#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d1d s THR 12 N 0.00 4.96 0.40 -0.99 2.01 -1.26 -5.09 115.64 115.68 1d1d s THR 12 Ca 0.00 0.02 -0.24 0.00 0.31 0.00 0.00 61.69 61.78 1d1d s THR 12 Cb 0.00 -3.21 -0.09 0.00 0.01 0.00 0.00 72.50 69.21 1d1d s THR 12 CO 0.00 0.51 1.06 -2.16 -0.69 0.00 0.00 174.62 173.34 1d1d s PRO 13 N -0.09 4.16 -0.55 4.92 0.04 -1.26 -4.91 135.00 137.31 1d1d s PRO 13 Ca 0.08 1.53 -0.26 0.00 0.04 0.00 0.00 61.00 62.38 1d1d s PRO 13 Cb -0.12 -2.55 -0.07 0.00 0.04 0.00 0.00 34.50 31.81 1d1d s PRO 13 CO 0.01 -0.15 2.31 -1.17 0.04 0.00 0.00 177.00 178.04 1d1d s LEU 14 N -2.63 3.33 0.14 -3.56 0.20 -1.26 -4.92 118.68 109.97 1d1d s LEU 14 Ca 0.58 0.83 -0.25 0.00 0.69 0.00 0.00 54.13 55.98 1d1d s LEU 14 Cb -0.22 -2.51 -0.07 0.00 -0.43 0.00 0.00 46.19 42.95 1d1d s LEU 14 CO 0.28 -2.90 0.78 -0.70 -0.29 0.00 0.00 176.35 173.52 1d1d s GLU 15 N 8.11 4.55 0.06 1.98 2.56 -1.26 -4.98 118.70 129.72 1d1d s GLU 15 Ca 0.92 1.14 -0.16 0.00 0.00 0.00 0.00 54.97 56.87 1d1d s GLU 15 Cb -0.16 -3.29 -0.21 0.00 2.00 0.00 0.00 34.13 32.48 1d1d s GLU 15 CO 0.23 0.50 1.20 -1.00 -0.56 0.00 0.00 175.26 175.62 1d1d h PRO 16 N 4.67 0.62 -0.20 4.30 0.13 -1.98 -2.13 132.00 137.40 1d1d h PRO 16 Ca -0.46 -0.61 -0.02 0.00 -0.87 0.00 0.00 66.00 64.04 1d1d h PRO 16 Cb 1.21 0.16 -0.01 0.00 0.13 0.00 0.00 31.00 32.48 1d1d h PRO 16 CO 0.67 1.22 0.05 1.57 -0.23 0.00 0.00 178.00 181.28 1d1d h LYS 17 N 0.26 0.32 -0.74 0.86 2.10 -1.99 -0.50 116.57 116.88 1d1d h LYS 17 Ca -0.09 -0.08 0.03 0.00 -2.00 0.00 0.00 60.65 58.52 1d1d h LYS 17 Cb 1.46 -0.04 -0.04 0.00 -0.90 0.00 0.00 32.23 32.70 1d1d h LYS 17 CO 0.16 0.44 0.49 -0.07 -2.00 0.00 0.00 179.45 178.46 1d1d h LEU 18 N 0.15 0.79 -0.85 7.07 3.38 -1.98 -0.21 115.31 123.66 1d1d h LEU 18 Ca 0.06 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.94 1d1d h LEU 18 Cb 0.26 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 1d1d h LEU 18 CO -0.00 0.55 -0.05 0.40 0.09 0.00 0.00 178.44 179.43 1d1d h ILE 19 N 0.93 1.25 -0.87 1.22 2.04 -0.92 -2.46 117.51 118.70 1d1d h ILE 19 Ca 0.29 -1.09 -0.01 0.00 1.00 0.00 0.00 64.86 65.04 1d1d h ILE 19 Cb 0.01 0.96 -0.04 0.00 -0.74 0.00 0.00 36.82 37.00 1d1d h ILE 19 CO -0.08 0.38 0.49 0.74 0.00 0.00 0.00 178.15 179.69 1d1d h THR 20 N 0.73 1.25 -0.13 -0.27 2.02 0.59 0.43 112.91 117.53 1d1d h THR 20 Ca 0.13 -0.59 -0.00 0.00 0.77 0.00 0.00 66.41 66.72 1d1d h THR 20 Cb 0.52 0.06 -0.01 0.00 -1.74 0.00 0.00 68.15 66.99 1d1d h THR 20 CO 0.03 0.27 0.08 0.03 0.37 0.00 0.00 175.52 176.30 1d1d h ARG 21 N 1.21 0.18 -0.39 6.66 3.08 -0.96 0.40 114.38 124.56 1d1d h ARG 21 Ca 0.31 -0.02 -0.09 0.00 0.07 0.00 0.00 59.98 60.25 1d1d h ARG 21 Cb 0.00 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.00 1d1d h ARG 21 CO -0.05 0.19 -0.13 -0.07 -1.07 0.00 0.00 179.97 178.84 1d1d h LEU 22 N 0.13 0.69 -1.07 3.04 3.38 -1.10 -2.00 115.31 118.38 1d1d h LEU 22 Ca 0.05 -0.21 -0.08 0.00 0.09 0.00 0.00 57.88 57.73 1d1d h LEU 22 Cb 0.06 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 1d1d h LEU 22 CO -0.01 0.84 -0.19 0.00 0.09 0.00 0.00 178.44 179.17 1d1d h ALA 23 N 1.22 1.22 -0.31 1.53 0.00 0.32 -2.05 119.26 121.19 1d1d h ALA 23 Ca 0.11 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.69 1d1d h ALA 23 Cb 0.58 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1d1d h ALA 23 CO 0.04 0.50 0.06 -0.44 0.00 0.00 0.00 179.25 179.41 1d1d h ASP 24 N 0.39 0.49 -0.94 0.00 5.19 0.43 -2.28 116.42 119.70 1d1d h ASP 24 Ca 0.07 -0.25 0.03 0.00 -0.62 0.00 0.00 57.03 56.25 1d1d h ASP 24 Cb 0.56 -0.13 -0.05 0.00 0.18 0.00 0.00 39.33 39.89 1d1d h ASP 24 CO 0.04 0.62 0.62 0.74 -3.12 0.00 0.00 179.24 178.13 1d1d h THR 25 N 0.34 1.18 -0.45 0.35 2.02 -1.03 0.24 112.91 115.56 1d1d h THR 25 Ca 0.10 -0.41 0.02 0.00 0.77 0.00 0.00 66.41 66.88 1d1d h THR 25 Cb 0.33 -0.13 -0.03 0.00 -1.74 0.00 0.00 68.15 66.58 1d1d h THR 25 CO 0.00 0.22 0.27 0.58 0.37 0.00 0.00 175.52 176.97 1d1d h VAL 26 N 1.20 1.05 -0.08 3.16 2.07 -1.06 1.44 116.25 124.04 1d1d h VAL 26 Ca 0.37 -0.19 -0.01 0.00 0.82 0.00 0.00 66.70 67.68 1d1d h VAL 26 Cb -0.03 0.46 -0.00 0.00 -1.52 0.00 0.00 31.29 30.20 1d1d h VAL 26 CO -0.10 0.10 -0.01 -0.09 0.02 0.00 0.00 177.57 177.49 1d1d h ARG 27 N 0.55 0.15 0.00 1.57 1.12 -0.75 0.50 114.38 117.51 1d1d h ARG 27 Ca 0.18 -0.05 0.00 0.00 -1.11 0.00 0.00 59.98 59.00 1d1d h ARG 27 Cb 0.00 -0.01 0.00 0.00 -0.01 0.00 0.00 29.97 29.95 1d1d h ARG 27 CO -0.08 0.44 0.00 1.79 -3.11 0.00 0.00 179.97 179.01 1d1d h THR 28 N -0.16 0.00 0.00 0.20 1.35 -0.25 -1.27 112.91 112.78 1d1d h THR 28 Ca 0.02 -0.37 0.00 0.00 -0.55 0.00 0.00 66.41 65.51 1d1d h THR 28 Cb 0.38 1.30 0.00 0.00 -1.73 0.00 0.00 68.15 68.10 1d1d h THR 28 CO 0.01 0.00 -1.10 0.29 -0.25 0.00 0.00 175.52 174.46 1d1d n LYS 29 N -2.90 0.29 -0.05 4.72 4.76 0.49 -5.05 118.16 120.43 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 0.21 0.29 0.72 0.00 0.17 -4.47 105.19 103.49 1d1d n GLY 30 Ca 0.02 -1.21 -0.11 0.00 0.00 0.00 0.00 46.02 44.72 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 0.00 1.04 -0.89 0.99 -0.00 -1.78 -2.26 115.31 112.42 1d1d h LEU 31 Ca 0.00 -0.38 0.00 0.00 -0.00 0.00 0.00 57.88 57.50 1d1d h LEU 31 Cb 0.00 -0.29 0.00 0.00 -0.00 0.00 0.00 40.66 40.37 1d1d h LEU 31 CO 0.00 1.18 0.00 0.54 -0.00 0.00 0.00 178.44 180.16 1d1d n ARG 32 N -4.12 1.60 -3.41 1.13 1.74 -1.26 -4.76 116.66 107.58 1d1d n ARG 32 Ca 0.01 -0.88 -0.28 0.00 -0.77 0.00 0.00 57.85 55.93 1d1d n ARG 32 Cb 0.44 -1.42 -0.03 0.00 -1.02 0.00 0.00 32.46 30.43 1d1d n ARG 32 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1d1d s SER 33 N -1.75 6.41 -0.60 0.55 0.15 -0.85 -5.02 113.70 112.59 1d1d s SER 33 Ca 0.35 0.61 -0.27 0.00 0.70 0.00 0.00 55.95 57.34 1d1d s SER 33 Cb 0.19 -2.10 0.01 0.00 -1.71 0.00 0.00 66.02 62.40 1d1d s SER 33 CO 0.29 -0.18 1.53 -2.16 1.20 0.00 0.00 173.24 173.91 1d1d s PRO 34 N -3.64 3.09 0.00 5.44 0.04 -1.26 -3.33 135.00 135.34 1d1d s PRO 34 Ca 0.42 0.39 0.00 0.00 0.04 0.00 0.00 61.00 61.85 1d1d s PRO 34 Cb -0.11 -4.21 0.00 0.00 0.04 0.00 0.00 34.50 30.22 1d1d s PRO 34 CO 0.31 -2.20 0.00 -0.89 0.04 0.00 0.00 177.00 174.26 1d1d n ILE 35 N 6.88 0.00 -0.05 0.56 2.08 -1.26 -4.99 119.36 122.58 1d1d n ILE 35 Ca 0.13 0.00 -0.09 0.00 0.56 0.00 0.00 62.75 63.35 1d1d n ILE 35 Cb 0.50 0.00 -0.03 0.00 -0.75 0.00 0.00 39.64 39.36 1d1d n ILE 35 CO 0.00 0.00 0.00 0.74 0.56 0.00 0.00 176.55 177.85 1d1d h THR 36 N 0.00 1.00 -0.53 1.39 2.02 -1.75 0.46 112.91 115.51 1d1d h THR 36 Ca 0.00 -0.08 -0.05 0.00 0.77 0.00 0.00 66.41 67.05 1d1d h THR 36 Cb 0.00 0.76 -0.02 0.00 -1.74 0.00 0.00 68.15 67.14 1d1d h THR 36 CO 0.00 0.04 0.11 -0.03 0.37 0.00 0.00 175.52 176.01 1d1d h MET 37 N 0.23 0.81 0.14 6.66 1.85 -1.90 0.38 114.93 123.10 1d1d h MET 37 Ca 0.08 -0.17 -0.01 0.00 -0.61 0.00 0.00 59.70 58.99 1d1d h MET 37 Cb 0.01 -0.12 0.00 0.00 0.43 0.00 0.00 31.60 31.93 1d1d h MET 37 CO -0.05 0.75 -0.07 0.00 -0.40 0.00 0.00 176.91 177.14 1d1d h ALA 38 N 1.34 -0.19 -0.37 0.39 0.00 -1.81 0.38 119.26 119.00 1d1d h ALA 38 Ca 0.17 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1d1d h ALA 38 Cb 0.31 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1d1d h ALA 38 CO 0.00 -0.41 0.24 0.93 0.00 0.00 0.00 179.25 180.01 1d1d h GLU 39 N -0.57 0.49 -0.74 0.00 5.08 0.07 0.32 114.58 119.23 1d1d h GLU 39 Ca -0.02 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.27 1d1d h GLU 39 Cb 0.44 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.55 1d1d h GLU 39 CO 0.03 0.33 0.33 0.28 -1.00 0.00 0.00 179.01 178.98 1d1d h VAL 40 N 0.50 1.25 0.00 3.13 2.07 -0.23 -1.29 116.25 121.67 1d1d h VAL 40 Ca 0.13 -0.73 -0.04 0.00 0.82 0.00 0.00 66.70 66.88 1d1d h VAL 40 Cb -0.05 0.35 -0.01 0.00 -1.52 0.00 0.00 31.29 30.06 1d1d h VAL 40 CO -0.03 0.30 -0.21 -0.33 0.02 0.00 0.00 177.57 177.32 1d1d h GLU 41 N 1.05 0.00 0.32 1.57 5.08 0.37 0.38 114.58 123.35 1d1d h GLU 41 Ca 0.25 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.60 1d1d h GLU 41 Cb 0.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.41 1d1d h GLU 41 CO -0.03 0.21 -0.16 0.00 -1.00 0.00 0.00 179.01 178.04 1d1d h ALA 42 N 1.79 -0.43 -0.10 3.43 0.00 0.80 1.55 119.26 126.30 1d1d h ALA 42 Ca -0.00 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.66 1d1d h ALA 42 Cb 0.58 0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.54 1d1d h ALA 42 CO 0.03 -0.62 -0.26 1.37 0.00 0.00 0.00 179.25 179.77 1d1d h LEU 43 N -0.68 0.39 -0.11 0.00 8.10 -1.32 -2.91 115.31 118.78 1d1d h LEU 43 Ca -0.04 -0.59 0.00 0.00 0.11 0.00 0.00 57.88 57.35 1d1d h LEU 43 Cb 0.48 -0.11 0.00 0.00 -0.44 0.00 0.00 40.66 40.58 1d1d h LEU 43 CO 0.07 0.91 0.00 0.23 -4.11 0.00 0.00 178.44 175.55 1d1d n MET 44 N -4.47 0.04 -0.53 0.17 2.81 0.13 -3.51 117.12 111.76 1d1d n MET 44 Ca -0.08 0.25 0.41 0.00 -1.81 0.00 0.00 57.70 56.48 1d1d n MET 44 Cb 0.45 -1.57 0.66 0.00 -0.71 0.00 0.00 33.22 32.05 1d1d n MET 44 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 1d1d n SER 45 N -1.64 0.08 -4.85 7.83 3.41 0.53 -4.25 113.62 114.73 1d1d n SER 45 Ca 0.04 1.01 -0.21 0.00 -0.26 0.00 0.00 58.87 59.44 1d1d n SER 45 Cb 0.21 -0.50 -0.04 0.00 -0.26 0.00 0.00 64.21 63.62 1d1d n SER 45 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1d1d s SER 46 N -4.07 5.27 -0.19 4.04 1.04 -1.23 -5.06 113.70 113.51 1d1d s SER 46 Ca -0.05 -0.51 -0.29 0.00 0.48 0.00 0.00 55.95 55.57 1d1d s SER 46 Cb 0.25 -0.94 -0.01 0.00 0.10 0.00 0.00 66.02 65.41 1d1d s SER 46 CO 0.74 -0.38 1.29 -2.16 0.98 0.00 0.00 173.24 173.72 1d1d s PRO 47 N -4.01 4.16 0.39 4.02 0.04 -1.26 -4.97 135.00 133.37 1d1d s PRO 47 Ca 0.41 1.60 0.04 0.00 0.04 0.00 0.00 61.00 63.10 1d1d s PRO 47 Cb -0.06 -3.80 0.04 0.00 0.04 0.00 0.00 34.50 30.73 1d1d s PRO 47 CO 0.27 -0.80 0.33 1.47 0.04 0.00 0.00 177.00 178.31 1d1d n LEU 48 N 6.86 0.00 -4.92 -3.56 -0.00 -1.26 -4.97 117.00 109.14 1d1d n LEU 48 Ca 0.14 -1.95 -0.26 0.00 -0.00 0.00 0.00 56.01 53.95 1d1d n LEU 48 Cb 0.45 -0.07 0.02 0.00 -0.00 0.00 0.00 43.42 43.82 1d1d n LEU 48 CO 0.57 -0.51 0.47 -0.76 -0.00 0.00 0.00 177.39 177.16 1d1d s LEU 49 N 0.00 3.35 0.05 1.47 2.01 -1.26 -4.76 118.68 119.54 1d1d s LEU 49 Ca 0.25 0.64 -0.16 0.00 0.01 0.00 0.00 54.13 54.87 1d1d s LEU 49 Cb -0.02 -3.48 -0.21 0.00 0.01 0.00 0.00 46.19 42.49 1d1d s LEU 49 CO 0.16 -0.95 1.19 1.55 1.01 0.00 0.00 176.35 179.31 1d1d h PRO 50 N -0.02 0.61 -0.45 1.29 0.13 -1.84 -1.96 132.00 129.76 1d1d h PRO 50 Ca -0.46 -0.59 -0.12 0.00 -0.87 0.00 0.00 66.00 63.97 1d1d h PRO 50 Cb 1.25 0.15 -0.01 0.00 0.13 0.00 0.00 31.00 32.52 1d1d h PRO 50 CO 0.60 1.20 -0.19 1.12 -0.23 0.00 0.00 178.00 180.50 1d1d h HIS 51 N 0.23 1.05 -0.35 1.56 2.07 -1.92 -2.69 115.15 115.10 1d1d h HIS 51 Ca -0.08 -0.25 -0.05 0.00 -2.85 0.00 0.00 60.37 57.14 1d1d h HIS 51 Cb 1.43 -0.25 -0.02 0.00 2.57 0.00 0.00 27.41 31.15 1d1d h HIS 51 CO 0.11 1.05 0.01 -0.44 -3.07 0.00 0.00 177.93 175.59 1d1d h ASP 52 N 0.75 0.51 -0.55 3.10 3.32 -1.97 -2.00 116.42 119.59 1d1d h ASP 52 Ca 0.10 -0.09 0.08 0.00 0.02 0.00 0.00 57.03 57.13 1d1d h ASP 52 Cb 0.76 -0.13 -0.06 0.00 0.22 0.00 0.00 39.33 40.11 1d1d h ASP 52 CO 0.06 0.57 0.21 0.58 -1.72 0.00 0.00 179.24 178.94 1d1d h VAL 53 N 0.52 0.82 -0.59 -1.35 2.07 -1.01 0.94 116.25 117.65 1d1d h VAL 53 Ca 0.11 -0.13 -0.10 0.00 0.82 0.00 0.00 66.70 67.39 1d1d h VAL 53 Cb 0.32 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 30.46 1d1d h VAL 53 CO 0.01 0.07 -0.04 0.71 0.02 0.00 0.00 177.57 178.34 1d1d h THR 54 N 0.39 1.27 -0.66 2.57 1.35 -1.30 0.44 112.91 116.97 1d1d h THR 54 Ca 0.27 -1.20 -0.08 0.00 -0.55 0.00 0.00 66.41 64.85 1d1d h THR 54 Cb 0.29 0.85 -0.03 0.00 -1.73 0.00 0.00 68.15 67.53 1d1d h THR 54 CO -0.26 0.43 0.11 -1.13 -0.25 0.00 0.00 175.52 174.42 1d1d h ASN 55 N 0.96 1.06 0.11 5.36 -1.24 -0.49 0.40 115.58 121.74 1d1d h ASN 55 Ca 0.16 -0.26 -0.01 0.00 0.71 0.00 0.00 56.30 56.91 1d1d h ASN 55 Cb 0.60 -0.28 0.00 0.00 0.73 0.00 0.00 38.32 39.37 1d1d h ASN 55 CO 0.04 1.05 -0.05 0.25 -1.29 0.00 0.00 177.43 177.42 1d1d h LEU 56 N 1.02 -0.12 -0.63 0.34 5.85 0.11 -2.59 115.31 119.30 1d1d h LEU 56 Ca 0.20 -0.38 0.06 0.00 0.84 0.00 0.00 57.88 58.59 1d1d h LEU 56 Cb 0.44 0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.45 1d1d h LEU 56 CO 0.01 0.35 0.34 0.24 -0.34 0.00 0.00 178.44 179.04 1d1d h MET 57 N -0.64 0.62 -0.79 1.25 2.86 -0.03 0.15 114.93 118.35 1d1d h MET 57 Ca -0.01 -0.04 0.09 0.00 -2.06 0.00 0.00 59.70 57.68 1d1d h MET 57 Cb 0.50 -0.14 -0.05 0.00 0.06 0.00 0.00 31.60 31.97 1d1d h MET 57 CO 0.02 0.41 0.52 -0.09 1.06 0.00 0.00 176.91 178.83 1d1d h ARG 58 N 0.63 0.72 -0.01 1.72 2.43 -0.20 1.85 114.38 121.52 1d1d h ARG 58 Ca 0.28 -0.04 -0.21 0.00 -0.81 0.00 0.00 59.98 59.20 1d1d h ARG 58 Cb 0.17 -0.16 -0.00 0.00 -0.42 0.00 0.00 29.97 29.56 1d1d h ARG 58 CO -0.18 0.48 -0.89 0.28 -1.51 0.00 0.00 179.97 178.16 1d1d h VAL 59 N 0.74 1.42 -0.09 0.20 2.07 -0.74 -3.25 116.25 116.60 1d1d h VAL 59 Ca 0.36 -2.43 -0.13 0.00 0.82 0.00 0.00 66.70 65.32 1d1d h VAL 59 Cb 0.41 2.37 0.01 0.00 -1.52 0.00 0.00 31.29 32.56 1d1d h VAL 59 CO -0.14 0.72 -0.46 0.40 0.02 0.00 0.00 177.57 178.12 1d1d h ILE 60 N 0.21 1.38 -4.08 4.57 2.04 0.13 -3.44 117.51 118.32 1d1d h ILE 60 Ca -0.06 -1.81 -0.64 0.00 1.00 0.00 0.00 64.86 63.36 1d1d h ILE 60 Cb 1.51 2.24 -0.31 0.00 -0.74 0.00 0.00 36.82 39.52 1d1d h ILE 60 CO 0.15 0.54 -0.87 -1.48 0.00 0.00 0.00 178.15 176.49 1d1d s LEU 61 N -8.61 2.01 0.00 1.44 2.34 0.61 -4.86 118.68 111.61 1d1d s LEU 61 Ca -0.13 -0.44 -0.08 0.00 0.06 0.00 0.00 54.13 53.55 1d1d s LEU 61 Cb 0.05 -1.19 0.12 0.00 -0.56 0.00 0.00 46.19 44.61 1d1d s LEU 61 CO 0.81 0.22 0.27 0.61 -1.06 0.00 0.00 176.35 177.20 1d1d n GLY 62 N 2.92 -1.95 0.25 -3.48 0.00 -1.25 -4.02 105.19 97.67 1d1d n GLY 62 Ca -0.17 -0.63 0.15 0.00 0.00 0.00 0.00 46.02 45.36 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 0.45 1.61 0.13 -1.97 -1.83 132.00 130.39 1d1d h PRO 63 Ca -0.12 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.98 1d1d h PRO 63 Cb 0.42 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.55 1d1d h PRO 63 CO 0.07 0.00 -0.22 0.00 -0.23 0.00 0.00 178.00 177.63 1d1d h ALA 64 N 2.01 -0.61 0.00 -0.56 0.00 -1.98 -3.15 119.26 114.97 1d1d h ALA 64 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1d1d h ALA 64 Cb 0.74 0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.77 1d1d h ALA 64 CO 0.00 -0.57 0.00 -0.35 0.00 0.00 0.00 179.25 178.33 1d1d n PRO 65 N -5.11 0.73 0.04 0.00 -0.04 -1.24 -3.04 135.00 126.34 1d1d n PRO 65 Ca -0.07 0.00 -0.20 0.00 -0.04 0.00 0.00 63.50 63.19 1d1d n PRO 65 Cb 0.24 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.07 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 0.74 0.00 0.54 5.03 -1.29 -2.89 116.97 119.10 1d1d h TYR 66 Ca 0.00 -0.46 -0.06 0.00 2.58 0.00 0.00 58.73 60.79 1d1d h TYR 66 Cb 0.01 -0.06 -0.01 0.00 1.55 0.00 0.00 36.73 38.22 1d1d h TYR 66 CO 0.00 1.31 -0.28 0.00 -1.32 0.00 0.00 178.16 177.86 1d1d h ALA 67 N 0.25 1.50 -0.46 1.82 0.00 -1.52 -0.38 119.26 120.47 1d1d h ALA 67 Ca -0.13 -0.26 -0.10 0.00 0.00 0.00 0.00 54.91 54.42 1d1d h ALA 67 Cb 1.60 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.33 1d1d h ALA 67 CO 0.17 0.35 -0.12 -0.07 0.00 0.00 0.00 179.25 179.58 1d1d h LEU 68 N 0.00 0.90 -0.58 0.00 4.07 -1.66 -0.38 115.31 117.67 1d1d h LEU 68 Ca -0.00 -0.37 -0.13 0.00 0.08 0.00 0.00 57.88 57.46 1d1d h LEU 68 Cb 0.51 -0.25 -0.01 0.00 1.08 0.00 0.00 40.66 41.99 1d1d h LEU 68 CO 0.04 1.06 -0.23 -0.25 -1.08 0.00 0.00 178.44 177.97 1d1d h TRP 69 N 0.73 1.02 -0.61 1.13 7.01 -1.19 -1.12 115.95 122.93 1d1d h TRP 69 Ca 0.11 -0.25 -0.00 0.00 2.11 0.00 0.00 58.89 60.87 1d1d h TRP 69 Cb 0.67 -0.24 -0.03 0.00 -2.10 0.00 0.00 29.16 27.46 1d1d h TRP 69 CO 0.05 1.03 0.38 0.52 -2.79 0.00 0.00 178.44 177.62 1d1d h MET 70 N 0.77 0.82 -0.43 2.65 2.86 -0.79 1.41 114.93 122.21 1d1d h MET 70 Ca 0.10 -0.07 -0.06 0.00 -2.06 0.00 0.00 59.70 57.61 1d1d h MET 70 Cb 0.78 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 32.25 1d1d h MET 70 CO 0.07 0.57 0.04 0.22 1.06 0.00 0.00 176.91 178.87 1d1d h ASP 71 N 0.82 0.71 0.47 1.22 3.58 -0.88 0.11 116.42 122.45 1d1d h ASP 71 Ca 0.22 -0.28 -0.11 0.00 0.42 0.00 0.00 57.03 57.27 1d1d h ASP 71 Cb -0.04 -0.19 -0.01 0.00 1.72 0.00 0.00 39.33 40.80 1d1d h ASP 71 CO -0.04 0.82 -0.52 0.00 -2.88 0.00 0.00 179.24 176.61 1d1d h ALA 72 N 0.92 1.09 -0.46 -0.78 0.00 -0.76 -2.46 119.26 116.81 1d1d h ALA 72 Ca 0.13 -0.48 -0.12 0.00 0.00 0.00 0.00 54.91 54.44 1d1d h ALA 72 Cb 0.43 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1d1d h ALA 72 CO 0.01 0.66 -0.20 2.35 0.00 0.00 0.00 179.25 182.07 1d1d h TRP 73 N 0.05 1.09 -0.44 0.00 7.01 0.24 0.15 115.95 124.05 1d1d h TRP 73 Ca -0.00 -0.26 0.01 0.00 2.11 0.00 0.00 58.89 60.74 1d1d h TRP 73 Cb 0.94 -0.25 -0.02 0.00 -2.10 0.00 0.00 29.16 27.72 1d1d h TRP 73 CO 0.00 1.07 0.29 0.78 -2.79 0.00 0.00 178.44 177.79 1d1d h GLY 74 N 0.79 0.62 0.76 2.65 0.00 -0.47 0.43 103.07 107.84 1d1d h GLY 74 Ca 0.11 -0.23 -0.04 0.00 0.00 0.00 0.00 47.33 47.17 1d1d h GLY 74 CO 0.06 0.22 -0.06 -2.08 0.00 0.00 0.00 176.54 174.68 1d1d h VAL 75 N 0.58 1.30 -0.49 4.60 2.07 -1.31 -1.11 116.25 121.91 1d1d h VAL 75 Ca 0.16 -1.07 0.05 0.00 0.82 0.00 0.00 66.70 66.66 1d1d h VAL 75 Cb -0.06 1.69 -0.05 0.00 -1.52 0.00 0.00 31.29 31.35 1d1d h VAL 75 CO -0.04 0.32 0.21 1.56 0.02 0.00 0.00 177.57 179.64 1d1d h GLN 76 N -0.00 0.41 -0.78 1.57 1.08 -0.42 0.29 115.11 117.25 1d1d h GLN 76 Ca 0.04 -0.02 -0.02 0.00 -1.45 0.00 0.00 58.65 57.19 1d1d h GLN 76 Cb 0.52 -0.09 -0.04 0.00 -0.05 0.00 0.00 27.48 27.82 1d1d h GLN 76 CO 0.02 0.27 0.40 -0.07 -0.95 0.00 0.00 178.83 178.50 1d1d h LEU 77 N 0.42 0.98 -1.22 1.46 3.38 -0.08 -1.13 115.31 119.12 1d1d h LEU 77 Ca 0.22 -0.09 -0.08 0.00 0.09 0.00 0.00 57.88 58.02 1d1d h LEU 77 Cb 0.18 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 1d1d h LEU 77 CO -0.19 0.81 -0.39 1.56 0.09 0.00 0.00 178.44 180.32 1d1d h GLN 78 N 1.09 0.00 -0.36 1.13 4.20 0.17 -2.20 115.11 119.14 1d1d h GLN 78 Ca 0.27 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.91 1d1d h GLN 78 Cb 0.06 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.83 1d1d h GLN 78 CO -0.04 0.39 -0.10 0.00 -0.67 0.00 0.00 178.83 178.41 1d1d h THR 79 N 0.00 1.24 0.04 -0.54 1.03 0.77 0.43 112.91 115.88 1d1d h THR 79 Ca -0.00 -1.05 -0.00 0.00 -0.01 0.00 0.00 66.41 65.34 1d1d h THR 79 Cb 0.69 1.07 0.00 0.00 -1.07 0.00 0.00 68.15 68.84 1d1d h THR 79 CO 0.05 0.35 -0.02 0.58 -0.01 0.00 0.00 175.52 176.47 1d1d h VAL 80 N 0.57 1.32 -0.09 0.00 2.07 -1.01 0.51 116.25 119.62 1d1d h VAL 80 Ca 0.10 -1.28 0.01 0.00 0.82 0.00 0.00 66.70 66.35 1d1d h VAL 80 Cb 0.51 2.16 -0.01 0.00 -1.52 0.00 0.00 31.29 32.43 1d1d h VAL 80 CO 0.03 0.32 0.03 0.40 0.02 0.00 0.00 177.57 178.37 1d1d h ILE 81 N -0.63 0.99 -0.50 4.57 5.03 -1.30 0.36 117.51 126.02 1d1d h ILE 81 Ca -0.01 -0.03 -0.03 0.00 -0.12 0.00 0.00 64.86 64.68 1d1d h ILE 81 Cb 0.57 0.90 -0.02 0.00 -3.03 0.00 0.00 36.82 35.23 1d1d h ILE 81 CO 0.01 0.01 0.20 0.00 -0.68 0.00 0.00 178.15 177.70 1d1d h ALA 82 N 1.05 0.65 -0.39 1.87 0.00 -0.18 0.42 119.26 122.67 1d1d h ALA 82 Ca 0.04 -0.15 0.05 0.00 0.00 0.00 0.00 54.91 54.84 1d1d h ALA 82 Cb 0.01 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.57 1d1d h ALA 82 CO -0.03 0.26 0.14 0.00 0.00 0.00 0.00 179.25 179.62 1d1d h ALA 83 N 1.05 0.46 -0.54 0.00 0.00 0.51 0.39 119.26 121.13 1d1d h ALA 83 Ca 0.17 0.04 -0.08 0.00 0.00 0.00 0.00 54.91 55.04 1d1d h ALA 83 Cb 0.19 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 1d1d h ALA 83 CO -0.01 -0.25 0.02 0.00 0.00 0.00 0.00 179.25 179.01 1d1d h ALA 84 N 1.25 0.73 -0.68 0.00 0.00 0.07 -0.41 119.26 120.22 1d1d h ALA 84 Ca 0.18 -0.28 0.01 0.00 0.00 0.00 0.00 54.91 54.82 1d1d h ALA 84 Cb 0.15 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 1d1d h ALA 84 CO -0.18 0.53 0.45 1.15 0.00 0.00 0.00 179.25 181.20 1d1d h THR 85 N 0.82 1.16 -0.03 0.00 2.02 0.80 -1.40 112.91 116.29 1d1d h THR 85 Ca 0.16 -0.31 -0.18 0.00 0.77 0.00 0.00 66.41 66.85 1d1d h THR 85 Cb 0.50 0.18 -0.01 0.00 -1.74 0.00 0.00 68.15 67.08 1d1d h THR 85 CO 0.02 0.16 -0.78 0.03 0.37 0.00 0.00 175.52 175.33 1d1d h ARG 86 N 0.90 0.24 -3.62 6.66 3.08 0.16 -3.42 114.38 118.38 1d1d h ARG 86 Ca 0.25 -0.22 -0.48 0.00 0.07 0.00 0.00 59.98 59.61 1d1d h ARG 86 Cb -0.07 0.05 -0.39 0.00 0.08 0.00 0.00 29.97 29.64 1d1d h ARG 86 CO -0.06 0.90 -0.77 0.16 -1.07 0.00 0.00 179.97 179.14 1d1d s ASP 87 N -6.93 2.26 -0.67 7.04 1.47 -0.20 -5.03 116.67 114.62 1d1d s ASP 87 Ca -0.04 -0.46 -0.06 0.00 1.18 0.00 0.00 52.55 53.17 1d1d s ASP 87 Cb 0.11 -0.52 -0.13 0.00 -0.34 0.00 0.00 42.92 42.04 1d1d s ASP 87 CO 0.82 -0.25 2.64 -0.81 0.68 0.00 0.00 175.17 178.25 1d1d n PRO 88 N 5.10 2.19 -0.29 2.11 -0.04 -1.14 -3.42 135.00 139.51 1d1d n PRO 88 Ca -0.08 -1.31 0.00 0.00 -0.04 0.00 0.00 63.50 62.08 1d1d n PRO 88 Cb 0.49 -2.27 0.01 0.00 -0.04 0.00 0.00 33.50 31.68 1d1d n PRO 88 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 1d1d n ARG 89 N 3.35 0.15 -3.43 0.54 1.85 -1.26 -5.08 116.66 112.77 1d1d n ARG 89 Ca 0.47 -0.91 -0.38 0.00 -1.00 0.00 0.00 57.85 56.03 1d1d n ARG 89 Cb 0.40 -0.56 -0.06 0.00 -1.05 0.00 0.00 32.46 31.19 1d1d n ARG 89 CO 0.00 0.00 0.00 -1.01 -0.01 0.00 0.00 177.63 176.61 1d1d s HIS 90 N -0.16 3.75 -0.19 2.89 3.76 -1.22 -4.97 115.29 119.14 1d1d s HIS 90 Ca 0.01 1.07 0.28 0.00 -0.15 0.00 0.00 55.06 56.28 1d1d s HIS 90 Cb 0.01 -2.36 0.87 0.00 1.11 0.00 0.00 32.58 32.22 1d1d s HIS 90 CO 0.00 0.61 1.80 -1.00 -0.85 0.00 0.00 174.74 175.31 1d1d h PRO 91 N 4.72 0.00 -0.04 8.40 0.13 -1.96 -2.95 132.00 140.30 1d1d h PRO 91 Ca -0.51 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.64 1d1d h PRO 91 Cb 1.22 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.35 1d1d h PRO 91 CO 0.62 0.00 0.04 0.00 -0.23 0.00 0.00 178.00 178.44 1d1d h ALA 92 N 2.03 1.73 -2.40 -0.56 0.00 -1.93 -3.42 119.26 114.71 1d1d h ALA 92 Ca 0.00 -0.00 -0.51 0.00 0.00 0.00 0.00 54.91 54.40 1d1d h ALA 92 Cb 0.73 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 1d1d h ALA 92 CO 0.00 -0.06 -0.08 0.54 0.00 0.00 0.00 179.25 179.65 1d1d s ASN 93 N -6.37 6.46 0.00 0.00 2.20 -1.11 -4.62 114.94 111.50 1d1d s ASN 93 Ca -0.05 0.81 0.00 0.00 -0.94 0.00 0.00 52.86 52.68 1d1d s ASN 93 Cb 0.16 -2.19 0.00 0.00 -2.00 0.00 0.00 41.25 37.22 1d1d s ASN 93 CO 0.59 -0.24 0.00 0.61 -2.94 0.00 0.00 177.10 175.12 1d1d n GLY 94 N -1.01 -2.94 0.13 0.45 0.00 -1.26 -4.97 105.19 95.59 1d1d n GLY 94 Ca -0.01 -0.98 0.00 0.00 0.00 0.00 0.00 46.02 45.04 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 -4.96 117.38 112.71 1d1d n GLN 95 Ca 0.00 -0.59 0.00 0.00 -2.00 0.00 0.00 57.00 54.41 1d1d n GLN 95 Cb 0.00 -0.47 0.00 0.00 -4.06 0.00 0.00 30.24 25.71 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 0.00 -0.76 0.80 1.69 0.00 -1.26 -4.96 105.19 100.70 1d1d n GLY 96 Ca 0.00 -1.63 0.13 0.00 0.00 0.00 0.00 46.02 44.52 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 2.10 -2.68 1.61 0.63 -1.26 -4.59 116.66 112.47 1d1d n ARG 97 Ca 0.00 -1.61 -0.05 0.00 -0.92 0.00 0.00 57.85 55.27 1d1d n ARG 97 Cb 0.00 -1.47 0.08 0.00 0.45 0.00 0.00 32.46 31.53 1d1d n ARG 97 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1d1d n GLY 98 N 1.29 -1.22 0.00 5.14 0.00 -1.26 -5.09 105.19 104.06 1d1d n GLY 98 Ca 0.16 0.75 0.00 0.00 0.00 0.00 0.00 46.02 46.93 1d1d n GLY 98 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1d1d n GLU 99 N 1.14 0.00 -0.82 1.61 0.00 -1.26 -5.10 120.64 116.21 1d1d n GLU 99 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.17 1d1d n GLU 99 Cb 0.71 -0.11 0.00 0.00 0.00 0.00 0.00 31.44 32.04 1d1d n GLU 99 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.13 175.00 1d1d n ARG 100 N -0.17 0.00 -1.36 3.44 3.00 -1.26 -4.93 116.66 115.38 1d1d n ARG 100 Ca 0.00 0.41 -0.29 0.00 -0.00 0.00 0.00 57.85 57.97 1d1d n ARG 100 Cb 0.00 -0.41 0.16 0.00 0.00 0.00 0.00 32.46 32.21 1d1d n ARG 100 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.63 177.55 1d1d s THR 101 N 0.00 1.99 0.04 5.15 -1.32 -1.26 -4.85 115.64 115.40 1d1d s THR 101 Ca 0.00 0.00 -0.24 0.00 -1.21 0.00 0.00 61.69 60.24 1d1d s THR 101 Cb 0.00 -2.63 0.06 0.00 -1.51 0.00 0.00 72.50 68.42 1d1d s THR 101 CO 0.00 0.00 0.55 0.20 -2.21 0.00 0.00 174.62 173.16 1d1d s ASN 102 N -3.77 -0.49 0.34 8.08 -0.87 -1.26 -5.02 114.94 111.94 1d1d s ASN 102 Ca 0.65 0.25 0.05 0.00 -1.57 0.00 0.00 52.86 52.23 1d1d s ASN 102 Cb -0.16 0.51 0.62 0.00 -0.02 0.00 0.00 41.25 42.20 1d1d s ASN 102 CO 0.55 -0.72 1.89 -0.07 -2.57 0.00 0.00 177.10 176.18 1d1d h LEU 103 N 2.75 0.49 -0.83 0.60 4.07 -1.98 -1.72 115.31 118.68 1d1d h LEU 103 Ca -0.30 -0.09 -0.06 0.00 0.08 0.00 0.00 57.88 57.51 1d1d h LEU 103 Cb 1.21 -0.13 -0.03 0.00 1.08 0.00 0.00 40.66 42.80 1d1d h LEU 103 CO 0.40 0.54 0.14 -0.78 -1.08 0.00 0.00 178.44 177.67 1d1d h ASP 104 N 0.51 0.96 -0.28 -0.43 3.58 -1.98 0.40 116.42 119.19 1d1d h ASP 104 Ca 0.11 -0.20 -0.00 0.00 0.42 0.00 0.00 57.03 57.36 1d1d h ASP 104 Cb 0.30 -0.25 -0.01 0.00 1.72 0.00 0.00 39.33 41.08 1d1d h ASP 104 CO 0.01 0.94 0.16 -0.09 -2.88 0.00 0.00 179.24 177.37 1d1d h ARG 105 N 0.97 0.38 -0.06 0.28 2.43 -1.73 -2.15 114.38 114.49 1d1d h ARG 105 Ca 0.20 -0.04 -0.12 0.00 -0.81 0.00 0.00 59.98 59.21 1d1d h ARG 105 Cb 0.36 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.82 1d1d h ARG 105 CO 0.00 0.31 -0.52 -0.07 -1.51 0.00 0.00 179.97 178.18 1d1d h LEU 106 N 0.34 0.17 0.10 3.80 3.38 -1.14 -3.25 115.31 118.71 1d1d h LEU 106 Ca 0.10 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1d1d h LEU 106 Cb 0.04 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 1d1d h LEU 106 CO -0.02 0.66 -0.25 0.11 0.09 0.00 0.00 178.44 179.04 1d1d h LYS 107 N 0.12 -0.37 0.00 1.13 1.57 0.42 -3.44 116.57 116.01 1d1d h LYS 107 Ca 0.00 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 1d1d h LYS 107 Cb 0.96 0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.36 1d1d h LYS 107 CO 0.08 -0.25 0.00 0.41 -0.57 0.00 0.00 179.45 179.12 1d1d n GLY 108 N -1.24 0.56 0.17 3.86 0.00 -0.91 -4.47 105.19 103.17 1d1d n GLY 108 Ca -0.04 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.06 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 0.51 -4.58 0.99 -0.00 -1.24 -3.35 117.00 109.33 1d1d n LEU 109 Ca 0.00 -0.22 -0.30 0.00 -0.00 0.00 0.00 56.01 55.49 1d1d n LEU 109 Cb 0.00 -0.04 0.21 0.00 -0.00 0.00 0.00 43.42 43.59 1d1d n LEU 109 CO 0.00 0.11 0.59 0.00 -0.00 0.00 0.00 177.39 178.09 1d1d n ALA 110 N -0.41 -1.74 -2.09 1.96 0.00 -1.25 -4.70 120.51 112.28 1d1d n ALA 110 Ca 0.13 -0.83 -0.41 0.00 0.00 0.00 0.00 53.44 52.32 1d1d n ALA 110 Cb 0.13 -2.11 -0.03 0.00 0.00 0.00 0.00 19.45 17.45 1d1d n ALA 110 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1d1d s ASP 111 N -2.53 6.94 0.00 0.00 2.15 -1.26 -1.98 116.67 119.99 1d1d s ASP 111 Ca 0.68 2.31 0.00 0.00 0.43 0.00 0.00 52.55 55.97 1d1d s ASP 111 Cb -0.24 -2.60 0.00 0.00 -0.30 0.00 0.00 42.92 39.78 1d1d s ASP 111 CO 0.61 -0.51 0.00 0.61 -0.17 0.00 0.00 175.17 175.71 1d1d n GLY 112 N 2.61 1.70 0.04 2.66 0.00 -1.26 -4.78 105.19 106.16 1d1d n GLY 112 Ca 0.07 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.10 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 0.86 -2.69 1.61 2.81 -0.84 -4.49 117.12 112.37 1d1d n MET 113 Ca 0.00 -0.09 -0.42 0.00 -1.81 0.00 0.00 57.70 55.37 1d1d n MET 113 Cb 0.00 -1.44 -0.03 0.00 -0.71 0.00 0.00 33.22 31.04 1d1d n MET 113 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 1d1d s VAL 114 N -2.88 4.78 0.00 2.03 1.01 -1.09 -2.82 120.40 121.43 1d1d s VAL 114 Ca -0.08 2.03 0.00 0.00 0.00 0.00 0.00 61.98 63.93 1d1d s VAL 114 Cb 0.09 -4.31 0.00 0.00 0.00 0.00 0.00 36.38 32.16 1d1d s VAL 114 CO 0.74 -0.02 0.00 0.61 0.00 0.00 0.00 175.10 176.43 1d1d n GLY 115 N 3.13 0.70 2.60 4.51 0.00 -1.26 -5.01 105.19 109.86 1d1d n GLY 115 Ca 0.09 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.96 3.64 -0.02 1.61 -0.87 -1.13 -5.00 114.94 110.21 1d1d s ASN 116 Ca 0.00 -1.53 -0.22 0.00 -1.57 0.00 0.00 52.86 49.54 1d1d s ASN 116 Cb 0.00 -0.53 -0.22 0.00 -0.02 0.00 0.00 41.25 40.47 1d1d s ASN 116 CO 0.00 -0.41 1.10 1.55 -2.57 0.00 0.00 177.10 176.76 1d1d h PRO 117 N 8.12 0.27 0.00 -0.60 0.13 -1.95 0.58 132.00 138.56 1d1d h PRO 117 Ca -0.15 -0.26 -0.16 0.00 -0.87 0.00 0.00 66.00 64.56 1d1d h PRO 117 Cb 1.00 0.07 -0.02 0.00 0.13 0.00 0.00 31.00 32.18 1d1d h PRO 117 CO 0.43 0.95 -0.75 -0.56 -0.23 0.00 0.00 178.00 177.85 1d1d h GLN 118 N -0.31 0.00 0.00 0.86 -0.00 -1.95 -2.32 115.11 111.41 1d1d h GLN 118 Ca -0.04 0.00 -0.19 0.00 -0.00 0.00 0.00 58.65 58.42 1d1d h GLN 118 Cb 1.06 0.00 0.02 0.00 -0.00 0.00 0.00 27.48 28.55 1d1d h GLN 118 CO 0.07 0.75 -0.76 0.78 -0.00 0.00 0.00 178.83 179.67 1d1d h GLY 119 N 2.65 0.57 1.05 0.06 0.00 -1.93 -2.62 103.07 102.85 1d1d h GLY 119 Ca -0.01 -1.00 -0.09 0.00 0.00 0.00 0.00 47.33 46.23 1d1d h GLY 119 CO 0.10 0.89 0.01 0.06 0.00 0.00 0.00 176.54 177.60 1d1d h GLN 120 N 0.06 0.99 -0.84 4.80 3.07 -0.92 0.12 115.11 122.39 1d1d h GLN 120 Ca -0.10 -0.31 -0.01 0.00 0.09 0.00 0.00 58.65 58.33 1d1d h GLN 120 Cb 1.45 -0.09 -0.04 0.00 0.08 0.00 0.00 27.48 28.88 1d1d h GLN 120 CO 0.15 0.98 0.49 0.00 0.09 0.00 0.00 178.83 180.54 1d1d h ALA 121 N 0.97 1.07 0.00 0.06 0.00 -1.48 0.19 119.26 120.08 1d1d h ALA 121 Ca 0.16 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1d1d h ALA 121 Cb 0.53 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1d1d h ALA 121 CO 0.03 0.56 0.00 0.00 0.00 0.00 0.00 179.25 179.83 1d1d n ALA 122 N -2.37 2.11 0.08 0.00 0.00 -0.99 -2.64 120.51 116.71 1d1d n ALA 122 Ca 0.09 0.01 -0.16 0.00 0.00 0.00 0.00 53.44 53.37 1d1d n ALA 122 Cb 0.07 -1.45 -0.14 0.00 0.00 0.00 0.00 19.45 17.93 1d1d n ALA 122 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1d1d h LEU 123 N 0.00 0.41 -0.47 0.00 6.46 0.14 -3.20 115.31 118.66 1d1d h LEU 123 Ca 0.00 -0.50 0.00 0.00 -0.12 0.00 0.00 57.88 57.26 1d1d h LEU 123 Cb 0.64 -0.13 0.00 0.00 -0.73 0.00 0.00 40.66 40.44 1d1d h LEU 123 CO 0.00 1.41 0.00 -0.07 -0.62 0.00 0.00 178.44 179.16 1d1d h LEU 124 N 0.07 0.00 0.00 2.25 3.38 -0.58 -3.49 115.31 116.94 1d1d h LEU 124 Ca -0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.77 1d1d h LEU 124 Cb 2.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.75 1d1d h LEU 124 CO 0.18 0.00 0.00 -2.11 0.09 0.00 0.00 178.44 176.60 1d1d n ARG 125 N -2.60 0.00 -2.34 1.13 -4.01 -1.08 -4.39 116.66 103.37 1d1d n ARG 125 Ca 0.03 0.00 -0.42 0.00 -1.04 0.00 0.00 57.85 56.42 1d1d n ARG 125 Cb 0.38 0.00 -0.02 0.00 -3.04 0.00 0.00 32.46 29.77 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 -3.18 3.42 0.00 2.89 0.04 -1.26 -3.11 135.00 133.80 1d1d s PRO 126 Ca 0.00 0.76 0.00 0.00 0.04 0.00 0.00 61.00 61.80 1d1d s PRO 126 Cb 0.00 -4.08 0.00 0.00 0.04 0.00 0.00 34.50 30.46 1d1d s PRO 126 CO 0.00 -1.77 0.00 0.41 0.04 0.00 0.00 177.00 175.68 1d1d n GLY 127 N 5.19 3.64 0.30 0.56 0.00 -1.26 -4.96 105.19 108.66 1d1d n GLY 127 Ca 0.15 -0.52 -0.07 0.00 0.00 0.00 0.00 46.02 45.58 1d1d n GLY 127 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1d1d h GLU 128 N 0.00 0.97 -0.86 1.61 5.08 -1.75 -2.50 114.58 117.13 1d1d h GLU 128 Ca 0.00 -0.29 -0.02 0.00 -1.00 0.00 0.00 59.36 58.05 1d1d h GLU 128 Cb 0.00 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.11 1d1d h GLU 128 CO 0.00 0.95 0.46 -0.07 -1.00 0.00 0.00 179.01 179.35 1d1d h LEU 129 N 0.89 1.09 -1.04 1.33 3.38 -1.86 -1.67 115.31 117.43 1d1d h LEU 129 Ca 0.16 -0.11 0.02 0.00 0.09 0.00 0.00 57.88 58.05 1d1d h LEU 129 Cb 0.52 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 40.93 1d1d h LEU 129 CO 0.03 0.89 0.65 0.58 0.09 0.00 0.00 178.44 180.67 1d1d h VAL 130 N 1.21 1.21 -0.99 1.22 2.07 -1.77 0.39 116.25 119.59 1d1d h VAL 130 Ca 0.30 -0.44 0.04 0.00 0.82 0.00 0.00 66.70 67.42 1d1d h VAL 130 Cb 0.06 -0.18 -0.06 0.00 -1.52 0.00 0.00 31.29 29.59 1d1d h VAL 130 CO -0.05 0.23 0.65 0.00 0.02 0.00 0.00 177.57 178.42 1d1d h ALA 131 N 1.41 1.36 -0.37 1.67 0.00 -0.90 0.49 119.26 122.92 1d1d h ALA 131 Ca 0.38 -0.05 -0.14 0.00 0.00 0.00 0.00 54.91 55.10 1d1d h ALA 131 Cb -0.07 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.36 1d1d h ALA 131 CO -0.10 0.54 -0.33 0.82 0.00 0.00 0.00 179.25 180.18 1d1d h ILE 132 N 1.25 1.28 -0.11 0.00 2.04 -0.73 0.87 117.51 122.11 1d1d h ILE 132 Ca 0.39 -1.49 -0.01 0.00 1.00 0.00 0.00 64.86 64.75 1d1d h ILE 132 Cb 0.01 1.34 -0.00 0.00 -0.74 0.00 0.00 36.82 37.42 1d1d h ILE 132 CO -0.12 0.50 0.01 0.74 0.00 0.00 0.00 178.15 179.28 1d1d h THR 133 N 0.70 1.23 -0.36 -0.27 2.02 0.35 0.54 112.91 117.12 1d1d h THR 133 Ca 0.07 -0.72 -0.02 0.00 0.77 0.00 0.00 66.41 66.52 1d1d h THR 133 Cb 0.89 1.50 -0.02 0.00 -1.74 0.00 0.00 68.15 68.79 1d1d h THR 133 CO 0.08 0.21 0.16 0.00 0.37 0.00 0.00 175.52 176.33 1d1d h ALA 134 N 0.77 0.46 -0.44 6.16 0.00 -0.02 0.16 119.26 126.36 1d1d h ALA 134 Ca 0.03 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.77 1d1d h ALA 134 Cb 0.31 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1d1d h ALA 134 CO 0.00 0.04 0.04 0.77 0.00 0.00 0.00 179.25 180.10 1d1d h SER 135 N 0.43 0.64 -0.40 0.00 0.02 -0.73 0.21 113.55 113.73 1d1d h SER 135 Ca 0.12 -0.13 -0.07 0.00 -0.84 0.00 0.00 61.79 60.87 1d1d h SER 135 Cb 0.15 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.51 1d1d h SER 135 CO -0.01 0.69 -0.04 0.00 -1.14 0.00 0.00 176.83 176.33 1d1d h ALA 136 N 1.39 0.55 -0.15 3.77 0.00 0.64 0.33 119.26 125.79 1d1d h ALA 136 Ca 0.14 -0.28 -0.10 0.00 0.00 0.00 0.00 54.91 54.67 1d1d h ALA 136 Cb 0.35 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1d1d h ALA 136 CO 0.01 0.36 -0.35 -0.07 0.00 0.00 0.00 179.25 179.20 1d1d h LEU 137 N 0.55 0.31 -0.18 0.00 4.07 -0.23 0.85 115.31 120.69 1d1d h LEU 137 Ca 0.11 -0.12 -0.13 0.00 0.08 0.00 0.00 57.88 57.82 1d1d h LEU 137 Cb 0.53 -0.09 0.00 0.00 1.08 0.00 0.00 40.66 42.19 1d1d h LEU 137 CO 0.03 0.65 -0.39 1.56 -1.08 0.00 0.00 178.44 179.20 1d1d h GLN 138 N 0.26 0.58 -0.16 1.13 4.20 -0.23 -1.39 115.11 119.52 1d1d h GLN 138 Ca 0.03 -0.39 -0.10 0.00 0.06 0.00 0.00 58.65 58.26 1d1d h GLN 138 Cb 0.74 0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.56 1d1d h GLN 138 CO 0.06 1.00 -0.33 0.00 -0.67 0.00 0.00 178.83 178.89 1d1d h ALA 139 N 0.58 1.16 0.59 3.87 0.00 -0.16 -2.45 119.26 122.84 1d1d h ALA 139 Ca 0.00 -0.36 -0.03 0.00 0.00 0.00 0.00 54.91 54.52 1d1d h ALA 139 Cb 1.00 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.70 1d1d h ALA 139 CO 0.09 0.55 -0.28 0.35 0.00 0.00 0.00 179.25 179.95 1d1d h PHE 140 N 0.27 -0.73 -0.34 0.00 3.57 -0.73 -2.49 116.94 116.49 1d1d h PHE 140 Ca 0.03 -0.02 0.10 0.00 3.53 0.00 0.00 57.97 61.61 1d1d h PHE 140 Cb 0.72 0.24 -0.01 0.00 2.79 0.00 0.00 35.95 39.68 1d1d h PHE 140 CO 0.02 -0.41 0.40 0.07 -2.23 0.00 0.00 178.31 176.16 1d1d h ARG 141 N -1.11 0.00 -0.26 1.11 0.11 -1.25 0.28 114.38 113.26 1d1d h ARG 141 Ca -0.08 0.00 -0.14 0.00 0.10 0.00 0.00 59.98 59.86 1d1d h ARG 141 Cb 0.65 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.73 1d1d h ARG 141 CO 0.13 0.00 -0.38 1.49 0.10 0.00 0.00 179.97 181.31 1d1d h GLU 142 N 0.00 0.71 -0.37 0.08 4.81 -1.21 0.28 114.58 118.89 1d1d h GLU 142 Ca 0.16 -0.42 -0.09 0.00 -0.13 0.00 0.00 59.36 58.88 1d1d h GLU 142 Cb 0.96 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.37 1d1d h GLU 142 CO -0.00 1.04 -0.12 0.28 -0.73 0.00 0.00 179.01 179.48 1d1d h VAL 143 N 0.45 1.28 -0.18 0.32 2.07 -0.05 -1.71 116.25 118.42 1d1d h VAL 143 Ca 0.03 -1.22 -0.02 0.00 0.82 0.00 0.00 66.70 66.30 1d1d h VAL 143 Cb 0.97 1.31 -0.01 0.00 -1.52 0.00 0.00 31.29 32.04 1d1d h VAL 143 CO 0.09 0.40 0.02 0.00 0.02 0.00 0.00 177.57 178.10 1d1d h ALA 144 N 0.81 0.24 -0.95 1.67 0.00 -1.17 -2.81 119.26 117.06 1d1d h ALA 144 Ca 0.09 -0.18 0.14 0.00 0.00 0.00 0.00 54.91 54.96 1d1d h ALA 144 Cb 0.65 -0.07 -0.09 0.00 0.00 0.00 0.00 17.79 18.28 1d1d h ALA 144 CO 0.04 -0.08 0.56 0.00 0.00 0.00 0.00 179.25 179.78 1d1d h ARG 145 N 0.08 0.80 -7.85 0.00 2.47 -0.36 -3.42 114.38 106.11 1d1d h ARG 145 Ca 0.05 -0.05 -0.44 0.00 -1.26 0.00 0.00 59.98 58.28 1d1d h ARG 145 Cb 0.34 -0.18 0.17 0.00 -1.65 0.00 0.00 29.97 28.65 1d1d h ARG 145 CO 0.01 0.53 0.42 -1.17 0.56 0.00 0.00 179.97 180.32 1d1d s LEU 146 N -10.28 2.75 0.60 3.04 2.96 -0.65 -5.07 118.68 112.03 1d1d s LEU 146 Ca -0.12 0.18 -0.03 0.00 -0.22 0.00 0.00 54.13 53.94 1d1d s LEU 146 Cb 0.22 -2.15 0.03 0.00 0.50 0.00 0.00 46.19 44.80 1d1d s LEU 146 CO 0.80 -2.86 0.88 0.00 -1.32 0.00 0.00 176.35 173.84 1d1d s ALA 147 N -3.93 3.49 -0.27 5.97 0.00 -1.26 -4.92 121.76 120.84 1d1d s ALA 147 Ca 0.76 -1.03 -0.02 0.00 0.00 0.00 0.00 51.96 51.67 1d1d s ALA 147 Cb -0.03 -2.38 0.03 0.00 0.00 0.00 0.00 23.12 20.75 1d1d s ALA 147 CO 0.54 -0.92 -0.03 -2.00 0.00 0.00 0.00 175.76 173.35 1d1d s GLU 148 N -4.96 2.73 0.02 0.00 -6.30 -1.26 -4.98 118.70 103.96 1d1d s GLU 148 Ca 0.57 -1.06 -0.30 0.00 -2.50 0.00 0.00 54.97 51.68 1d1d s GLU 148 Cb -0.10 -3.09 -0.05 0.00 0.00 0.00 0.00 34.13 30.89 1d1d s GLU 148 CO 0.42 -0.47 1.18 -1.25 0.02 0.00 0.00 175.26 175.16 1d1d s PRO 149 N 1.32 4.42 -0.21 4.30 0.04 -1.26 -5.02 135.00 138.59 1d1d s PRO 149 Ca -0.01 1.71 -0.08 0.00 0.04 0.00 0.00 61.00 62.66 1d1d s PRO 149 Cb -0.18 -3.42 -0.04 0.00 0.04 0.00 0.00 34.50 30.91 1d1d s PRO 149 CO -0.03 -0.29 0.08 0.00 0.04 0.00 0.00 177.00 176.80 1d1d s ALA 150 N 1.38 3.37 -0.05 8.56 0.00 -1.26 -4.83 121.76 128.93 1d1d s ALA 150 Ca 0.57 -0.87 -0.04 0.00 0.00 0.00 0.00 51.96 51.62 1d1d s ALA 150 Cb -0.27 -2.03 0.01 0.00 0.00 0.00 0.00 23.12 20.83 1d1d s ALA 150 CO 0.27 -0.06 0.07 0.41 0.00 0.00 0.00 175.76 176.46 1d1d n GLY 151 N 4.03 -4.61 0.12 0.00 0.00 -1.26 -4.81 105.19 98.66 1d1d n GLY 151 Ca -0.16 0.38 -0.16 0.00 0.00 0.00 0.00 46.02 46.08 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 2.65 0.32 -0.08 1.61 0.13 -1.95 -3.04 132.00 131.63 1d1d h PRO 152 Ca -0.17 -0.31 0.02 0.00 -0.87 0.00 0.00 66.00 64.68 1d1d h PRO 152 Cb 0.38 0.08 -0.00 0.00 0.13 0.00 0.00 31.00 31.59 1d1d h PRO 152 CO 0.00 0.99 0.11 0.11 -0.23 0.00 0.00 178.00 178.98 1d1d h TRP 153 N -0.23 0.00 -0.22 1.56 0.09 -1.90 0.39 115.95 115.63 1d1d h TRP 153 Ca -0.04 0.00 -0.04 0.00 0.09 0.00 0.00 58.89 58.90 1d1d h TRP 153 Cb 1.11 0.00 -0.01 0.00 0.08 0.00 0.00 29.16 30.33 1d1d h TRP 153 CO 0.15 0.00 -0.03 0.00 0.09 0.00 0.00 178.44 178.65 1d1d h ALA 154 N 1.85 1.55 0.00 0.11 0.00 -1.84 -0.05 119.26 120.88 1d1d h ALA 154 Ca 0.04 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1d1d h ALA 154 Cb 0.26 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1d1d h ALA 154 CO -0.00 0.33 0.00 0.22 0.00 0.00 0.00 179.25 179.79 1d1d h ASP 155 N 0.32 0.00 -3.37 0.00 1.82 -0.30 -3.43 116.42 111.46 1d1d h ASP 155 Ca 0.07 0.00 -0.60 0.00 -0.39 0.00 0.00 57.03 56.11 1d1d h ASP 155 Cb 0.26 0.00 -0.10 0.00 0.68 0.00 0.00 39.33 40.17 1d1d h ASP 155 CO 0.01 0.00 0.32 -0.63 -1.61 0.00 0.00 179.24 177.33 1d1d s ILE 156 N -3.22 4.91 -0.05 2.25 1.01 -0.03 -5.04 121.20 121.04 1d1d s ILE 156 Ca 0.07 1.38 0.02 0.00 0.00 0.00 0.00 60.65 62.12 1d1d s ILE 156 Cb 0.05 -4.04 0.01 0.00 0.01 0.00 0.00 42.46 38.50 1d1d s ILE 156 CO 0.66 -0.01 -0.10 0.42 0.00 0.00 0.00 174.94 175.92 1d1d s THR 157 N 2.55 0.90 0.16 2.92 -4.23 -1.26 -4.91 115.64 111.78 1d1d s THR 157 Ca 0.31 -0.37 -0.31 0.00 -1.18 0.00 0.00 61.69 60.14 1d1d s THR 157 Cb -0.16 -0.83 -0.10 0.00 1.34 0.00 0.00 72.50 72.75 1d1d s THR 157 CO 0.08 0.29 1.55 -1.58 -0.54 0.00 0.00 174.62 174.43 1d1d s GLN 158 N 0.54 4.22 0.26 3.99 2.00 -1.26 -5.00 119.66 124.41 1d1d s GLN 158 Ca -0.10 2.34 0.08 0.00 -2.00 0.00 0.00 55.36 55.68 1d1d s GLN 158 Cb -0.13 -3.16 -0.05 0.00 0.80 0.00 0.00 33.01 30.47 1d1d s GLN 158 CO 0.02 -0.59 -0.10 0.20 -0.50 0.00 0.00 175.29 174.32 1d1d s GLY 159 N 1.12 1.72 0.29 2.59 0.00 -1.26 -4.01 107.32 107.77 1d1d s GLY 159 Ca 0.69 -1.83 0.14 0.00 0.00 0.00 0.00 44.72 43.73 1d1d s GLY 159 CO 0.31 -1.83 1.58 -0.56 0.00 0.00 0.00 173.10 172.60 1d1d h PRO 160 N 2.35 0.00 0.00 2.90 0.13 -1.97 -2.98 132.00 132.44 1d1d h PRO 160 Ca -0.39 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.66 1d1d h PRO 160 Cb 1.23 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.35 1d1d h PRO 160 CO 0.65 0.55 -0.38 1.03 -0.23 0.00 0.00 178.00 179.62 1d1d h SER 161 N 0.00 0.00 -3.35 1.44 0.87 -2.01 -3.42 113.55 107.08 1d1d h SER 161 Ca -0.01 0.00 -0.66 0.00 -1.23 0.00 0.00 61.79 59.90 1d1d h SER 161 Cb 1.17 0.00 -0.18 0.00 -0.44 0.00 0.00 62.40 62.96 1d1d h SER 161 CO 0.07 0.38 -0.64 -0.70 -0.53 0.00 0.00 176.83 175.41 1d1d s GLU 162 N -3.86 3.29 0.43 2.24 2.56 -1.12 -5.08 118.70 117.16 1d1d s GLU 162 Ca -0.01 -0.45 -0.25 0.00 0.00 0.00 0.00 54.97 54.25 1d1d s GLU 162 Cb 0.13 -2.86 -0.09 0.00 2.00 0.00 0.00 34.13 33.31 1d1d s GLU 162 CO 0.70 0.50 1.31 0.45 -0.56 0.00 0.00 175.26 177.66 1d1d n SER 163 N 2.76 2.73 0.04 -1.70 2.88 -1.26 -4.45 113.62 114.62 1d1d n SER 163 Ca -0.18 1.11 -0.11 0.00 -1.33 0.00 0.00 58.87 58.36 1d1d n SER 163 Cb 0.53 -1.52 -0.04 0.00 -0.75 0.00 0.00 64.21 62.42 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 2.12 -0.38 -0.44 0.66 3.57 -1.94 0.91 116.94 121.43 1d1d h PHE 164 Ca -0.49 0.01 -0.11 0.00 3.53 0.00 0.00 57.97 60.92 1d1d h PHE 164 Cb 1.29 0.17 -0.02 0.00 2.79 0.00 0.00 35.95 40.19 1d1d h PHE 164 CO 0.48 -0.22 -0.17 -0.24 -2.23 0.00 0.00 178.31 175.93 1d1d h VAL 165 N -0.24 1.27 -0.16 1.41 3.04 -1.97 0.10 116.25 119.70 1d1d h VAL 165 Ca 0.06 -1.29 -0.00 0.00 -1.01 0.00 0.00 66.70 64.45 1d1d h VAL 165 Cb 0.31 1.11 -0.01 0.00 -2.01 0.00 0.00 31.29 30.70 1d1d h VAL 165 CO -0.16 0.44 0.10 0.44 -1.01 0.00 0.00 177.57 177.38 1d1d h ASP 166 N 0.75 0.19 -0.62 3.17 5.19 -1.75 -1.11 116.42 122.24 1d1d h ASP 166 Ca 0.11 -0.04 -0.09 0.00 -0.62 0.00 0.00 57.03 56.39 1d1d h ASP 166 Cb 0.70 -0.05 -0.02 0.00 0.18 0.00 0.00 39.33 40.14 1d1d h ASP 166 CO 0.05 0.17 0.02 0.15 -3.12 0.00 0.00 179.24 176.52 1d1d h PHE 167 N 0.19 1.18 -0.95 4.55 3.57 0.10 -2.56 116.94 123.02 1d1d h PHE 167 Ca 0.06 -0.19 0.08 0.00 3.53 0.00 0.00 57.97 61.45 1d1d h PHE 167 Cb 0.01 -0.31 -0.07 0.00 2.79 0.00 0.00 35.95 38.38 1d1d h PHE 167 CO -0.06 1.02 0.61 0.00 -2.23 0.00 0.00 178.31 177.66 1d1d h ALA 168 N 1.01 1.52 -0.01 2.41 0.00 -0.44 0.15 119.26 123.90 1d1d h ALA 168 Ca 0.18 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 1d1d h ALA 168 Cb 0.54 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 1d1d h ALA 168 CO 0.03 0.31 0.01 -0.91 0.00 0.00 0.00 179.25 178.69 1d1d h ASN 169 N 1.03 0.02 -0.82 0.00 2.35 -0.82 0.56 115.58 117.89 1d1d h ASN 169 Ca 0.43 -0.11 0.04 0.00 -0.55 0.00 0.00 56.30 56.11 1d1d h ASN 169 Cb 0.30 -0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.62 1d1d h ASN 169 CO -0.18 0.12 0.54 0.03 -1.65 0.00 0.00 177.43 176.29 1d1d h ARG 170 N -0.09 0.97 -0.18 0.81 2.47 -0.93 0.38 114.38 117.82 1d1d h ARG 170 Ca 0.00 -0.06 -0.08 0.00 -1.26 0.00 0.00 59.98 58.59 1d1d h ARG 170 Cb 0.11 -0.22 -0.00 0.00 -1.65 0.00 0.00 29.97 28.21 1d1d h ARG 170 CO -0.00 0.64 -0.20 1.25 0.56 0.00 0.00 179.97 182.22 1d1d h LEU 171 N 1.00 0.49 -0.89 3.04 6.46 -0.28 -1.53 115.31 123.59 1d1d h LEU 171 Ca 0.33 -0.49 0.00 0.00 -0.12 0.00 0.00 57.88 57.60 1d1d h LEU 171 Cb 0.06 -0.14 -0.04 0.00 -0.73 0.00 0.00 40.66 39.81 1d1d h LEU 171 CO -0.10 0.88 0.57 0.40 -0.62 0.00 0.00 178.44 179.57 1d1d h ILE 172 N 0.10 1.24 -0.55 4.05 2.04 0.89 0.30 117.51 125.58 1d1d h ILE 172 Ca 0.02 -0.46 -0.04 0.00 1.00 0.00 0.00 64.86 65.39 1d1d h ILE 172 Cb 0.76 -0.06 -0.03 0.00 -0.74 0.00 0.00 36.82 36.75 1d1d h ILE 172 CO 0.05 0.23 0.18 0.50 0.00 0.00 0.00 178.15 179.11 1d1d h LYS 173 N 1.21 0.82 0.13 2.37 3.64 -0.17 0.47 116.57 125.04 1d1d h LYS 173 Ca 0.32 -0.15 -0.01 0.00 -1.27 0.00 0.00 60.65 59.55 1d1d h LYS 173 Cb -0.11 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 31.57 1d1d h LYS 173 CO -0.07 0.71 -0.06 0.00 -2.27 0.00 0.00 179.45 177.76 1d1d h ALA 174 N 1.39 -0.17 -0.31 5.00 0.00 -0.14 -1.83 119.26 123.20 1d1d h ALA 174 Ca 0.18 -0.21 0.04 0.00 0.00 0.00 0.00 54.91 54.92 1d1d h ALA 174 Cb 0.23 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 1d1d h ALA 174 CO -0.01 -0.37 0.10 0.28 0.00 0.00 0.00 179.25 179.24 1d1d h VAL 175 N -0.62 0.90 -0.95 0.00 2.07 -0.21 -0.73 116.25 116.71 1d1d h VAL 175 Ca -0.02 -0.08 0.15 0.00 0.82 0.00 0.00 66.70 67.57 1d1d h VAL 175 Cb 0.48 0.66 -0.08 0.00 -1.52 0.00 0.00 31.29 30.82 1d1d h VAL 175 CO 0.03 0.04 0.60 -0.08 0.02 0.00 0.00 177.57 178.18 1d1d h GLU 176 N 0.23 0.77 -1.00 1.57 4.57 -0.06 0.19 114.58 120.85 1d1d h GLU 176 Ca 0.14 -0.05 -0.55 0.00 -1.18 0.00 0.00 59.36 57.72 1d1d h GLU 176 Cb 0.12 -0.17 -0.30 0.00 -0.16 0.00 0.00 28.75 28.23 1d1d h GLU 176 CO -0.15 0.51 0.71 0.41 -1.18 0.00 0.00 179.01 179.31 1d1d n GLY 177 N -1.39 4.81 3.57 1.92 0.00 -0.41 -4.94 105.19 108.75 1d1d n GLY 177 Ca 0.19 -1.37 -0.26 0.00 0.00 0.00 0.00 46.02 44.57 1d1d n GLY 177 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1d1d s SER 178 N -1.41 3.79 -1.12 1.61 1.04 0.66 -4.96 113.70 113.31 1d1d s SER 178 Ca 0.58 -1.23 -0.15 0.00 0.48 0.00 0.00 55.95 55.63 1d1d s SER 178 Cb 0.48 -0.37 0.16 0.00 0.10 0.00 0.00 66.02 66.39 1d1d s SER 178 CO 0.08 -0.26 1.35 1.51 0.98 0.00 0.00 173.24 176.89 1d1d s ASP 179 N -3.64 6.93 0.17 7.02 -4.77 -1.26 -4.96 116.67 116.16 1d1d s ASP 179 Ca 0.33 -2.68 0.07 0.00 -3.30 0.00 0.00 52.55 46.96 1d1d s ASP 179 Cb 0.04 -2.40 -0.04 0.00 -1.09 0.00 0.00 42.92 39.42 1d1d s ASP 179 CO 0.17 -0.86 -0.13 -0.76 0.70 0.00 0.00 175.17 174.29 1d1d s LEU 180 N 1.99 2.52 0.71 2.11 1.43 -1.26 -5.12 118.68 121.06 1d1d s LEU 180 Ca 0.40 -0.98 -0.11 0.00 -1.03 0.00 0.00 54.13 52.41 1d1d s LEU 180 Cb -0.03 -0.58 0.02 0.00 0.03 0.00 0.00 46.19 45.63 1d1d s LEU 180 CO -0.03 -0.20 1.07 -2.16 0.23 0.00 0.00 176.35 175.26 1d1d s PRO 181 N -3.47 2.78 -1.22 1.29 0.04 -1.26 -4.92 135.00 128.24 1d1d s PRO 181 Ca 0.18 0.89 -0.20 0.00 0.04 0.00 0.00 61.00 61.92 1d1d s PRO 181 Cb -0.01 -1.98 -0.02 0.00 0.04 0.00 0.00 34.50 32.54 1d1d s PRO 181 CO 0.05 -1.20 1.88 -0.35 0.04 0.00 0.00 177.00 177.42 1d1d n PRO 182 N -3.19 2.36 0.00 0.56 -0.04 -1.26 -2.42 135.00 131.01 1d1d n PRO 182 Ca 0.07 -2.75 0.00 0.00 -0.04 0.00 0.00 63.50 60.78 1d1d n PRO 182 Cb 0.54 -3.51 0.00 0.00 -0.04 0.00 0.00 33.50 30.49 1d1d n PRO 182 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1d1d n SER 183 N 10.48 0.00 0.01 3.54 7.64 -1.26 -4.94 113.62 129.10 1d1d n SER 183 Ca 0.48 0.00 0.13 0.00 1.01 0.00 0.00 58.87 60.49 1d1d n SER 183 Cb 0.45 0.00 0.56 0.00 -1.01 0.00 0.00 64.21 64.21 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 2.23 -1.90 -0.43 0.00 -1.01 -4.25 120.51 115.15 1d1d n ALA 184 Ca 0.00 -0.08 -0.42 0.00 0.00 0.00 0.00 53.44 52.94 1d1d n ALA 184 Cb 0.00 -1.44 -0.00 0.00 0.00 0.00 0.00 19.45 18.01 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 -1.60 3.19 0.00 0.00 1.74 -1.24 -2.50 116.66 116.25 1d1d n ARG 185 Ca 0.06 -2.88 0.00 0.00 -0.77 0.00 0.00 57.85 54.26 1d1d n ARG 185 Cb 0.33 -3.13 0.00 0.00 -1.02 0.00 0.00 32.46 28.64 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 5.13 0.00 0.16 7.54 0.00 -1.26 -4.93 120.51 127.15 1d1d n ALA 186 Ca 0.50 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.97 1d1d n ALA 186 Cb 0.37 0.00 0.20 0.00 0.00 0.00 0.00 19.45 20.02 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 -0.30 0.00 0.13 -1.63 -2.65 132.00 127.55 1d1d h PRO 187 Ca 0.00 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.99 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 0.49 -0.40 0.28 -0.23 0.00 0.00 178.00 178.14 1d1d h VAL 188 N 0.00 1.29 -0.13 1.56 2.07 -1.83 0.41 116.25 119.61 1d1d h VAL 188 Ca -0.00 -1.57 -0.04 0.00 0.82 0.00 0.00 66.70 65.91 1d1d h VAL 188 Cb 1.12 1.48 -0.00 0.00 -1.52 0.00 0.00 31.29 32.37 1d1d h VAL 188 CO 0.06 0.51 -0.06 0.40 0.02 0.00 0.00 177.57 178.51 1d1d h ILE 189 N 0.59 1.31 -0.32 4.57 2.04 -1.76 -2.02 117.51 121.92 1d1d h ILE 189 Ca 0.05 -1.07 -0.08 0.00 1.00 0.00 0.00 64.86 64.76 1d1d h ILE 189 Cb 0.94 1.73 -0.02 0.00 -0.74 0.00 0.00 36.82 38.74 1d1d h ILE 189 CO 0.09 0.31 -0.15 0.40 0.00 0.00 0.00 178.15 178.79 1d1d h ILE 190 N -0.06 1.25 -0.78 -0.67 2.04 -1.40 -2.18 117.51 115.71 1d1d h ILE 190 Ca 0.03 -1.13 0.02 0.00 1.00 0.00 0.00 64.86 64.78 1d1d h ILE 190 Cb 0.51 1.17 -0.04 0.00 -0.74 0.00 0.00 36.82 37.72 1d1d h ILE 190 CO 0.02 0.37 0.52 -0.78 0.00 0.00 0.00 178.15 178.27 1d1d h ASP 191 N 0.52 0.87 -0.26 1.72 3.58 -0.01 -1.30 116.42 121.54 1d1d h ASP 191 Ca 0.09 -0.02 -0.03 0.00 0.42 0.00 0.00 57.03 57.49 1d1d h ASP 191 Cb 0.57 -0.21 -0.01 0.00 1.72 0.00 0.00 39.33 41.39 1d1d h ASP 191 CO 0.04 0.62 0.05 0.00 -2.88 0.00 0.00 179.24 177.07 1d1d h PHE 193 N 0.25 0.96 -0.42 0.00 0.04 -0.86 0.45 116.94 117.35 1d1d h PHE 193 Ca 0.08 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.88 1d1d h PHE 193 Cb 0.31 -0.30 0.00 0.00 2.20 0.00 0.00 35.95 38.16 1d1d h PHE 193 CO 0.02 0.35 0.00 2.89 -0.60 0.00 0.00 178.31 180.97 1d1d n ARG 194 N -4.60 2.28 0.05 1.51 1.85 -0.59 -4.08 116.66 113.08 1d1d n ARG 194 Ca 0.18 -1.95 -0.22 0.00 -1.00 0.00 0.00 57.85 54.86 1d1d n ARG 194 Cb 0.44 -1.46 -0.15 0.00 -1.05 0.00 0.00 32.46 30.24 1d1d n ARG 194 CO 0.00 0.00 0.00 0.37 -0.01 0.00 0.00 177.63 177.99 1d1d h GLN 195 N 3.54 0.34 0.00 2.89 4.15 0.38 -3.48 115.11 122.93 1d1d h GLN 195 Ca 0.00 -0.59 0.00 0.00 0.77 0.00 0.00 58.65 58.83 1d1d h GLN 195 Cb 0.79 0.22 0.00 0.00 0.21 0.00 0.00 27.48 28.70 1d1d h GLN 195 CO 0.00 1.28 0.00 1.63 -1.93 0.00 0.00 178.83 179.81 1d1d n LYS 196 N -3.66 0.00 0.00 1.69 5.02 -1.02 -5.07 118.16 115.12 1d1d n LYS 196 Ca -0.26 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.03 1d1d n LYS 196 Cb 1.03 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 36.04 1d1d n LYS 196 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1d1d n SER 197 N -0.02 0.00 -4.94 4.39 7.64 -1.26 -4.71 113.62 114.72 1d1d n SER 197 Ca 0.00 0.00 -0.21 0.00 1.01 0.00 0.00 58.87 59.67 1d1d n SER 197 Cb 0.00 0.00 0.05 0.00 -1.01 0.00 0.00 64.21 63.25 1d1d n SER 197 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 1d1d s GLN 198 N 0.00 2.43 0.10 1.43 1.11 -1.26 -4.94 119.66 118.53 1d1d s GLN 198 Ca 0.00 -0.92 -0.10 0.00 0.01 0.00 0.00 55.36 54.35 1d1d s GLN 198 Cb 0.00 -2.50 -0.15 0.00 -1.01 0.00 0.00 33.01 29.35 1d1d s GLN 198 CO 0.00 -0.78 1.27 -1.00 0.01 0.00 0.00 175.29 174.79 1d1d h PRO 199 N 0.04 0.64 0.02 2.91 0.13 -1.97 0.19 132.00 133.97 1d1d h PRO 199 Ca -0.40 -0.62 -0.00 0.00 -0.87 0.00 0.00 66.00 64.11 1d1d h PRO 199 Cb 1.29 0.16 0.00 0.00 0.13 0.00 0.00 31.00 32.58 1d1d h PRO 199 CO 0.49 1.23 -0.01 -0.44 -0.23 0.00 0.00 178.00 179.04 1d1d h ASP 200 N 0.39 -0.02 -0.09 1.44 3.32 -1.97 1.46 116.42 120.94 1d1d h ASP 200 Ca -0.09 -0.21 -0.12 0.00 0.02 0.00 0.00 57.03 56.63 1d1d h ASP 200 Cb 1.55 0.01 -0.01 0.00 0.22 0.00 0.00 39.33 41.10 1d1d h ASP 200 CO 0.18 0.20 -0.31 0.40 -1.72 0.00 0.00 179.24 177.98 1d1d h ILE 201 N -0.25 1.28 -0.26 0.35 1.08 -1.97 -1.61 117.51 116.14 1d1d h ILE 201 Ca -0.00 -1.42 -0.12 0.00 -0.39 0.00 0.00 64.86 62.93 1d1d h ILE 201 Cb 0.24 1.42 -0.00 0.00 -3.07 0.00 0.00 36.82 35.40 1d1d h ILE 201 CO 0.00 0.45 -0.30 -0.61 -0.69 0.00 0.00 178.15 177.01 1d1d h GLN 202 N 0.49 0.67 -0.17 2.37 5.75 -0.38 -1.72 115.11 122.12 1d1d h GLN 202 Ca 0.06 -0.37 -0.03 0.00 -0.15 0.00 0.00 58.65 58.16 1d1d h GLN 202 Cb 0.79 0.02 -0.01 0.00 1.07 0.00 0.00 27.48 29.35 1d1d h GLN 202 CO 0.06 0.98 -0.04 0.37 -2.65 0.00 0.00 178.83 177.55 1d1d h GLN 203 N 0.39 0.25 -0.02 1.69 5.75 0.22 0.38 115.11 123.78 1d1d h GLN 203 Ca 0.04 -0.04 -0.01 0.00 -0.15 0.00 0.00 58.65 58.48 1d1d h GLN 203 Cb 0.87 -0.04 -0.00 0.00 1.07 0.00 0.00 27.48 29.38 1d1d h GLN 203 CO 0.07 0.31 -0.03 1.25 -2.65 0.00 0.00 178.83 177.78 1d1d h LEU 204 N 0.25 0.06 -0.90 -2.39 6.46 -1.12 -0.99 115.31 116.68 1d1d h LEU 204 Ca 0.06 -0.52 -0.04 0.00 -0.12 0.00 0.00 57.88 57.25 1d1d h LEU 204 Cb 0.24 -0.02 -0.03 0.00 -0.73 0.00 0.00 40.66 40.12 1d1d h LEU 204 CO 0.01 0.58 0.30 0.40 -0.62 0.00 0.00 178.44 179.10 1d1d h ILE 205 N -0.45 1.25 -0.29 4.05 2.04 -0.92 0.19 117.51 123.37 1d1d h ILE 205 Ca 0.00 -0.78 -0.05 0.00 1.00 0.00 0.00 64.86 65.03 1d1d h ILE 205 Cb 0.56 0.36 -0.02 0.00 -0.74 0.00 0.00 36.82 36.99 1d1d h ILE 205 CO 0.01 0.32 -0.03 -0.09 0.00 0.00 0.00 178.15 178.36 1d1d h ARG 206 N 1.08 0.46 -0.11 2.37 1.12 -0.20 -0.08 114.38 119.02 1d1d h ARG 206 Ca 0.25 -0.10 0.00 0.00 -1.11 0.00 0.00 59.98 59.02 1d1d h ARG 206 Cb 0.20 -0.07 0.00 0.00 -0.01 0.00 0.00 29.97 30.09 1d1d h ARG 206 CO -0.02 0.51 0.00 0.00 -3.11 0.00 0.00 179.97 177.35 1d1d n ALA 207 N -2.48 2.54 -1.47 2.80 0.00 -0.38 -4.91 120.51 116.60 1d1d n ALA 207 Ca 0.01 -0.48 -0.33 0.00 0.00 0.00 0.00 53.44 52.64 1d1d n ALA 207 Cb 0.25 -1.13 0.06 0.00 0.00 0.00 0.00 19.45 18.63 1d1d n ALA 207 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1d1d s ALA 208 N -1.87 2.39 0.51 0.00 0.00 -0.03 -5.00 121.76 117.76 1d1d s ALA 208 Ca 0.34 0.62 -0.19 0.00 0.00 0.00 0.00 51.96 52.73 1d1d s ALA 208 Cb 0.18 -3.35 -0.08 0.00 0.00 0.00 0.00 23.12 19.88 1d1d s ALA 208 CO 0.29 -1.41 1.04 -1.25 0.00 0.00 0.00 175.76 174.43 1d1d s PRO 209 N -4.04 3.72 -0.05 0.00 0.04 -1.26 -4.93 135.00 128.47 1d1d s PRO 209 Ca 0.69 1.32 0.07 0.00 0.04 0.00 0.00 61.00 63.11 1d1d s PRO 209 Cb -0.22 -2.09 0.29 0.00 0.04 0.00 0.00 34.50 32.52 1d1d s PRO 209 CO 0.42 -0.49 1.10 0.43 0.04 0.00 0.00 177.00 178.50 1d1d n SER 210 N -1.17 2.25 -0.09 6.66 7.64 -1.26 -3.44 113.62 124.20 1d1d n SER 210 Ca 0.09 -2.19 0.11 0.00 1.01 0.00 0.00 58.87 57.89 1d1d n SER 210 Cb 0.53 -0.40 0.13 0.00 -1.01 0.00 0.00 64.21 63.46 1d1d n SER 210 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10 1d1d n THR 211 N 0.29 0.00 -3.99 0.44 5.66 -1.26 -4.90 114.28 110.52 1d1d n THR 211 Ca 0.10 -0.05 -0.10 0.00 -3.05 0.00 0.00 64.05 60.95 1d1d n THR 211 Cb 0.45 0.62 -0.11 0.00 -1.55 0.00 0.00 70.33 69.73 1d1d n THR 211 CO 0.00 0.00 0.00 -1.48 -3.05 0.00 0.00 175.07 170.54 1d1d s LEU 212 N -2.87 2.21 -0.37 1.09 0.05 -1.22 -5.06 118.68 112.52 1d1d s LEU 212 Ca 0.13 -0.45 0.09 0.00 0.05 0.00 0.00 54.13 53.95 1d1d s LEU 212 Cb 0.17 0.03 0.37 0.00 -2.05 0.00 0.00 46.19 44.71 1d1d s LEU 212 CO 0.71 -0.24 1.37 0.35 -0.55 0.00 0.00 176.35 177.99 1d1d n THR 213 N 1.75 0.00 -4.34 5.48 -2.24 -1.26 -4.85 114.28 108.82 1d1d n THR 213 Ca -0.22 -1.27 -0.26 0.00 -2.27 0.00 0.00 64.05 60.03 1d1d n THR 213 Cb 0.55 0.96 -0.13 0.00 -2.10 0.00 0.00 70.33 69.62 1d1d n THR 213 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1d1d s THR 214 N 0.16 2.00 -0.32 4.28 2.01 -1.26 -3.45 115.64 119.07 1d1d s THR 214 Ca 0.17 -1.71 -0.05 0.00 0.31 0.00 0.00 61.69 60.41 1d1d s THR 214 Cb 0.38 -1.81 -0.17 0.00 0.01 0.00 0.00 72.50 70.91 1d1d s THR 214 CO -0.09 -0.03 2.75 -0.81 -0.69 0.00 0.00 174.62 175.75 1d1d n PRO 215 N 0.87 1.84 0.19 4.92 -0.04 -1.25 -2.74 135.00 138.79 1d1d n PRO 215 Ca -0.18 -1.02 0.00 0.00 -0.04 0.00 0.00 63.50 62.26 1d1d n PRO 215 Cb 0.54 -2.07 0.00 0.00 -0.04 0.00 0.00 33.50 31.93 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 2.91 -1.07 0.14 0.55 0.00 -1.26 -4.87 105.19 101.58 1d1d n GLY 216 Ca 0.39 0.18 -0.10 0.00 0.00 0.00 0.00 46.02 46.49 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 -0.36 1.61 3.07 -1.97 -0.59 114.58 116.64 1d1d h GLU 217 Ca 0.00 -0.30 0.01 0.00 -0.50 0.00 0.00 59.36 58.57 1d1d h GLU 217 Cb 0.00 0.09 -0.02 0.00 -0.84 0.00 0.00 28.75 27.97 1d1d h GLU 217 CO 0.00 1.00 0.22 0.82 -1.40 0.00 0.00 179.01 179.66 1d1d h ILE 218 N 0.17 1.06 -0.15 3.13 5.03 -1.87 0.70 117.51 125.58 1d1d h ILE 218 Ca -0.06 -0.15 -0.14 0.00 -0.12 0.00 0.00 64.86 64.39 1d1d h ILE 218 Cb 1.51 0.57 0.00 0.00 -3.03 0.00 0.00 36.82 35.87 1d1d h ILE 218 CO 0.14 0.08 -0.44 0.40 -0.68 0.00 0.00 178.15 177.66 1d1d h ILE 219 N 0.45 1.35 -0.38 -0.67 2.04 -1.78 -1.16 117.51 117.35 1d1d h ILE 219 Ca 0.14 -1.71 0.04 0.00 1.00 0.00 0.00 64.86 64.33 1d1d h ILE 219 Cb -0.02 2.03 -0.02 0.00 -0.74 0.00 0.00 36.82 38.07 1d1d h ILE 219 CO -0.05 0.52 0.26 0.50 0.00 0.00 0.00 178.15 179.38 1d1d h LYS 220 N 0.19 0.35 0.02 2.37 1.63 -0.76 0.55 116.57 120.91 1d1d h LYS 220 Ca -0.01 -0.02 -0.00 0.00 -0.85 0.00 0.00 60.65 59.77 1d1d h LYS 220 Cb 1.05 -0.08 0.00 0.00 -0.60 0.00 0.00 32.23 32.61 1d1d h LYS 220 CO 0.09 0.23 -0.01 -0.92 -3.45 0.00 0.00 179.45 175.39 1d1d h TYR 221 N 0.36 -0.02 -0.90 1.91 3.20 0.58 0.11 116.97 122.20 1d1d h TYR 221 Ca 0.16 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.03 1d1d h TYR 221 Cb 0.20 0.01 -0.04 0.00 1.54 0.00 0.00 36.73 38.43 1d1d h TYR 221 CO -0.00 0.66 0.57 0.28 -1.64 0.00 0.00 178.16 178.03 1d1d h VAL 222 N -0.75 1.24 -0.32 1.81 2.07 -0.70 0.25 116.25 119.85 1d1d h VAL 222 Ca -0.00 -0.47 -0.09 0.00 0.82 0.00 0.00 66.70 66.96 1d1d h VAL 222 Cb 0.69 -0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 30.40 1d1d h VAL 222 CO 0.00 0.24 -0.16 -0.07 0.02 0.00 0.00 177.57 177.60 1d1d h LEU 223 N 1.22 0.69 -2.16 2.57 3.38 0.02 0.66 115.31 121.69 1d1d h LEU 223 Ca 0.33 -0.41 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 1d1d h LEU 223 Cb -0.10 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.45 1d1d h LEU 223 CO -0.07 0.95 -0.04 0.44 0.09 0.00 0.00 178.44 179.81 1d1d h ASP 224 N 0.43 0.00 0.11 -0.43 5.19 -0.13 -1.88 116.42 119.72 1d1d h ASP 224 Ca 0.07 0.00 -0.21 0.00 -0.62 0.00 0.00 57.03 56.27 1d1d h ASP 224 Cb 0.69 0.00 0.01 0.00 0.18 0.00 0.00 39.33 40.21 1d1d h ASP 224 CO 0.05 0.04 -1.04 0.03 -3.12 0.00 0.00 179.24 175.20 1d1d h ARG 225 N 0.00 0.23 -0.74 3.56 2.47 0.05 -3.34 114.38 116.62 1d1d h ARG 225 Ca -0.00 -0.40 0.07 0.00 -1.26 0.00 0.00 59.98 58.39 1d1d h ARG 225 Cb 0.26 0.15 -0.06 0.00 -1.65 0.00 0.00 29.97 28.67 1d1d h ARG 225 CO 0.01 1.19 0.41 1.96 0.56 0.00 0.00 179.97 184.10 1d1d h GLN 226 N -0.43 0.71 -6.39 0.04 4.20 -0.40 -3.38 115.11 109.46 1d1d h GLN 226 Ca -0.21 -0.04 -0.57 0.00 0.06 0.00 0.00 58.65 57.88 1d1d h GLN 226 Cb 1.62 -0.16 -0.04 0.00 0.30 0.00 0.00 27.48 29.20 1d1d h GLN 226 CO 0.08 0.47 1.16 0.21 -0.67 0.00 0.00 178.83 180.08 1d1d s LYS 227 N -6.07 3.52 -0.07 1.46 2.36 -0.75 -4.88 119.74 115.31 1d1d s LYS 227 Ca -0.13 1.24 -0.01 0.00 -2.55 0.00 0.00 55.97 54.53 1d1d s LYS 227 Cb 0.17 -4.09 -0.00 0.00 -1.05 0.00 0.00 37.83 32.86 1d1d s LYS 227 CO 0.77 -1.64 -0.02 0.82 1.55 0.00 0.00 175.35 176.83 1d1d h ILE 228 N 6.56 0.00 -3.04 5.43 5.03 -1.86 -3.47 117.51 126.16 1d1d h ILE 228 Ca -0.31 -0.65 -0.56 0.00 -0.12 0.00 0.00 64.86 63.22 1d1d h ILE 228 Cb 1.14 0.00 0.20 0.00 -3.03 0.00 0.00 36.82 35.12 1d1d h ILE 228 CO 1.05 0.00 -0.64 0.00 -0.68 0.00 0.00 178.15 177.88 1d1d n ALA 229 N -2.61 -2.26 1.50 1.87 0.00 -1.26 -5.14 120.51 112.61 1d1d n ALA 229 Ca -0.01 -0.35 0.12 0.00 0.00 0.00 0.00 53.44 53.21 1d1d n ALA 229 Cb 0.03 -1.74 0.71 0.00 0.00 0.00 0.00 19.45 18.46 1d1d n ALA 229 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15