15 -0.23 -0.27 2.02 0.40 0.40 112.91 117.26 1d1d h THR 133 Ca 0.13 -0.44 -0.00 0.00 0.77 0.00 0.00 66.41 66.87 1d1d h THR 133 Cb 0.69 1.31 -0.01 0.00 -1.74 0.00 0.00 68.15 68.40 1d1d h THR 133 CO 0.05 0.12 0.13 0.00 0.37 0.00 0.00 175.52 176.20 1d1d h ALA 134 N 0.86 0.30 -0.37 6.16 0.00 0.10 -0.32 119.26 125.98 1d1d h ALA 134 Ca 0.02 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1d1d h ALA 134 Cb 0.18 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1d1d h ALA 134 CO -0.00 -0.18 0.16 0.77 0.00 0.00 0.00 179.25 180.00 1d1d h SER 135 N 0.27 0.46 -0.47 0.00 0.02 -0.67 0.23 113.55 113.39 1d1d h SER 135 Ca 0.08 -0.04 -0.06 0.00 -0.84 0.00 0.00 61.79 60.93 1d1d h SER 135 Cb 0.05 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 62.45 1d1d h SER 135 CO -0.01 0.41 0.05 0.00 -1.14 0.00 0.00 176.83 176.14 1d1d h ALA 136 N 1.67 0.62 -0.32 3.77 0.00 0.60 0.17 119.26 125.77 1d1d h ALA 136 Ca 0.13 -0.24 -0.09 0.00 0.00 0.00 0.00 54.91 54.71 1d1d h ALA 136 Cb 0.08 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1d1d h ALA 136 CO -0.02 0.37 -0.17 -0.07 0.00 0.00 0.00 179.25 179.37 1d1d h LEU 137 N 0.65 0.56 -0.77 0.00 4.07 -0.20 -1.74 115.31 117.87 1d1d h LEU 137 Ca 0.14 -0.17 -0.11 0.00 0.08 0.00 0.00 57.88 57.83 1d1d h LEU 137 Cb 0.42 -0.15 -0.01 0.00 1.08 0.00 0.00 40.66 42.00 1d1d h LEU 137 CO 0.01 0.74 -0.23 1.56 -1.08 0.00 0.00 178.44 179.44 1d1d h GLN 138 N 0.51 0.68 -0.10 1.13 7.50 -0.55 -2.35 115.11 121.93 1d1d h GLN 138 Ca 0.09 -0.27 -0.10 0.00 0.50 0.00 0.00 58.65 58.87 1d1d h GLN 138 Cb 0.58 -0.03 -0.01 0.00 0.05 0.00 0.00 27.48 28.06 1d1d h GLN 138 CO 0.04 0.85 -0.38 0.00 -1.50 0.00 0.00 178.83 177.84 1d1d h ALA 139 N 1.15 1.18 0.61 3.87 0.00 -0.52 -2.49 119.26 123.07 1d1d h ALA 139 Ca 0.08 -0.38 -0.03 0.00 0.00 0.00 0.00 54.91 54.58 1d1d h ALA 139 Cb 0.71 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.42 1d1d h ALA 139 CO 0.05 0.56 -0.30 0.35 0.00 0.00 0.00 179.25 179.91 1d1d h PHE 140 N 0.18 -0.77 -0.38 0.00 3.04 -0.86 -2.28 116.94 115.87 1d1d h PHE 140 Ca 0.02 -0.02 0.11 0.00 3.98 0.00 0.00 57.97 62.06 1d1d h PHE 140 Cb 0.76 0.25 -0.02 0.00 2.56 0.00 0.00 35.95 39.51 1d1d h PHE 140 CO 0.01 -0.48 0.44 0.07 -2.02 0.00 0.00 178.31 176.33 1d1d h ARG 141 N -1.00 0.00 -0.40 1.11 0.11 -1.46 0.41 114.38 113.16 1d1d h ARG 141 Ca -0.08 0.00 -0.16 0.00 0.10 0.00 0.00 59.98 59.84 1d1d h ARG 141 Cb 0.63 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.71 1d1d h ARG 141 CO 0.14 0.00 -0.36 1.49 0.10 0.00 0.00 179.97 181.34 1d1d h GLU 142 N 0.00 0.95 -0.10 0.08 4.57 -1.18 -0.24 114.58 118.67 1d1d h GLU 142 Ca 0.18 -0.49 -0.21 0.00 -1.18 0.00 0.00 59.36 57.66 1d1d h GLU 142 Cb 1.06 0.01 0.01 0.00 -0.16 0.00 0.00 28.75 29.67 1d1d h GLU 142 CO -0.00 1.15 -0.77 0.28 -1.18 0.00 0.00 179.01 178.49 1d1d h VAL 143 N 0.78 1.31 -0.34 0.32 2.07 0.31 0.25 116.25 120.94 1d1d h VAL 143 Ca 0.07 -2.01 0.01 0.00 0.82 0.00 0.00 66.70 65.59 1d1d h VAL 143 Cb 0.96 2.16 -0.02 0.00 -1.52 0.00 0.00 31.29 32.86 1d1d h VAL 143 CO 0.09 0.62 0.21 0.00 0.02 0.00 0.00 177.57 178.52 1d1d h ALA 144 N 0.48 0.43 -0.22 1.67 0.00 -0.97 -2.53 119.26 118.12 1d1d h ALA 144 Ca -0.07 -0.01 -0.19 0.00 0.00 0.00 0.00 54.91 54.64 1d1d h ALA 144 Cb 1.41 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 19.09 1d1d h ALA 144 CO 0.16 -0.14 -0.61 0.00 0.00 0.00 0.00 179.25 178.67 1d1d h ARG 145 N 0.43 0.73 -6.57 0.00 2.47 -1.04 -3.40 114.38 106.99 1d1d h ARG 145 Ca 0.13 -0.50 -0.55 0.00 -1.26 0.00 0.00 59.98 57.80 1d1d h ARG 145 Cb -0.02 0.07 -0.07 0.00 -1.65 0.00 0.00 29.97 28.30 1d1d h ARG 145 CO -0.05 1.12 0.98 -1.17 0.56 0.00 0.00 179.97 181.41 1d1d s LEU 146 N -8.48 3.44 0.02 3.04 2.96 0.89 -4.97 118.68 115.58 1d1d s LEU 146 Ca -0.09 0.10 -0.30 0.00 -0.22 0.00 0.00 54.13 53.61 1d1d s LEU 146 Cb 0.10 -3.15 -0.07 0.00 0.50 0.00 0.00 46.19 43.57 1d1d s LEU 146 CO 0.88 -1.50 1.59 0.00 -1.32 0.00 0.00 176.35 176.00 1d1d s ALA 147 N 4.99 3.64 -0.02 5.97 0.00 -1.26 -4.70 121.76 130.39 1d1d s ALA 147 Ca 0.43 1.06 -0.30 0.00 0.00 0.00 0.00 51.96 53.15 1d1d s ALA 147 Cb -0.07 -3.68 -0.05 0.00 0.00 0.00 0.00 23.12 19.31 1d1d s ALA 147 CO 0.25 -1.13 1.48 -1.83 0.00 0.00 0.00 175.76 174.53 1d1d s GLU 148 N 2.94 4.24 -1.05 0.00 -1.05 -1.26 -4.91 118.70 117.61 1d1d s GLU 148 Ca 0.71 2.04 -0.23 0.00 -0.15 0.00 0.00 54.97 57.35 1d1d s GLU 148 Cb -0.36 -3.70 -0.00 0.00 -0.44 0.00 0.00 34.13 29.63 1d1d s GLU 148 CO 0.30 -0.68 1.73 -1.25 0.95 0.00 0.00 175.26 176.32 1d1d s PRO 149 N 2.95 3.14 0.33 -4.83 0.04 -1.26 -4.96 135.00 130.41 1d1d s PRO 149 Ca 0.67 -0.97 -0.28 0.00 0.04 0.00 0.00 61.00 60.45 1d1d s PRO 149 Cb -0.32 -5.27 -0.09 0.00 0.04 0.00 0.00 34.50 28.86 1d1d s PRO 149 CO 0.27 -2.87 1.14 0.00 0.04 0.00 0.00 177.00 175.58 1d1d s ALA 150 N 7.49 3.33 0.28 8.56 0.00 -1.26 -4.95 121.76 135.21 1d1d s ALA 150 Ca 0.59 0.95 -0.29 0.00 0.00 0.00 0.00 51.96 53.22 1d1d s ALA 150 Cb -0.02 -3.36 -0.14 0.00 0.00 0.00 0.00 23.12 19.60 1d1d s ALA 150 CO -0.01 -0.33 1.05 0.41 0.00 0.00 0.00 175.76 176.89 1d1d n GLY 151 N 0.91 -0.15 0.18 0.00 0.00 -1.26 -4.90 105.19 99.96 1d1d n GLY 151 Ca 0.01 0.35 -0.18 0.00 0.00 0.00 0.00 46.02 46.20 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 2.23 0.59 -0.82 1.61 0.13 -1.93 -3.04 132.00 130.76 1d1d h PRO 152 Ca -0.40 -0.57 0.24 0.00 -0.87 0.00 0.00 66.00 64.40 1d1d h PRO 152 Cb 1.34 0.15 -0.03 0.00 0.13 0.00 0.00 31.00 32.58 1d1d h PRO 152 CO 0.62 1.19 0.63 0.11 -0.23 0.00 0.00 178.00 180.32 1d1d h TRP 153 N 0.20 0.00 -0.52 1.56 0.09 -1.90 1.24 115.95 116.62 1d1d h TRP 153 Ca -0.08 0.00 0.09 0.00 0.09 0.00 0.00 58.89 58.99 1d1d h TRP 153 Cb 1.41 0.00 -0.03 0.00 0.08 0.00 0.00 29.16 30.62 1d1d h TRP 153 CO 0.12 0.00 0.35 0.00 0.09 0.00 0.00 178.44 179.00 1d1d h ALA 154 N 1.51 2.06 0.00 0.11 0.00 -1.90 0.52 119.26 121.56 1d1d h ALA 154 Ca 0.39 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.27 1d1d h ALA 154 Cb 1.64 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 19.36 1d1d h ALA 154 CO -0.00 -0.17 -0.22 0.38 0.00 0.00 0.00 179.25 179.23 1d1d h ASP 155 N 0.33 0.00 -3.10 0.00 3.04 0.14 -3.44 116.42 113.39 1d1d h ASP 155 Ca 0.24 0.00 -0.58 0.00 -3.24 0.00 0.00 57.03 53.45 1d1d h ASP 155 Cb 0.51 0.00 -0.06 0.00 -1.04 0.00 0.00 39.33 38.74 1d1d h ASP 155 CO -0.06 0.08 0.77 -0.63 -2.04 0.00 0.00 179.24 177.36 1d1d s ILE 156 N -3.19 4.70 -0.07 4.15 1.01 0.18 -5.02 121.20 122.96 1d1d s ILE 156 Ca 0.05 2.00 0.00 0.00 0.00 0.00 0.00 60.65 62.71 1d1d s ILE 156 Cb 0.06 -4.30 0.02 0.00 0.01 0.00 0.00 42.46 38.25 1d1d s ILE 156 CO 0.70 -0.16 -0.06 -0.89 0.00 0.00 0.00 174.94 174.52 1d1d s THR 157 N 3.11 0.80 0.18 2.92 2.01 -1.26 -4.85 115.64 118.53 1d1d s THR 157 Ca 0.44 -0.22 -0.32 0.00 0.31 0.00 0.00 61.69 61.90 1d1d s THR 157 Cb -0.15 -0.82 -0.11 0.00 0.01 0.00 0.00 72.50 71.44 1d1d s THR 157 CO 0.07 0.31 1.63 -1.58 -0.69 0.00 0.00 174.62 174.35 1d1d s GLN 158 N 1.27 4.18 0.16 4.92 -0.44 -1.26 -4.98 119.66 123.50 1d1d s GLN 158 Ca -0.04 2.45 0.05 0.00 -2.50 0.00 0.00 55.36 55.32 1d1d s GLN 158 Cb -0.14 -3.15 -0.04 0.00 -1.64 0.00 0.00 33.01 28.04 1d1d s GLN 158 CO -0.02 -0.67 0.09 0.20 0.50 0.00 0.00 175.29 175.39 1d1d s GLY 159 N 1.24 1.75 0.40 2.59 0.00 -1.26 -4.22 107.32 107.82 1d1d s GLY 159 Ca 0.72 -1.24 0.27 0.00 0.00 0.00 0.00 44.72 44.48 1d1d s GLY 159 CO 0.32 -1.24 1.78 -0.56 0.00 0.00 0.00 173.10 173.40 1d1d h PRO 160 N 2.60 0.00 0.00 2.90 0.13 -2.00 -2.80 132.00 132.84 1d1d h PRO 160 Ca -0.47 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1d1d h PRO 160 Cb 1.20 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.33 1d1d h PRO 160 CO 0.62 0.00 -1.07 -1.13 -0.23 0.00 0.00 178.00 176.18 1d1d n SER 161 N -2.79 0.79 -4.69 1.44 3.41 -1.26 -4.85 113.62 105.68 1d1d n SER 161 Ca 0.03 0.31 -0.35 0.00 -0.26 0.00 0.00 58.87 58.59 1d1d n SER 161 Cb 0.38 0.55 -0.09 0.00 -0.26 0.00 0.00 64.21 64.79 1d1d n SER 161 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1d1d s GLU 162 N -3.37 3.51 0.24 4.33 2.02 -1.06 -5.06 118.70 119.31 1d1d s GLU 162 Ca -0.01 -0.34 -0.31 0.00 0.02 0.00 0.00 54.97 54.33 1d1d s GLU 162 Cb 0.10 -3.04 -0.13 0.00 0.10 0.00 0.00 34.13 31.16 1d1d s GLU 162 CO 0.80 0.52 1.56 0.45 0.02 0.00 0.00 175.26 178.61 1d1d n SER 163 N 2.75 3.44 0.07 -0.19 2.88 -1.26 -4.42 113.62 116.88 1d1d n SER 163 Ca -0.18 1.12 0.04 0.00 -1.33 0.00 0.00 58.87 58.52 1d1d n SER 163 Cb 0.53 -1.52 0.44 0.00 -0.75 0.00 0.00 64.21 62.91 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 5.13 0.38 0.14 0.66 3.57 -1.97 0.22 116.94 125.06 1d1d h PHE 164 Ca -0.45 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.03 1d1d h PHE 164 Cb 1.24 -0.12 0.00 0.00 2.79 0.00 0.00 35.95 39.86 1d1d h PHE 164 CO 0.59 0.31 -0.07 0.28 -2.23 0.00 0.00 178.31 177.19 1d1d h VAL 165 N 0.39 1.01 -0.27 1.41 2.07 -1.98 0.26 116.25 119.14 1d1d h VAL 165 Ca 0.10 -1.06 0.04 0.00 0.82 0.00 0.00 66.70 66.60 1d1d h VAL 165 Cb 0.09 1.62 -0.04 0.00 -1.52 0.00 0.00 31.29 31.44 1d1d h VAL 165 CO -0.01 0.23 0.03 0.44 0.02 0.00 0.00 177.57 178.28 1d1d h ASP 166 N -0.73 -0.05 -0.12 0.57 3.32 -1.87 -0.30 116.42 117.25 1d1d h ASP 166 Ca -0.02 0.05 -0.06 0.00 0.02 0.00 0.00 57.03 57.03 1d1d h ASP 166 Cb 0.52 0.08 -0.02 0.00 0.22 0.00 0.00 39.33 40.14 1d1d h ASP 166 CO 0.03 0.01 -0.09 0.15 -1.72 0.00 0.00 179.24 177.62 1d1d h PHE 167 N 0.12 0.45 0.02 4.55 3.04 -0.62 -2.76 116.94 121.74 1d1d h PHE 167 Ca 0.13 -0.06 -0.00 0.00 3.98 0.00 0.00 57.97 62.02 1d1d h PHE 167 Cb 0.15 -0.13 0.00 0.00 2.56 0.00 0.00 35.95 38.54 1d1d h PHE 167 CO -0.19 0.51 -0.01 0.00 -2.02 0.00 0.00 178.31 176.60 1d1d h ALA 168 N 1.51 -0.03 -0.87 2.41 0.00 0.81 -2.05 119.26 121.04 1d1d h ALA 168 Ca 0.08 -0.02 0.14 0.00 0.00 0.00 0.00 54.91 55.12 1d1d h ALA 168 Cb 0.41 0.01 -0.09 0.00 0.00 0.00 0.00 17.79 18.12 1d1d h ALA 168 CO 0.02 -0.50 0.47 -0.91 0.00 0.00 0.00 179.25 178.33 1d1d h ASN 169 N -0.06 0.59 -0.82 0.00 2.35 -0.84 0.31 115.58 117.12 1d1d h ASN 169 Ca -0.00 0.09 0.06 0.00 -0.55 0.00 0.00 56.30 55.89 1d1d h ASN 169 Cb 0.05 -0.01 -0.05 0.00 0.05 0.00 0.00 38.32 38.36 1d1d h ASN 169 CO 0.01 0.26 0.54 0.03 -1.65 0.00 0.00 177.43 176.61 1d1d h ARG 170 N 0.68 0.90 -0.14 0.81 3.08 -1.13 0.11 114.38 118.67 1d1d h ARG 170 Ca 0.47 -0.05 -0.09 0.00 0.07 0.00 0.00 59.98 60.38 1d1d h ARG 170 Cb 0.64 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.48 1d1d h ARG 170 CO -0.35 0.59 -0.32 1.25 -1.07 0.00 0.00 179.97 180.08 1d1d h LEU 171 N 0.92 0.28 -0.07 3.04 6.46 0.21 0.17 115.31 126.32 1d1d h LEU 171 Ca 0.35 -0.10 -0.02 0.00 -0.12 0.00 0.00 57.88 57.99 1d1d h LEU 171 Cb 0.19 -0.08 -0.00 0.00 -0.73 0.00 0.00 40.66 40.04 1d1d h LEU 171 CO -0.12 0.59 -0.03 0.40 -0.62 0.00 0.00 178.44 178.66 1d1d h ILE 172 N 0.24 1.32 -0.58 4.05 1.08 0.21 0.38 117.51 124.22 1d1d h ILE 172 Ca 0.03 -1.02 -0.03 0.00 -0.39 0.00 0.00 64.86 63.45 1d1d h ILE 172 Cb 0.69 1.86 -0.03 0.00 -3.07 0.00 0.00 36.82 36.27 1d1d h ILE 172 CO 0.05 0.28 0.25 0.50 -0.69 0.00 0.00 178.15 178.55 1d1d h LYS 173 N -0.23 0.83 0.15 2.37 1.63 -0.85 0.46 116.57 120.92 1d1d h LYS 173 Ca 0.02 -0.11 -0.01 0.00 -0.85 0.00 0.00 60.65 59.69 1d1d h LYS 173 Cb 0.47 -0.15 0.00 0.00 -0.60 0.00 0.00 32.23 31.94 1d1d h LYS 173 CO 0.01 0.66 -0.07 0.00 -3.45 0.00 0.00 179.45 176.60 1d1d h ALA 174 N 1.46 -0.20 -0.52 5.00 0.00 -0.80 0.77 119.26 124.99 1d1d h ALA 174 Ca 0.20 -0.20 0.05 0.00 0.00 0.00 0.00 54.91 54.95 1d1d h ALA 174 Cb 0.13 0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.94 1d1d h ALA 174 CO -0.02 -0.40 0.26 0.28 0.00 0.00 0.00 179.25 179.37 1d1d h VAL 175 N -0.62 0.95 0.37 0.00 2.07 0.07 -2.38 116.25 116.70 1d1d h VAL 175 Ca -0.02 -0.17 -0.01 0.00 0.82 0.00 0.00 66.70 67.32 1d1d h VAL 175 Cb 0.47 0.40 -0.00 0.00 -1.52 0.00 0.00 31.29 30.64 1d1d h VAL 175 CO 0.03 0.09 -0.22 -0.33 0.02 0.00 0.00 177.57 177.16 1d1d h GLU 176 N 0.50 -0.54 -1.30 1.57 5.08 -0.06 -2.00 114.58 117.83 1d1d h GLU 176 Ca 0.23 0.04 0.39 0.00 -1.00 0.00 0.00 59.36 59.02 1d1d h GLU 176 Cb 0.15 0.12 -0.10 0.00 0.50 0.00 0.00 28.75 29.42 1d1d h GLU 176 CO -0.16 -0.36 0.86 0.78 -1.00 0.00 0.00 179.01 179.13 1d1d h GLY 177 N -0.56 0.96 -0.94 -3.84 0.00 -0.42 -3.40 103.07 94.87 1d1d h GLY 177 Ca -0.04 -0.11 -0.48 0.00 0.00 0.00 0.00 47.33 46.70 1d1d h GLY 177 CO 0.04 -0.24 0.37 -1.35 0.00 0.00 0.00 176.54 175.37 1d1d s SER 178 N -4.72 4.71 -0.90 0.19 1.04 -0.75 -4.97 113.70 108.29 1d1d s SER 178 Ca -0.07 1.13 -0.00 0.00 0.48 0.00 0.00 55.95 57.48 1d1d s SER 178 Cb 0.27 -1.83 0.34 0.00 0.10 0.00 0.00 66.02 64.90 1d1d s SER 178 CO 0.82 -1.81 1.76 -0.67 0.98 0.00 0.00 173.24 174.32 1d1d n ASP 179 N -3.31 6.99 -4.76 7.02 2.03 -1.26 -4.98 116.55 118.28 1d1d n ASP 179 Ca 0.07 -3.74 -0.31 0.00 0.52 0.00 0.00 54.79 51.33 1d1d n ASP 179 Cb 0.58 -1.04 0.09 0.00 -0.72 0.00 0.00 41.12 40.02 1d1d n ASP 179 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1d1d s LEU 180 N -4.13 3.08 0.82 -2.67 1.43 -1.26 -5.02 118.68 110.92 1d1d s LEU 180 Ca 0.44 1.89 -0.12 0.00 -1.03 0.00 0.00 54.13 55.31 1d1d s LEU 180 Cb 0.29 -4.53 0.08 0.00 0.03 0.00 0.00 46.19 42.06 1d1d s LEU 180 CO -0.22 -2.05 1.10 -2.16 0.23 0.00 0.00 176.35 173.26 1d1d s PRO 181 N -4.73 1.92 -1.24 1.29 0.04 -1.26 -4.92 135.00 126.11 1d1d s PRO 181 Ca 0.63 0.58 -0.20 0.00 0.04 0.00 0.00 61.00 62.04 1d1d s PRO 181 Cb -0.18 -1.91 -0.01 0.00 0.04 0.00 0.00 34.50 32.45 1d1d s PRO 181 CO 0.54 -1.72 1.83 -1.25 0.04 0.00 0.00 177.00 176.44 1d1d s PRO 182 N -5.18 3.26 0.00 0.56 0.04 -1.26 -2.25 135.00 130.17 1d1d s PRO 182 Ca 0.61 -1.57 0.00 0.00 0.04 0.00 0.00 61.00 60.08 1d1d s PRO 182 Cb -0.14 -5.39 0.00 0.00 0.04 0.00 0.00 34.50 29.00 1d1d s PRO 182 CO 0.54 -3.09 0.00 0.43 0.04 0.00 0.00 177.00 174.92 1d1d n SER 183 N 11.31 0.00 0.05 6.66 7.64 -1.26 -4.94 113.62 133.07 1d1d n SER 183 Ca 0.47 0.00 0.13 0.00 1.01 0.00 0.00 58.87 60.47 1d1d n SER 183 Cb 0.46 0.00 0.37 0.00 -1.01 0.00 0.00 64.21 64.03 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 2.70 -2.27 -0.43 0.00 -0.95 -4.25 120.51 115.31 1d1d n ALA 184 Ca 0.00 -0.16 -0.42 0.00 0.00 0.00 0.00 53.44 52.85 1d1d n ALA 184 Cb 0.00 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.13 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 -1.89 3.49 0.00 0.00 1.74 -1.23 -2.75 116.66 116.02 1d1d n ARG 185 Ca 0.05 -3.39 0.00 0.00 -0.77 0.00 0.00 57.85 53.74 1d1d n ARG 185 Cb 0.39 -2.99 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 4.31 0.00 0.04 7.54 0.00 -1.26 -4.96 120.51 126.18 1d1d n ALA 186 Ca 0.42 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.71 1d1d n ALA 186 Cb 0.37 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.78 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 0.53 -0.91 0.00 0.13 -1.74 -2.84 132.00 127.17 1d1d h PRO 187 Ca 0.00 -0.51 0.04 0.00 -0.87 0.00 0.00 66.00 64.67 1d1d h PRO 187 Cb 0.00 0.13 -0.06 0.00 0.13 0.00 0.00 31.00 31.20 1d1d h PRO 187 CO 0.00 1.14 0.58 0.28 -0.23 0.00 0.00 178.00 179.77 1d1d h VAL 188 N 0.32 1.12 -0.14 1.56 2.07 -1.83 1.47 116.25 120.82 1d1d h VAL 188 Ca -0.07 -0.38 -0.01 0.00 0.82 0.00 0.00 66.70 67.06 1d1d h VAL 188 Cb 1.51 -0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 31.19 1d1d h VAL 188 CO 0.16 0.20 0.04 0.40 0.02 0.00 0.00 177.57 178.40 1d1d h ILE 189 N 1.10 1.18 -0.48 4.57 2.04 -1.77 0.12 117.51 124.27 1d1d h ILE 189 Ca 0.37 -0.54 -0.08 0.00 1.00 0.00 0.00 64.86 65.61 1d1d h ILE 189 Cb 0.06 1.28 -0.02 0.00 -0.74 0.00 0.00 36.82 37.40 1d1d h ILE 189 CO -0.14 0.16 -0.03 0.40 0.00 0.00 0.00 178.15 178.54 1d1d h ILE 190 N 0.04 1.25 -0.67 -0.67 2.04 -1.11 -2.50 117.51 115.90 1d1d h ILE 190 Ca 0.04 -1.07 -0.01 0.00 1.00 0.00 0.00 64.86 64.82 1d1d h ILE 190 Cb 0.21 0.92 -0.03 0.00 -0.74 0.00 0.00 36.82 37.18 1d1d h ILE 190 CO -0.00 0.37 0.36 -0.78 0.00 0.00 0.00 178.15 178.10 1d1d h ASP 191 N 0.75 0.84 -0.47 1.72 3.58 0.24 -2.16 116.42 120.92 1d1d h ASP 191 Ca 0.14 -0.10 0.08 0.00 0.42 0.00 0.00 57.03 57.57 1d1d h ASP 191 Cb 0.50 -0.21 -0.07 0.00 1.72 0.00 0.00 39.33 41.27 1d1d h ASP 191 CO 0.03 0.70 0.08 0.00 -2.88 0.00 0.00 179.24 177.16 1d1d h PHE 193 N 0.21 0.00 -0.03 0.00 0.04 -1.11 0.18 116.94 116.24 1d1d h PHE 193 Ca 0.24 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.98 1d1d h PHE 193 Cb 0.32 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.44 1d1d h PHE 193 CO -0.24 0.00 -0.53 2.89 -0.60 0.00 0.00 178.31 179.83 1d1d n ARG 194 N -4.13 1.60 0.00 1.51 -4.01 0.13 -3.13 116.66 108.62 1d1d n ARG 194 Ca 0.05 -3.29 -0.04 0.00 -1.04 0.00 0.00 57.85 53.54 1d1d n ARG 194 Cb 0.46 -1.58 -0.01 0.00 -3.04 0.00 0.00 32.46 28.29 1d1d n ARG 194 CO 0.00 0.00 0.00 0.94 -3.04 0.00 0.00 177.63 175.53 1d1d n GLN 195 N -1.05 0.12 -0.01 2.89 0.00 0.44 -4.94 117.38 114.82 1d1d n GLN 195 Ca 0.19 0.05 -0.02 0.00 -0.00 0.00 0.00 57.00 57.22 1d1d n GLN 195 Cb 0.72 -0.71 -0.01 0.00 0.00 0.00 0.00 30.24 30.24 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 -3.56 0.06 -0.95 3.69 0.00 -1.04 -5.05 118.16 111.32 1d1d n LYS 196 Ca -0.06 0.02 -0.32 0.00 0.00 0.00 0.00 58.31 57.95 1d1d n LYS 196 Cb 0.28 -0.91 0.02 0.00 0.00 0.00 0.00 35.03 34.42 1d1d n LYS 196 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.40 177.83 1d1d n SER 197 N -2.75 -4.26 -4.06 3.14 7.64 -1.19 -4.79 113.62 107.35 1d1d n SER 197 Ca -0.05 0.33 -0.37 0.00 1.01 0.00 0.00 58.87 59.80 1d1d n SER 197 Cb 0.55 -0.68 0.05 0.00 -1.01 0.00 0.00 64.21 63.12 1d1d n SER 197 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1d1d n GLN 198 N 1.76 -0.16 0.08 1.43 3.00 -1.26 -4.54 117.38 117.68 1d1d n GLN 198 Ca 0.02 -0.04 -0.09 0.00 -0.01 0.00 0.00 57.00 56.88 1d1d n GLN 198 Cb 0.44 -1.13 0.01 0.00 0.00 0.00 0.00 30.24 29.57 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 -1.14 0.27 0.01 -1.09 0.13 -1.94 -0.38 132.00 127.87 1d1d h PRO 199 Ca -0.43 -0.26 0.00 0.00 -0.87 0.00 0.00 66.00 64.44 1d1d h PRO 199 Cb 1.35 0.07 -0.00 0.00 0.13 0.00 0.00 31.00 32.54 1d1d h PRO 199 CO 0.24 0.95 -0.02 0.22 -0.23 0.00 0.00 178.00 179.16 1d1d h ASP 200 N 0.16 -0.06 -0.30 1.44 1.82 -1.97 1.57 116.42 119.08 1d1d h ASP 200 Ca -0.04 0.01 -0.14 0.00 -0.39 0.00 0.00 57.03 56.47 1d1d h ASP 200 Cb 1.42 0.02 -0.00 0.00 0.68 0.00 0.00 39.33 41.45 1d1d h ASP 200 CO 0.13 -0.04 -0.36 0.40 -1.61 0.00 0.00 179.24 177.76 1d1d h ILE 201 N -0.05 1.29 -0.50 2.25 1.08 -1.88 -2.55 117.51 117.16 1d1d h ILE 201 Ca 0.01 -1.54 -0.01 0.00 -0.39 0.00 0.00 64.86 62.92 1d1d h ILE 201 Cb 0.05 1.57 -0.02 0.00 -3.07 0.00 0.00 36.82 35.35 1d1d h ILE 201 CO -0.02 0.50 0.27 -0.61 -0.69 0.00 0.00 178.15 177.60 1d1d h GLN 202 N 0.55 0.70 -0.10 2.37 4.15 -0.75 -1.60 115.11 120.42 1d1d h GLN 202 Ca 0.04 -0.08 0.00 0.00 0.77 0.00 0.00 58.65 59.38 1d1d h GLN 202 Cb 0.95 -0.14 -0.01 0.00 0.21 0.00 0.00 27.48 28.50 1d1d h GLN 202 CO 0.09 0.55 0.07 1.96 -1.93 0.00 0.00 178.83 179.56 1d1d h GLN 203 N 0.66 0.13 -0.17 1.69 1.08 0.23 0.28 115.11 119.01 1d1d h GLN 203 Ca 0.17 -0.01 -0.04 0.00 -1.45 0.00 0.00 58.65 57.33 1d1d h GLN 203 Cb 0.05 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.45 1d1d h GLN 203 CO -0.03 0.09 -0.05 1.25 -0.95 0.00 0.00 178.83 179.13 1d1d h LEU 204 N 0.13 0.35 -0.33 1.46 6.46 -0.88 0.40 115.31 122.90 1d1d h LEU 204 Ca 0.04 -0.38 -0.05 0.00 -0.12 0.00 0.00 57.88 57.37 1d1d h LEU 204 Cb -0.01 -0.10 -0.01 0.00 -0.73 0.00 0.00 40.66 39.81 1d1d h LEU 204 CO -0.01 0.65 0.02 0.40 -0.62 0.00 0.00 178.44 178.88 1d1d h ILE 205 N 0.04 1.25 -0.29 4.05 5.03 -0.62 0.47 117.51 127.44 1d1d h ILE 205 Ca 0.04 -0.91 -0.05 0.00 -0.12 0.00 0.00 64.86 63.82 1d1d h ILE 205 Cb 0.50 1.20 -0.02 0.00 -3.03 0.00 0.00 36.82 35.48 1d1d h ILE 205 CO 0.02 0.30 -0.03 -0.09 -0.68 0.00 0.00 178.15 177.67 1d1d h ARG 206 N 0.38 0.46 -0.26 2.37 1.12 -0.42 -0.45 114.38 117.58 1d1d h ARG 206 Ca 0.10 -0.10 0.00 0.00 -1.11 0.00 0.00 59.98 58.87 1d1d h ARG 206 Cb 0.41 -0.07 0.00 0.00 -0.01 0.00 0.00 29.97 30.31 1d1d h ARG 206 CO 0.01 0.51 0.00 0.00 -3.11 0.00 0.00 179.97 177.38 1d1d n ALA 207 N -2.48 2.48 -1.21 2.80 0.00 0.14 -4.93 120.51 117.31 1d1d n ALA 207 Ca 0.01 -0.69 -0.32 0.00 0.00 0.00 0.00 53.44 52.44 1d1d n ALA 207 Cb 0.25 -1.01 0.10 0.00 0.00 0.00 0.00 19.45 18.79 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 -1.66 2.13 0.57 0.00 0.00 0.16 -4.99 121.76 117.97 1d1d s ALA 208 Ca 0.34 0.44 -0.16 0.00 0.00 0.00 0.00 51.96 52.57 1d1d s ALA 208 Cb 0.19 -3.33 -0.05 0.00 0.00 0.00 0.00 23.12 19.93 1d1d s ALA 208 CO 0.27 -1.87 1.05 -1.25 0.00 0.00 0.00 175.76 173.95 1d1d s PRO 209 N -4.61 3.45 0.00 0.00 0.04 -1.26 -4.93 135.00 127.69 1d1d s PRO 209 Ca 0.64 1.20 0.13 0.00 0.04 0.00 0.00 61.00 63.01 1d1d s PRO 209 Cb -0.20 -2.05 0.60 0.00 0.04 0.00 0.00 34.50 32.89 1d1d s PRO 209 CO 0.53 -0.70 1.41 0.43 0.04 0.00 0.00 177.00 178.71 1d1d n SER 210 N -1.84 0.83 -0.75 6.66 7.64 -1.26 -3.21 113.62 121.69 1d1d n SER 210 Ca 0.09 -1.75 0.11 0.00 1.01 0.00 0.00 58.87 58.33 1d1d n SER 210 Cb 0.53 -0.08 0.31 0.00 -1.01 0.00 0.00 64.21 63.97 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 -0.16 0.29 -3.66 0.44 -1.04 -1.26 -4.78 114.28 104.12 1d1d n THR 211 Ca 0.11 -0.47 -0.07 0.00 -2.04 0.00 0.00 64.05 61.58 1d1d n THR 211 Cb 0.17 0.58 -0.08 0.00 -1.82 0.00 0.00 70.33 69.18 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 -1.55 -0.72 -0.15 -4.42 0.05 -1.20 -5.03 118.68 105.66 1d1d s LEU 212 Ca 0.34 1.14 0.24 0.00 0.05 0.00 0.00 54.13 55.90 1d1d s LEU 212 Cb 0.19 1.62 0.47 0.00 -2.05 0.00 0.00 46.19 46.42 1d1d s LEU 212 CO 0.28 -0.23 1.14 0.35 -0.55 0.00 0.00 176.35 177.34 1d1d n THR 213 N 5.25 0.71 -4.41 5.48 -2.24 -1.26 -4.74 114.28 113.07 1d1d n THR 213 Ca -0.11 -2.06 -0.23 0.00 -2.27 0.00 0.00 64.05 59.37 1d1d n THR 213 Cb 0.50 1.17 -0.11 0.00 -2.10 0.00 0.00 70.33 69.79 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 -2.13 2.21 -0.95 4.28 -4.23 -1.26 -4.35 115.64 109.20 1d1d s THR 214 Ca 0.29 -2.20 -0.07 0.00 -1.18 0.00 0.00 61.69 58.53 1d1d s THR 214 Cb 0.35 -2.13 -0.10 0.00 1.34 0.00 0.00 72.50 71.96 1d1d s THR 214 CO -0.09 -0.35 2.56 -0.81 -0.54 0.00 0.00 174.62 175.39 1d1d n PRO 215 N -0.20 2.50 0.06 3.99 -0.04 -1.26 -2.97 135.00 137.08 1d1d n PRO 215 Ca -0.09 -1.55 0.00 0.00 -0.04 0.00 0.00 63.50 61.82 1d1d n PRO 215 Cb 0.59 -2.44 0.00 0.00 -0.04 0.00 0.00 33.50 31.60 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 3.45 -1.01 0.20 0.55 0.00 -1.26 -4.92 105.19 102.21 1d1d n GLY 216 Ca 0.53 0.16 -0.18 0.00 0.00 0.00 0.00 46.02 46.54 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 0.70 -0.77 1.61 4.39 -1.95 -1.81 114.58 116.75 1d1d h GLU 217 Ca 0.00 -0.66 0.04 0.00 0.34 0.00 0.00 59.36 59.08 1d1d h GLU 217 Cb 0.00 0.16 -0.04 0.00 -0.10 0.00 0.00 28.75 28.77 1d1d h GLU 217 CO 0.00 1.25 0.51 0.82 -1.16 0.00 0.00 179.01 180.43 1d1d h ILE 218 N 0.44 1.11 0.03 3.13 1.08 -1.83 0.50 117.51 121.96 1d1d h ILE 218 Ca -0.09 -0.32 -0.00 0.00 -0.39 0.00 0.00 64.86 64.06 1d1d h ILE 218 Cb 1.54 0.10 0.00 0.00 -3.07 0.00 0.00 36.82 35.38 1d1d h ILE 218 CO 0.18 0.17 -0.02 0.40 -0.69 0.00 0.00 178.15 178.19 1d1d h ILE 219 N 0.93 1.36 -0.58 -0.67 2.04 -1.80 0.82 117.51 119.62 1d1d h ILE 219 Ca 0.31 -1.34 0.10 0.00 1.00 0.00 0.00 64.86 64.93 1d1d h ILE 219 Cb 0.08 2.24 -0.03 0.00 -0.74 0.00 0.00 36.82 38.37 1d1d h ILE 219 CO -0.09 0.34 0.39 0.07 0.00 0.00 0.00 178.15 178.85 1d1d h LYS 220 N -0.64 0.36 -0.02 2.37 5.09 -0.79 0.46 116.57 123.39 1d1d h LYS 220 Ca -0.00 -0.02 -0.08 0.00 0.09 0.00 0.00 60.65 60.64 1d1d h LYS 220 Cb 0.58 -0.08 0.01 0.00 0.10 0.00 0.00 32.23 32.84 1d1d h LYS 220 CO 0.01 0.24 -0.29 -0.92 -2.09 0.00 0.00 179.45 176.40 1d1d h TYR 221 N 0.37 0.33 0.13 0.07 3.20 0.07 -1.11 116.97 120.03 1d1d h TYR 221 Ca 0.27 -0.16 -0.01 0.00 3.14 0.00 0.00 58.73 61.97 1d1d h TYR 221 Cb 0.55 -0.04 0.00 0.00 1.54 0.00 0.00 36.73 38.78 1d1d h TYR 221 CO -0.00 0.93 -0.06 0.28 -1.64 0.00 0.00 178.16 177.67 1d1d h VAL 222 N -0.36 0.90 -0.61 1.81 2.07 0.14 0.37 116.25 120.56 1d1d h VAL 222 Ca -0.03 -0.07 0.01 0.00 0.82 0.00 0.00 66.70 67.43 1d1d h VAL 222 Cb 0.99 0.94 -0.03 0.00 -1.52 0.00 0.00 31.29 31.68 1d1d h VAL 222 CO 0.06 0.02 0.41 -0.07 0.02 0.00 0.00 177.57 178.00 1d1d h LEU 223 N -0.20 0.70 -1.09 2.57 3.38 -0.22 0.48 115.31 120.92 1d1d h LEU 223 Ca -0.02 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.88 1d1d h LEU 223 Cb 0.16 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 1d1d h LEU 223 CO 0.03 0.50 -0.25 0.44 0.09 0.00 0.00 178.44 179.25 1d1d h ASP 224 N 0.82 0.00 0.40 -0.43 3.32 -0.49 -2.27 116.42 117.77 1d1d h ASP 224 Ca 0.23 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.28 1d1d h ASP 224 Cb -0.07 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.48 1d1d h ASP 224 CO -0.05 0.25 -0.64 -1.14 -1.72 0.00 0.00 179.24 175.93 1d1d n ARG 225 N -3.42 0.03 0.12 3.56 0.63 0.12 -4.19 116.66 113.51 1d1d n ARG 225 Ca 0.00 0.00 -0.13 0.00 -0.92 0.00 0.00 57.85 56.80 1d1d n ARG 225 Cb 0.44 -1.51 -0.08 0.00 0.45 0.00 0.00 32.46 31.76 1d1d n ARG 225 CO 0.00 0.00 0.00 1.96 -2.51 0.00 0.00 177.63 177.08 1d1d h GLN 226 N 0.00 -0.31 0.00 -0.14 4.20 0.42 -3.48 115.11 115.80 1d1d h GLN 226 Ca 0.00 0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.73 1d1d h GLN 226 Cb 0.52 0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.37 1d1d h GLN 226 CO 0.00 0.02 0.00 1.63 -0.67 0.00 0.00 178.83 179.81 1d1d n LYS 227 N -5.08 0.00 0.00 1.46 5.02 -1.23 -5.03 118.16 113.31 1d1d n LYS 227 Ca -0.09 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.20 1d1d n LYS 227 Cb 0.25 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.26 1d1d n LYS 227 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 1d1d n ILE 228 N 0.00 0.00 0.00 -0.18 5.41 -1.25 -3.68 119.36 119.66 1d1d n ILE 228 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 1d1d n ILE 228 Cb 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 38.93 1d1d n ILE 228 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1d1d n ALA 229 N 0.00 0.00 1.50 -1.39 0.00 -1.26 -5.15 120.51 114.21 1d1d n ALA 229 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.56 1d1d n ALA 229 Cb 0.00 0.00 0.71 0.00 0.00 0.00 0.00 19.45 20.16 1d1d n ALA 229 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15