#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 1.14 0.11 5.87 2.01 -1.26 -5.07 115.64 118.43 1d1d s THR 12 Ca 0.00 -0.76 -0.30 0.00 0.31 0.00 0.00 61.69 60.94 1d1d s THR 12 Cb 0.00 -0.98 -0.06 0.00 0.01 0.00 0.00 72.50 71.47 1d1d s THR 12 CO 0.00 0.21 1.15 -2.16 -0.69 0.00 0.00 174.62 173.13 1d1d s PRO 13 N -0.63 4.50 -0.51 4.92 0.04 -1.26 -4.92 135.00 137.14 1d1d s PRO 13 Ca 0.04 1.74 -0.26 0.00 0.04 0.00 0.00 61.00 62.56 1d1d s PRO 13 Cb -0.06 -3.32 -0.06 0.00 0.04 0.00 0.00 34.50 31.10 1d1d s PRO 13 CO 0.00 -0.11 2.26 -1.17 0.04 0.00 0.00 177.00 178.03 1d1d s LEU 14 N 0.42 3.38 -0.01 -3.56 1.98 -1.26 -4.92 118.68 114.71 1d1d s LEU 14 Ca 0.54 0.92 0.03 0.00 -2.89 0.00 0.00 54.13 52.74 1d1d s LEU 14 Cb -0.29 -2.55 -0.01 0.00 0.66 0.00 0.00 46.19 44.00 1d1d s LEU 14 CO 0.32 -2.72 -0.10 -0.70 -1.89 0.00 0.00 176.35 171.26 1d1d s GLU 15 N 7.89 0.83 0.09 1.98 2.56 -1.26 -5.04 118.70 125.75 1d1d s GLU 15 Ca 0.90 -0.34 -0.12 0.00 0.00 0.00 0.00 54.97 55.41 1d1d s GLU 15 Cb -0.16 -0.79 -0.19 0.00 2.00 0.00 0.00 34.13 34.99 1d1d s GLU 15 CO 0.25 0.19 1.25 -1.00 -0.56 0.00 0.00 175.26 175.38 1d1d h PRO 16 N 6.01 0.70 -0.31 4.30 0.13 -1.97 0.19 132.00 141.05 1d1d h PRO 16 Ca -0.32 -0.69 -0.08 0.00 -0.87 0.00 0.00 66.00 64.04 1d1d h PRO 16 Cb 1.18 0.18 -0.01 0.00 0.13 0.00 0.00 31.00 32.47 1d1d h PRO 16 CO 0.49 1.28 -0.13 1.57 -0.23 0.00 0.00 178.00 180.98 1d1d h LYS 17 N 0.43 0.64 -0.28 0.86 2.10 -1.99 0.03 116.57 118.37 1d1d h LYS 17 Ca -0.10 -0.27 -0.09 0.00 -2.00 0.00 0.00 60.65 58.19 1d1d h LYS 17 Cb 1.58 -0.02 -0.01 0.00 -0.90 0.00 0.00 32.23 32.88 1d1d h LYS 17 CO 0.19 0.85 -0.19 -0.07 -2.00 0.00 0.00 179.45 178.23 1d1d h LEU 18 N 0.40 0.65 -1.30 7.07 3.38 -1.94 -2.24 115.31 121.33 1d1d h LEU 18 Ca 0.07 -0.44 0.03 0.00 0.09 0.00 0.00 57.88 57.64 1d1d h LEU 18 Cb 0.65 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 41.18 1d1d h LEU 18 CO 0.04 0.95 0.49 0.40 0.09 0.00 0.00 178.44 180.41 1d1d h ILE 19 N 0.36 1.11 -0.69 1.22 2.04 -0.54 0.57 117.51 121.58 1d1d h ILE 19 Ca 0.06 -0.31 -0.08 0.00 1.00 0.00 0.00 64.86 65.53 1d1d h ILE 19 Cb 0.73 0.12 -0.03 0.00 -0.74 0.00 0.00 36.82 36.90 1d1d h ILE 19 CO 0.05 0.17 0.14 0.74 0.00 0.00 0.00 178.15 179.24 1d1d h THR 20 N 0.91 1.26 -0.09 -0.27 2.02 -0.74 0.48 112.91 116.49 1d1d h THR 20 Ca 0.30 -1.01 -0.02 0.00 0.77 0.00 0.00 66.41 66.45 1d1d h THR 20 Cb 0.05 0.59 -0.00 0.00 -1.74 0.00 0.00 68.15 67.05 1d1d h THR 20 CO -0.09 0.39 -0.01 0.03 0.37 0.00 0.00 175.52 176.21 1d1d h ARG 21 N 1.06 0.17 -0.69 6.66 3.08 -0.60 -0.25 114.38 123.81 1d1d h ARG 21 Ca 0.21 -0.06 -0.06 0.00 0.07 0.00 0.00 59.98 60.14 1d1d h ARG 21 Cb 0.41 -0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.42 1d1d h ARG 21 CO 0.01 0.46 0.20 1.25 -1.07 0.00 0.00 179.97 180.81 1d1d h LEU 22 N -0.14 1.02 -1.16 3.04 6.46 -0.82 -1.89 115.31 121.83 1d1d h LEU 22 Ca 0.02 -0.22 -0.01 0.00 -0.12 0.00 0.00 57.88 57.56 1d1d h LEU 22 Cb 0.39 -0.27 -0.04 0.00 -0.73 0.00 0.00 40.66 40.02 1d1d h LEU 22 CO 0.01 0.97 0.44 0.00 -0.62 0.00 0.00 178.44 179.24 1d1d h ALA 23 N 1.09 1.37 -0.59 1.25 0.00 0.07 -1.59 119.26 120.86 1d1d h ALA 23 Ca 0.22 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 1d1d h ALA 23 Cb 0.33 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 1d1d h ALA 23 CO -0.00 0.54 0.27 0.22 0.00 0.00 0.00 179.25 180.28 1d1d h ASP 24 N 1.02 0.77 -0.71 0.00 3.58 -0.39 -2.02 116.42 118.68 1d1d h ASP 24 Ca 0.27 -0.14 0.04 0.00 0.42 0.00 0.00 57.03 57.61 1d1d h ASP 24 Cb -0.02 -0.20 -0.04 0.00 1.72 0.00 0.00 39.33 40.79 1d1d h ASP 24 CO -0.05 0.70 0.47 0.74 -2.88 0.00 0.00 179.24 178.22 1d1d h THR 25 N 0.80 1.10 -0.69 2.25 2.02 -0.55 0.70 112.91 118.53 1d1d h THR 25 Ca 0.20 -0.29 -0.02 0.00 0.77 0.00 0.00 66.41 67.07 1d1d h THR 25 Cb 0.13 0.17 -0.03 0.00 -1.74 0.00 0.00 68.15 66.69 1d1d h THR 25 CO -0.02 0.15 0.36 0.58 0.37 0.00 0.00 175.52 176.97 1d1d h VAL 26 N 0.85 1.22 -0.06 3.16 2.07 -0.66 1.84 116.25 124.67 1d1d h VAL 26 Ca 0.28 -0.58 -0.01 0.00 0.82 0.00 0.00 66.70 67.21 1d1d h VAL 26 Cb 0.08 0.33 -0.00 0.00 -1.52 0.00 0.00 31.29 30.18 1d1d h VAL 26 CO -0.08 0.25 -0.01 -0.09 0.02 0.00 0.00 177.57 177.65 1d1d h ARG 27 N 0.96 0.11 -0.19 1.57 2.43 -0.76 0.61 114.38 119.11 1d1d h ARG 27 Ca 0.24 -0.04 -0.11 0.00 -0.81 0.00 0.00 59.98 59.26 1d1d h ARG 27 Cb 0.07 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.60 1d1d h ARG 27 CO -0.04 0.44 -0.34 1.79 -1.51 0.00 0.00 179.97 180.32 1d1d h THR 28 N -0.22 1.29 0.00 0.20 1.35 -0.68 -2.04 112.91 112.81 1d1d h THR 28 Ca 0.02 -1.41 0.00 0.00 -0.55 0.00 0.00 66.41 64.47 1d1d h THR 28 Cb 0.40 1.51 0.00 0.00 -1.73 0.00 0.00 68.15 68.33 1d1d h THR 28 CO 0.01 0.44 -0.08 0.29 -0.25 0.00 0.00 175.52 175.92 1d1d n LYS 29 N -4.07 0.25 -0.08 4.72 4.76 0.62 -5.01 118.16 119.34 1d1d n LYS 29 Ca -0.01 0.18 0.00 0.00 -2.87 0.00 0.00 58.31 55.61 1d1d n LYS 29 Cb 0.45 -1.77 0.00 0.00 -1.84 0.00 0.00 35.03 31.87 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 1.33 -1.29 0.22 0.72 0.00 0.21 -4.33 105.19 102.04 1d1d n GLY 30 Ca 0.05 -1.09 -0.02 0.00 0.00 0.00 0.00 46.02 44.96 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 0.33 -1.29 0.99 4.07 -1.74 -1.81 115.31 115.86 1d1d h LEU 31 Ca 0.00 -0.12 0.00 0.00 0.08 0.00 0.00 57.88 57.84 1d1d h LEU 31 Cb 0.00 -0.09 0.00 0.00 1.08 0.00 0.00 40.66 41.65 1d1d h LEU 31 CO 0.00 0.64 0.00 0.54 -1.08 0.00 0.00 178.44 178.54 1d1d n ARG 32 N -4.09 1.86 -3.56 1.13 1.74 -1.26 -4.77 116.66 107.71 1d1d n ARG 32 Ca -0.01 -1.28 -0.26 0.00 -0.77 0.00 0.00 57.85 55.53 1d1d n ARG 32 Cb 0.43 -1.44 -0.03 0.00 -1.02 0.00 0.00 32.46 30.40 1d1d n ARG 32 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 1d1d s SER 33 N -1.74 6.37 -0.69 0.55 0.01 -0.68 -5.02 113.70 112.51 1d1d s SER 33 Ca 0.34 0.46 -0.27 0.00 1.31 0.00 0.00 55.95 57.80 1d1d s SER 33 Cb 0.19 -2.03 0.01 0.00 0.21 0.00 0.00 66.02 64.40 1d1d s SER 33 CO 0.30 -0.13 1.57 -2.16 0.41 0.00 0.00 173.24 173.22 1d1d s PRO 34 N -3.64 2.92 0.00 12.44 0.04 -1.26 -3.17 135.00 142.33 1d1d s PRO 34 Ca 0.40 0.14 0.00 0.00 0.04 0.00 0.00 61.00 61.58 1d1d s PRO 34 Cb -0.10 -4.31 0.00 0.00 0.04 0.00 0.00 34.50 30.12 1d1d s PRO 34 CO 0.31 -2.45 0.00 -0.89 0.04 0.00 0.00 177.00 174.01 1d1d n ILE 35 N 6.81 0.00 -0.01 0.56 2.08 -1.26 -4.99 119.36 122.54 1d1d n ILE 35 Ca 0.12 0.00 -0.12 0.00 0.56 0.00 0.00 62.75 63.32 1d1d n ILE 35 Cb 0.50 0.00 -0.06 0.00 -0.75 0.00 0.00 39.64 39.33 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 1.12 -0.58 1.39 2.02 -1.73 0.39 112.91 115.52 1d1d h THR 36 Ca 0.00 -0.36 0.01 0.00 0.77 0.00 0.00 66.41 66.83 1d1d h THR 36 Cb 0.00 1.20 -0.03 0.00 -1.74 0.00 0.00 68.15 67.58 1d1d h THR 36 CO 0.00 0.11 0.38 -0.03 0.37 0.00 0.00 175.52 176.34 1d1d h MET 37 N 0.01 0.74 -0.58 6.66 4.05 -1.87 0.54 114.93 124.47 1d1d h MET 37 Ca 0.03 -0.04 -0.09 0.00 -0.28 0.00 0.00 59.70 59.31 1d1d h MET 37 Cb 0.14 -0.17 -0.02 0.00 -0.80 0.00 0.00 31.60 30.75 1d1d h MET 37 CO -0.00 0.49 0.01 0.00 0.23 0.00 0.00 176.91 177.63 1d1d h ALA 38 N 1.23 0.79 -0.12 0.39 0.00 -1.91 0.24 119.26 119.88 1d1d h ALA 38 Ca 0.22 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1d1d h ALA 38 Cb -0.05 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.52 1d1d h ALA 38 CO -0.07 0.61 0.03 0.93 0.00 0.00 0.00 179.25 180.76 1d1d h GLU 39 N 0.92 0.19 -0.71 0.00 5.08 0.42 0.45 114.58 120.92 1d1d h GLU 39 Ca 0.17 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.45 1d1d h GLU 39 Cb 0.54 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.73 1d1d h GLU 39 CO 0.03 0.34 0.31 0.28 -1.00 0.00 0.00 179.01 178.97 1d1d h VAL 40 N -0.01 1.24 0.00 3.13 2.07 0.19 -1.45 116.25 121.43 1d1d h VAL 40 Ca 0.04 -0.73 -0.05 0.00 0.82 0.00 0.00 66.70 66.78 1d1d h VAL 40 Cb 0.24 0.39 -0.01 0.00 -1.52 0.00 0.00 31.29 30.39 1d1d h VAL 40 CO -0.00 0.30 -0.23 -0.08 0.02 0.00 0.00 177.57 177.57 1d1d h GLU 41 N 1.01 0.00 0.46 1.57 4.81 -0.30 0.10 114.58 122.23 1d1d h GLU 41 Ca 0.24 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.45 1d1d h GLU 41 Cb 0.17 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.55 1d1d h GLU 41 CO -0.02 0.23 -0.22 0.00 -0.73 0.00 0.00 179.01 178.27 1d1d h ALA 42 N 1.77 -0.62 -0.25 2.92 0.00 0.10 1.49 119.26 124.67 1d1d h ALA 42 Ca -0.00 -0.16 -0.17 0.00 0.00 0.00 0.00 54.91 54.58 1d1d h ALA 42 Cb 0.68 0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.70 1d1d h ALA 42 CO 0.03 -0.81 -0.53 1.37 0.00 0.00 0.00 179.25 179.31 1d1d h LEU 43 N -0.71 0.79 -0.08 0.00 -0.00 -1.41 -2.58 115.31 111.33 1d1d h LEU 43 Ca -0.06 -0.42 0.00 0.00 -0.00 0.00 0.00 57.88 57.40 1d1d h LEU 43 Cb 0.52 -0.23 0.00 0.00 -0.00 0.00 0.00 40.66 40.95 1d1d h LEU 43 CO 0.10 1.17 0.00 0.23 -0.00 0.00 0.00 178.44 179.94 1d1d n MET 44 N -3.99 0.05 -0.48 0.17 2.81 0.01 -3.66 117.12 112.03 1d1d n MET 44 Ca -0.03 0.18 0.38 0.00 -1.81 0.00 0.00 57.70 56.42 1d1d n MET 44 Cb 0.61 -1.57 0.61 0.00 -0.71 0.00 0.00 33.22 32.16 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 -1.65 0.09 -4.80 7.83 2.88 0.51 -4.24 113.62 114.23 1d1d n SER 45 Ca 0.05 0.99 -0.22 0.00 -1.33 0.00 0.00 58.87 58.36 1d1d n SER 45 Cb 0.26 -0.49 -0.05 0.00 -0.75 0.00 0.00 64.21 63.18 1d1d n SER 45 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1d1d s SER 46 N -4.12 4.93 0.49 -3.46 1.04 -1.24 -4.93 113.70 106.41 1d1d s SER 46 Ca -0.05 -0.71 -0.20 0.00 0.48 0.00 0.00 55.95 55.47 1d1d s SER 46 Cb 0.24 -0.75 -0.08 0.00 0.10 0.00 0.00 66.02 65.53 1d1d s SER 46 CO 0.70 -0.42 1.04 -2.16 0.98 0.00 0.00 173.24 173.38 1d1d s PRO 47 N -3.96 3.79 0.17 4.02 0.04 -1.26 -4.96 135.00 132.83 1d1d s PRO 47 Ca 0.41 1.35 -0.16 0.00 0.04 0.00 0.00 61.00 62.64 1d1d s PRO 47 Cb -0.03 -2.09 0.03 0.00 0.04 0.00 0.00 34.50 32.44 1d1d s PRO 47 CO 0.25 -0.44 0.45 -0.48 0.04 0.00 0.00 177.00 176.82 1d1d s LEU 48 N -3.53 0.30 0.90 -3.56 0.05 -1.26 -4.99 118.68 106.58 1d1d s LEU 48 Ca 0.67 -0.47 -0.11 0.00 0.05 0.00 0.00 54.13 54.26 1d1d s LEU 48 Cb -0.16 1.92 0.13 0.00 -2.05 0.00 0.00 46.19 46.03 1d1d s LEU 48 CO 0.21 -0.96 1.09 -0.76 -0.55 0.00 0.00 176.35 175.37 1d1d s LEU 49 N -2.86 2.36 0.22 1.48 1.43 -1.26 -4.64 118.68 115.40 1d1d s LEU 49 Ca 0.08 1.66 0.09 0.00 -1.03 0.00 0.00 54.13 54.93 1d1d s LEU 49 Cb 0.01 -4.08 0.16 0.00 0.03 0.00 0.00 46.19 42.30 1d1d s LEU 49 CO -0.06 -2.73 1.49 1.55 0.23 0.00 0.00 176.35 176.84 1d1d h PRO 50 N -1.61 0.01 -0.43 1.29 0.13 -1.87 -2.89 132.00 126.63 1d1d h PRO 50 Ca -0.48 -0.01 -0.10 0.00 -0.87 0.00 0.00 66.00 64.54 1d1d h PRO 50 Cb 1.28 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.40 1d1d h PRO 50 CO 0.52 0.76 -0.12 1.25 -0.23 0.00 0.00 178.00 180.18 1d1d h HIS 51 N 0.01 0.95 -0.15 1.56 2.76 -1.92 -2.51 115.15 115.83 1d1d h HIS 51 Ca -0.01 -0.21 -0.05 0.00 -2.20 0.00 0.00 60.37 57.91 1d1d h HIS 51 Cb 1.33 -0.23 -0.01 0.00 1.55 0.00 0.00 27.41 30.05 1d1d h HIS 51 CO 0.00 0.95 -0.11 -0.44 -1.30 0.00 0.00 177.93 177.04 1d1d h ASP 52 N 0.67 0.22 -0.58 3.26 3.32 -1.93 -1.53 116.42 119.85 1d1d h ASP 52 Ca 0.11 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.12 1d1d h ASP 52 Cb 0.65 -0.06 -0.03 0.00 0.22 0.00 0.00 39.33 40.12 1d1d h ASP 52 CO 0.04 0.36 0.38 0.58 -1.72 0.00 0.00 179.24 178.89 1d1d h VAL 53 N 0.23 1.16 -0.25 -1.35 2.07 -1.24 1.03 116.25 117.90 1d1d h VAL 53 Ca 0.05 -0.30 -0.05 0.00 0.82 0.00 0.00 66.70 67.22 1d1d h VAL 53 Cb 0.34 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 1d1d h VAL 53 CO 0.02 0.15 -0.03 0.71 0.02 0.00 0.00 177.57 178.45 1d1d h THR 54 N 0.79 1.27 -0.58 2.57 1.35 -1.13 0.58 112.91 117.77 1d1d h THR 54 Ca 0.21 -0.98 -0.04 0.00 -0.55 0.00 0.00 66.41 65.05 1d1d h THR 54 Cb -0.07 1.42 -0.03 0.00 -1.73 0.00 0.00 68.15 67.74 1d1d h THR 54 CO -0.04 0.31 0.21 -0.55 -0.25 0.00 0.00 175.52 175.19 1d1d h ASN 55 N 0.21 0.82 0.16 5.36 -1.07 -0.93 0.47 115.58 120.60 1d1d h ASN 55 Ca 0.07 -0.19 -0.01 0.00 0.07 0.00 0.00 56.30 56.24 1d1d h ASN 55 Cb 0.46 -0.21 0.00 0.00 -2.07 0.00 0.00 38.32 36.50 1d1d h ASN 55 CO 0.02 0.79 -0.08 0.25 0.07 0.00 0.00 177.43 178.48 1d1d h LEU 56 N 0.81 -0.18 -0.89 6.14 5.85 0.12 -2.62 115.31 124.54 1d1d h LEU 56 Ca 0.19 -0.22 0.05 0.00 0.84 0.00 0.00 57.88 58.74 1d1d h LEU 56 Cb 0.24 0.05 -0.06 0.00 0.37 0.00 0.00 40.66 41.26 1d1d h LEU 56 CO -0.01 0.13 0.56 0.24 -0.34 0.00 0.00 178.44 179.02 1d1d h MET 57 N -0.51 1.02 -0.74 1.25 2.86 0.31 -0.59 114.93 118.54 1d1d h MET 57 Ca -0.02 -0.06 0.11 0.00 -2.06 0.00 0.00 59.70 57.66 1d1d h MET 57 Cb 0.39 -0.23 -0.05 0.00 0.06 0.00 0.00 31.60 31.77 1d1d h MET 57 CO 0.04 0.68 0.49 -0.09 1.06 0.00 0.00 176.91 179.08 1d1d h ARG 58 N 1.05 0.58 -0.05 1.72 2.43 0.04 2.29 114.38 122.44 1d1d h ARG 58 Ca 0.38 -0.03 -0.18 0.00 -0.81 0.00 0.00 59.98 59.33 1d1d h ARG 58 Cb 0.11 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.53 1d1d h ARG 58 CO -0.15 0.38 -0.76 0.28 -1.51 0.00 0.00 179.97 178.21 1d1d h VAL 59 N 0.59 1.41 0.06 0.20 2.07 -0.76 -3.24 116.25 116.59 1d1d h VAL 59 Ca 0.35 -2.25 -0.17 0.00 0.82 0.00 0.00 66.70 65.44 1d1d h VAL 59 Cb 0.54 2.20 0.02 0.00 -1.52 0.00 0.00 31.29 32.53 1d1d h VAL 59 CO -0.12 0.67 -0.72 0.40 0.02 0.00 0.00 177.57 177.82 1d1d h ILE 60 N 0.22 1.45 -4.27 4.57 2.04 0.23 -3.45 117.51 118.30 1d1d h ILE 60 Ca -0.03 -2.28 -0.67 0.00 1.00 0.00 0.00 64.86 62.88 1d1d h ILE 60 Cb 1.34 2.84 -0.31 0.00 -0.74 0.00 0.00 36.82 39.96 1d1d h ILE 60 CO 0.13 0.66 -0.88 -1.48 0.00 0.00 0.00 178.15 176.57 1d1d s LEU 61 N -8.13 2.04 0.00 1.44 2.34 0.74 -4.86 118.68 112.26 1d1d s LEU 61 Ca -0.13 -0.46 0.00 0.00 0.06 0.00 0.00 54.13 53.59 1d1d s LEU 61 Cb 0.03 -1.28 0.00 0.00 -0.56 0.00 0.00 46.19 44.37 1d1d s LEU 61 CO 0.83 0.26 0.00 0.61 -1.06 0.00 0.00 176.35 177.00 1d1d n GLY 62 N 2.74 -3.29 0.17 -3.48 0.00 -1.25 -3.91 105.19 96.17 1d1d n GLY 62 Ca -0.17 -1.27 0.04 0.00 0.00 0.00 0.00 46.02 44.63 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 0.42 1.61 0.13 -1.98 -2.00 132.00 130.19 1d1d h PRO 63 Ca 0.00 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.11 1d1d h PRO 63 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1d1d h PRO 63 CO 0.00 0.43 -0.20 0.00 -0.23 0.00 0.00 178.00 177.99 1d1d h ALA 64 N 1.57 -0.57 0.00 -0.56 0.00 -2.00 -2.98 119.26 114.73 1d1d h ALA 64 Ca -0.00 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1d1d h ALA 64 Cb 1.08 0.22 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1d1d h ALA 64 CO 0.06 -0.60 0.00 -0.35 0.00 0.00 0.00 179.25 178.35 1d1d n PRO 65 N -5.18 0.75 -0.00 0.00 -0.04 -1.24 -3.35 135.00 125.94 1d1d n PRO 65 Ca -0.09 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.25 1d1d n PRO 65 Cb 0.28 -1.38 -0.10 0.00 -0.04 0.00 0.00 33.50 32.27 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 -0.07 0.00 0.54 3.20 -1.19 -2.39 116.97 117.06 1d1d h TYR 66 Ca 0.00 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.86 1d1d h TYR 66 Cb 0.00 0.02 -0.00 0.00 1.54 0.00 0.00 36.73 38.29 1d1d h TYR 66 CO 0.00 0.52 -0.04 0.00 -1.64 0.00 0.00 178.16 177.00 1d1d h ALA 67 N 0.08 1.83 -0.08 1.82 0.00 -1.60 1.02 119.26 122.31 1d1d h ALA 67 Ca -0.01 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1d1d h ALA 67 Cb 0.62 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 1d1d h ALA 67 CO 0.01 0.05 -0.01 -0.07 0.00 0.00 0.00 179.25 179.23 1d1d h LEU 68 N 0.00 0.15 -0.26 0.00 4.07 -1.68 0.54 115.31 118.14 1d1d h LEU 68 Ca -0.00 -0.35 -0.16 0.00 0.08 0.00 0.00 57.88 57.45 1d1d h LEU 68 Cb 0.08 -0.04 0.00 0.00 1.08 0.00 0.00 40.66 41.78 1d1d h LEU 68 CO 0.01 0.47 -0.47 -0.25 -1.08 0.00 0.00 178.44 177.12 1d1d h TRP 69 N -0.17 0.98 -0.38 1.13 7.01 -0.79 -1.45 115.95 122.29 1d1d h TRP 69 Ca 0.02 -0.34 0.01 0.00 2.11 0.00 0.00 58.89 60.69 1d1d h TRP 69 Cb 0.40 -0.19 -0.02 0.00 -2.10 0.00 0.00 29.16 27.25 1d1d h TRP 69 CO 0.05 1.15 0.24 0.52 -2.79 0.00 0.00 178.44 177.60 1d1d h MET 70 N 0.53 0.47 -0.26 2.65 2.86 0.11 1.51 114.93 122.81 1d1d h MET 70 Ca 0.02 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.62 1d1d h MET 70 Cb 1.07 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 32.61 1d1d h MET 70 CO 0.11 0.31 0.12 0.22 1.06 0.00 0.00 176.91 178.73 1d1d h ASP 71 N 0.49 0.34 -0.16 1.22 3.58 0.14 -1.43 116.42 120.59 1d1d h ASP 71 Ca 0.14 -0.13 -0.09 0.00 0.42 0.00 0.00 57.03 57.37 1d1d h ASP 71 Cb -0.03 -0.09 -0.02 0.00 1.72 0.00 0.00 39.33 40.91 1d1d h ASP 71 CO -0.05 0.38 -0.17 0.00 -2.88 0.00 0.00 179.24 176.52 1d1d h ALA 72 N 0.98 1.12 -0.77 -0.78 0.00 -0.89 -2.31 119.26 116.60 1d1d h ALA 72 Ca 0.09 -0.31 0.07 0.00 0.00 0.00 0.00 54.91 54.75 1d1d h ALA 72 Cb 0.13 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 17.72 1d1d h ALA 72 CO -0.01 0.55 0.45 2.35 0.00 0.00 0.00 179.25 182.59 1d1d h TRP 73 N 0.51 0.83 -0.88 0.00 7.01 0.27 0.51 115.95 124.19 1d1d h TRP 73 Ca 0.09 0.03 -0.02 0.00 2.11 0.00 0.00 58.89 61.09 1d1d h TRP 73 Cb 0.59 -0.26 -0.04 0.00 -2.10 0.00 0.00 29.16 27.35 1d1d h TRP 73 CO 0.02 0.40 0.46 0.78 -2.79 0.00 0.00 178.44 177.31 1d1d h GLY 74 N 0.81 1.33 0.70 2.65 0.00 -0.73 0.39 103.07 108.23 1d1d h GLY 74 Ca 0.35 -0.62 -0.03 0.00 0.00 0.00 0.00 47.33 47.02 1d1d h GLY 74 CO -0.19 0.60 -0.05 -2.08 0.00 0.00 0.00 176.54 174.82 1d1d h VAL 75 N 1.24 1.32 -0.45 4.60 2.07 -0.79 0.13 116.25 124.37 1d1d h VAL 75 Ca 0.31 -1.06 0.01 0.00 0.82 0.00 0.00 66.70 66.77 1d1d h VAL 75 Cb 0.06 1.81 -0.02 0.00 -1.52 0.00 0.00 31.29 31.61 1d1d h VAL 75 CO -0.05 0.30 0.29 1.56 0.02 0.00 0.00 177.57 179.70 1d1d h GLN 76 N -0.14 0.58 -0.47 1.57 1.08 0.21 0.67 115.11 118.62 1d1d h GLN 76 Ca 0.02 -0.04 -0.00 0.00 -1.45 0.00 0.00 58.65 57.19 1d1d h GLN 76 Cb 0.50 -0.13 -0.02 0.00 -0.05 0.00 0.00 27.48 27.77 1d1d h GLN 76 CO 0.01 0.39 0.28 -0.07 -0.95 0.00 0.00 178.83 178.49 1d1d h LEU 77 N 0.60 0.57 -1.35 1.46 3.38 -0.18 -1.83 115.31 117.96 1d1d h LEU 77 Ca 0.17 -0.06 0.01 0.00 0.09 0.00 0.00 57.88 58.08 1d1d h LEU 77 Cb -0.06 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.51 1d1d h LEU 77 CO -0.04 0.46 0.44 1.56 0.09 0.00 0.00 178.44 180.96 1d1d h GLN 78 N 0.63 0.88 -0.95 1.13 4.20 -0.43 -1.49 115.11 119.07 1d1d h GLN 78 Ca 0.17 -0.05 0.03 0.00 0.06 0.00 0.00 58.65 58.86 1d1d h GLN 78 Cb -0.00 -0.20 -0.06 0.00 0.30 0.00 0.00 27.48 27.53 1d1d h GLN 78 CO -0.03 0.58 0.62 1.15 -0.67 0.00 0.00 178.83 180.48 1d1d h THR 79 N 0.90 1.16 -0.44 -0.54 2.02 -0.04 0.48 112.91 116.45 1d1d h THR 79 Ca 0.25 -0.41 -0.09 0.00 0.77 0.00 0.00 66.41 66.92 1d1d h THR 79 Cb -0.10 -0.15 -0.02 0.00 -1.74 0.00 0.00 68.15 66.15 1d1d h THR 79 CO -0.05 0.22 -0.11 0.58 0.37 0.00 0.00 175.52 176.53 1d1d h VAL 80 N 1.20 1.26 -0.37 3.16 2.07 -0.89 0.37 116.25 123.05 1d1d h VAL 80 Ca 0.38 -1.17 -0.15 0.00 0.82 0.00 0.00 66.70 66.58 1d1d h VAL 80 Cb -0.00 1.03 -0.01 0.00 -1.52 0.00 0.00 31.29 30.79 1d1d h VAL 80 CO -0.12 0.40 -0.36 0.40 0.02 0.00 0.00 177.57 177.91 1d1d h ILE 81 N 0.72 1.28 -0.26 4.57 1.08 -0.59 -0.41 117.51 123.89 1d1d h ILE 81 Ca 0.12 -1.53 -0.15 0.00 -0.39 0.00 0.00 64.86 62.91 1d1d h ILE 81 Cb 0.59 1.37 -0.01 0.00 -3.07 0.00 0.00 36.82 35.71 1d1d h ILE 81 CO 0.04 0.51 -0.44 0.00 -0.69 0.00 0.00 178.15 177.57 1d1d h ALA 82 N 0.87 0.74 -0.05 1.87 0.00 0.27 0.32 119.26 123.29 1d1d h ALA 82 Ca 0.06 -0.46 -0.00 0.00 0.00 0.00 0.00 54.91 54.51 1d1d h ALA 82 Cb 0.93 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.62 1d1d h ALA 82 CO 0.09 0.66 0.01 0.00 0.00 0.00 0.00 179.25 180.01 1d1d h ALA 83 N 0.98 0.06 -0.18 0.00 0.00 -0.07 0.48 119.26 120.54 1d1d h ALA 83 Ca 0.04 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 1d1d h ALA 83 Cb 0.97 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 1d1d h ALA 83 CO 0.09 -0.33 0.03 0.00 0.00 0.00 0.00 179.25 179.04 1d1d h ALA 84 N 0.81 0.24 -0.95 0.00 0.00 -1.00 0.85 119.26 119.21 1d1d h ALA 84 Ca 0.01 -0.17 0.04 0.00 0.00 0.00 0.00 54.91 54.80 1d1d h ALA 84 Cb 0.22 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 17.89 1d1d h ALA 84 CO -0.00 -0.09 0.62 1.15 0.00 0.00 0.00 179.25 180.93 1d1d h THR 85 N 0.09 1.15 -0.03 0.00 2.02 -0.26 -2.36 112.91 113.53 1d1d h THR 85 Ca 0.06 -0.40 -0.18 0.00 0.77 0.00 0.00 66.41 66.65 1d1d h THR 85 Cb 0.31 -0.13 0.01 0.00 -1.74 0.00 0.00 68.15 66.60 1d1d h THR 85 CO 0.00 0.21 -0.70 -0.09 0.37 0.00 0.00 175.52 175.32 1d1d h ARG 86 N 1.18 0.53 -4.23 6.66 2.43 0.26 -3.43 114.38 117.78 1d1d h ARG 86 Ca 0.38 -0.53 -0.57 0.00 -0.81 0.00 0.00 59.98 58.46 1d1d h ARG 86 Cb 0.04 0.14 -0.38 0.00 -0.42 0.00 0.00 29.97 29.35 1d1d h ARG 86 CO -0.12 1.16 -0.79 -0.51 -1.51 0.00 0.00 179.97 178.19 1d1d s ASP 87 N -6.89 2.98 -0.60 -3.80 1.01 0.29 -5.02 116.67 104.65 1d1d s ASP 87 Ca -0.12 -0.73 -0.06 0.00 0.71 0.00 0.00 52.55 52.35 1d1d s ASP 87 Cb 0.05 -0.97 -0.14 0.00 1.01 0.00 0.00 42.92 42.87 1d1d s ASP 87 CO 0.85 -0.18 2.67 -0.81 0.21 0.00 0.00 175.17 177.91 1d1d n PRO 88 N 4.84 2.13 0.00 8.23 -0.04 -1.11 -3.43 135.00 145.62 1d1d n PRO 88 Ca -0.12 -1.25 0.00 0.00 -0.04 0.00 0.00 63.50 62.08 1d1d n PRO 88 Cb 0.47 -2.23 0.00 0.00 -0.04 0.00 0.00 33.50 31.70 1d1d n PRO 88 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1d1d n ARG 89 N 3.27 0.48 -2.84 0.54 3.00 -1.26 -4.90 116.66 114.95 1d1d n ARG 89 Ca 0.46 -0.63 -0.41 0.00 -0.01 0.00 0.00 57.85 57.26 1d1d n ARG 89 Cb 0.44 -0.76 -0.05 0.00 0.00 0.00 0.00 32.46 32.09 1d1d n ARG 89 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.63 176.62 1d1d s HIS 90 N -0.25 3.76 -0.15 -1.55 3.76 -1.22 -4.94 115.29 114.70 1d1d s HIS 90 Ca 0.00 1.64 0.28 0.00 -0.15 0.00 0.00 55.06 56.83 1d1d s HIS 90 Cb 0.00 -2.95 0.85 0.00 1.11 0.00 0.00 32.58 31.59 1d1d s HIS 90 CO 0.00 0.22 1.80 -1.00 -0.85 0.00 0.00 174.74 174.90 1d1d h PRO 91 N 5.73 0.00 0.00 8.40 0.13 -1.96 -2.89 132.00 141.40 1d1d h PRO 91 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 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 0.72 0.02 0.00 0.00 -0.23 0.00 0.00 178.00 178.51 1d1d h ALA 92 N 1.98 1.00 -2.38 -0.56 0.00 -1.92 -3.42 119.26 113.97 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 0.76 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.55 1d1d h ALA 92 CO 0.00 -0.00 -0.07 0.54 0.00 0.00 0.00 179.25 179.72 1d1d s ASN 93 N -4.28 6.43 0.00 0.00 2.20 -1.09 -4.45 114.94 113.74 1d1d s ASN 93 Ca -0.03 0.80 0.00 0.00 -0.94 0.00 0.00 52.86 52.69 1d1d s ASN 93 Cb 0.08 -2.18 0.00 0.00 -2.00 0.00 0.00 41.25 37.15 1d1d s ASN 93 CO 0.24 -0.28 0.79 0.61 -2.94 0.00 0.00 177.10 175.52 1d1d n GLY 94 N -1.21 -2.85 0.72 0.45 0.00 -1.26 -4.75 105.19 96.29 1d1d n GLY 94 Ca -0.01 0.18 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1d1d n GLY 94 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1d1d n GLN 95 N -1.57 0.00 0.00 1.61 10.64 -1.26 -5.01 117.38 121.79 1d1d n GLN 95 Ca 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.17 1d1d n GLN 95 Cb 0.00 -0.59 0.00 0.00 -0.86 0.00 0.00 30.24 28.79 1d1d n GLN 95 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1d1d n GLY 96 N 2.77 0.87 0.00 2.61 0.00 -1.26 -4.95 105.19 105.23 1d1d n GLY 96 Ca 0.00 0.27 0.14 0.00 0.00 0.00 0.00 46.02 46.43 1d1d n GLY 96 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1d1d n ARG 97 N 0.00 0.83 0.03 1.61 1.85 -1.26 -0.61 116.66 119.11 1d1d n ARG 97 Ca 0.00 0.00 -0.21 0.00 -1.00 0.00 0.00 57.85 56.64 1d1d n ARG 97 Cb 0.00 -1.50 -0.14 0.00 -1.05 0.00 0.00 32.46 29.77 1d1d n ARG 97 CO 0.00 0.00 0.00 0.78 -0.01 0.00 0.00 177.63 178.40 1d1d h GLY 98 N 4.25 0.34 0.00 2.89 0.00 -2.02 -3.42 103.07 105.11 1d1d h GLY 98 Ca 0.00 -0.86 -0.33 0.00 0.00 0.00 0.00 47.33 46.14 1d1d h GLY 98 CO 0.00 0.75 -2.06 -2.21 0.00 0.00 0.00 176.54 173.02 1d1d n GLU 99 N -3.93 0.46 -1.62 4.80 2.13 -1.18 -5.05 120.64 116.24 1d1d n GLU 99 Ca -0.22 0.20 0.00 0.00 0.66 0.00 0.00 57.16 57.80 1d1d n GLU 99 Cb 0.91 -1.27 0.00 0.00 0.27 0.00 0.00 31.44 31.35 1d1d n GLU 99 CO 0.00 0.00 0.00 -2.13 -0.41 0.00 0.00 177.13 174.59 1d1d n ARG 100 N -4.01 -4.62 -1.27 5.31 0.63 0.22 -4.83 116.66 108.11 1d1d n ARG 100 Ca -0.39 3.45 -0.29 0.00 -0.92 0.00 0.00 57.85 59.70 1d1d n ARG 100 Cb 0.76 -3.93 0.14 0.00 0.45 0.00 0.00 32.46 29.88 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 -3.68 2.51 -0.07 5.15 -1.32 -1.26 -4.44 115.64 112.54 1d1d s THR 101 Ca 0.00 0.17 -0.03 0.00 -1.21 0.00 0.00 61.69 60.61 1d1d s THR 101 Cb 0.00 -2.71 0.04 0.00 -1.51 0.00 0.00 72.50 68.32 1d1d s THR 101 CO 0.00 -0.22 0.16 0.20 -2.21 0.00 0.00 174.62 172.55 1d1d s ASN 102 N -3.54 -0.13 0.28 8.08 0.01 -1.26 -5.02 114.94 113.36 1d1d s ASN 102 Ca 0.64 0.32 0.00 0.00 -0.71 0.00 0.00 52.86 53.11 1d1d s ASN 102 Cb -0.17 0.23 0.51 0.00 0.41 0.00 0.00 41.25 42.22 1d1d s ASN 102 CO 0.56 -0.14 1.86 0.25 -1.51 0.00 0.00 177.10 178.12 1d1d h LEU 103 N 7.03 0.96 -0.47 0.60 5.85 -1.97 -0.00 115.31 127.31 1d1d h LEU 103 Ca -0.40 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.35 1d1d h LEU 103 Cb 1.15 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.99 1d1d h LEU 103 CO 0.42 0.55 0.30 -0.78 -0.34 0.00 0.00 178.44 178.59 1d1d h ASP 104 N 1.05 0.55 -0.42 1.25 3.58 -1.98 0.13 116.42 120.58 1d1d h ASP 104 Ca 0.47 -0.03 0.04 0.00 0.42 0.00 0.00 57.03 57.93 1d1d h ASP 104 Cb 0.38 -0.14 -0.04 0.00 1.72 0.00 0.00 39.33 41.25 1d1d h ASP 104 CO -0.23 0.41 0.20 0.03 -2.88 0.00 0.00 179.24 176.77 1d1d h ARG 105 N 0.63 0.39 0.00 0.28 2.47 -1.47 0.96 114.38 117.65 1d1d h ARG 105 Ca 0.17 -0.02 -0.01 0.00 -1.26 0.00 0.00 59.98 58.86 1d1d h ARG 105 Cb -0.05 -0.09 -0.00 0.00 -1.65 0.00 0.00 29.97 28.18 1d1d h ARG 105 CO -0.04 0.26 -0.03 -0.07 0.56 0.00 0.00 179.97 180.65 1d1d h LEU 106 N 0.40 0.00 -0.45 3.04 3.38 -0.72 -2.44 115.31 118.52 1d1d h LEU 106 Ca 0.18 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.10 1d1d h LEU 106 Cb 0.10 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 1d1d h LEU 106 CO -0.13 0.03 0.09 0.50 0.09 0.00 0.00 178.44 179.02 1d1d h LYS 107 N 0.00 0.74 0.00 1.13 1.63 0.18 -3.44 116.57 116.81 1d1d h LYS 107 Ca -0.00 -0.19 0.00 0.00 -0.85 0.00 0.00 60.65 59.61 1d1d h LYS 107 Cb 0.41 -0.09 0.00 0.00 -0.60 0.00 0.00 32.23 31.95 1d1d h LYS 107 CO 0.00 0.75 0.00 0.41 -3.45 0.00 0.00 179.45 177.16 1d1d n GLY 108 N -0.55 0.71 0.24 5.01 0.00 -0.92 -4.69 105.19 104.99 1d1d n GLY 108 Ca 0.00 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.09 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 0.72 -4.72 0.99 -0.00 -1.24 -3.48 117.00 109.26 1d1d n LEU 109 Ca 0.00 -0.32 -0.39 0.00 -0.00 0.00 0.00 56.01 55.29 1d1d n LEU 109 Cb 0.00 -0.06 0.03 0.00 -0.00 0.00 0.00 43.42 43.39 1d1d n LEU 109 CO 0.00 0.16 0.93 0.00 -0.00 0.00 0.00 177.39 178.48 1d1d n ALA 110 N -0.24 1.46 -1.74 1.96 0.00 -1.26 -4.71 120.51 115.98 1d1d n ALA 110 Ca 0.11 0.18 -0.42 0.00 0.00 0.00 0.00 53.44 53.31 1d1d n ALA 110 Cb 0.15 -2.32 -0.03 0.00 0.00 0.00 0.00 19.45 17.26 1d1d n ALA 110 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1d1d s ASP 111 N -0.75 6.43 0.00 0.00 -4.77 -1.26 -0.41 116.67 115.91 1d1d s ASP 111 Ca 0.67 2.77 0.00 0.00 -3.30 0.00 0.00 52.55 52.69 1d1d s ASP 111 Cb -0.45 -2.58 0.00 0.00 -1.09 0.00 0.00 42.92 38.80 1d1d s ASP 111 CO 0.53 -0.98 0.00 0.61 0.70 0.00 0.00 175.17 176.03 1d1d n GLY 112 N 4.13 1.55 0.01 2.12 0.00 -1.26 -4.81 105.19 106.93 1d1d n GLY 112 Ca 0.17 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.28 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 0.66 -2.92 1.61 2.81 0.45 -4.58 117.12 113.16 1d1d n MET 113 Ca 0.00 -0.13 -0.41 0.00 -1.81 0.00 0.00 57.70 55.34 1d1d n MET 113 Cb 0.00 -1.43 -0.04 0.00 -0.71 0.00 0.00 33.22 31.04 1d1d n MET 113 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 1d1d s VAL 114 N -3.18 4.88 0.00 2.03 1.01 -1.01 -3.19 120.40 120.94 1d1d s VAL 114 Ca -0.04 1.55 0.00 0.00 0.00 0.00 0.00 61.98 63.49 1d1d s VAL 114 Cb 0.12 -4.11 0.00 0.00 0.00 0.00 0.00 36.38 32.40 1d1d s VAL 114 CO 0.78 -0.01 0.00 0.61 0.00 0.00 0.00 175.10 176.47 1d1d n GLY 115 N 3.64 0.72 2.60 4.51 0.00 -1.26 -5.02 105.19 110.38 1d1d n GLY 115 Ca 0.04 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.77 3.13 -0.00 1.61 -0.87 -1.19 -5.04 114.94 109.81 1d1d s ASN 116 Ca 0.00 -1.05 -0.00 0.00 -1.57 0.00 0.00 52.86 50.23 1d1d s ASN 116 Cb 0.00 -0.38 -0.00 0.00 -0.02 0.00 0.00 41.25 40.84 1d1d s ASN 116 CO 0.00 -0.40 0.25 1.55 -2.57 0.00 0.00 177.10 175.94 1d1d h PRO 117 N 8.37 -0.01 -0.87 -0.60 0.13 -1.95 -1.13 132.00 135.93 1d1d h PRO 117 Ca -0.17 0.00 0.12 0.00 -0.87 0.00 0.00 66.00 65.08 1d1d h PRO 117 Cb 1.07 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.11 1d1d h PRO 117 CO 0.38 -0.01 0.49 0.37 -0.23 0.00 0.00 178.00 179.01 1d1d h GLN 118 N -0.03 0.73 -0.70 0.86 4.15 -1.96 -0.07 115.11 118.09 1d1d h GLN 118 Ca -0.00 -0.04 -0.05 0.00 0.77 0.00 0.00 58.65 59.33 1d1d h GLN 118 Cb 0.01 -0.17 -0.03 0.00 0.21 0.00 0.00 27.48 27.50 1d1d h GLN 118 CO 0.00 0.48 0.25 0.78 -1.93 0.00 0.00 178.83 178.42 1d1d h GLY 119 N 0.75 1.15 1.00 2.39 0.00 -1.95 -2.20 103.07 104.22 1d1d h GLY 119 Ca 0.45 -0.65 0.00 0.00 0.00 0.00 0.00 47.33 47.12 1d1d h GLY 119 CO -0.30 0.61 0.30 -1.61 0.00 0.00 0.00 176.54 175.55 1d1d h GLN 120 N 1.02 0.64 -0.13 4.80 -0.00 0.27 -0.62 115.11 121.08 1d1d h GLN 120 Ca 0.23 -0.05 -0.00 0.00 -0.00 0.00 0.00 58.65 58.83 1d1d h GLN 120 Cb 0.26 -0.14 -0.01 0.00 0.00 0.00 0.00 27.48 27.59 1d1d h GLN 120 CO -0.01 0.45 0.08 0.00 0.00 0.00 0.00 178.83 179.34 1d1d h ALA 121 N 1.15 1.89 0.00 3.38 0.00 -0.91 0.40 119.26 125.18 1d1d h ALA 121 Ca 0.17 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1d1d h ALA 121 Cb -0.04 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1d1d h ALA 121 CO -0.03 0.10 0.00 0.00 0.00 0.00 0.00 179.25 179.31 1d1d h ALA 122 N 1.91 1.00 0.00 0.00 0.00 -0.59 -2.75 119.26 118.82 1d1d h ALA 122 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1d1d h ALA 122 Cb -0.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1d1d h ALA 122 CO -0.01 0.00 -0.52 1.25 0.00 0.00 0.00 179.25 179.97 1d1d h LEU 123 N 0.00 0.00 -7.76 0.00 6.46 0.12 -3.43 115.31 110.69 1d1d h LEU 123 Ca 0.00 -0.09 -0.53 0.00 -0.12 0.00 0.00 57.88 57.14 1d1d h LEU 123 Cb 0.72 0.00 -0.36 0.00 -0.73 0.00 0.00 40.66 40.29 1d1d h LEU 123 CO 0.00 0.04 -0.81 -1.48 -0.62 0.00 0.00 178.44 175.58 1d1d s LEU 124 N -4.91 1.30 0.99 2.25 2.34 -0.73 -5.09 118.68 114.83 1d1d s LEU 124 Ca 0.05 -0.32 -0.16 0.00 0.06 0.00 0.00 54.13 53.76 1d1d s LEU 124 Cb 0.11 -0.88 -0.10 0.00 -0.56 0.00 0.00 46.19 44.76 1d1d s LEU 124 CO 0.71 -0.09 -0.49 -2.11 -1.06 0.00 0.00 176.35 173.31 1d1d n ARG 125 N 4.76 -0.08 -2.35 1.48 0.00 -1.26 -4.75 116.66 114.47 1d1d n ARG 125 Ca -0.14 -0.01 -0.43 0.00 -0.00 0.00 0.00 57.85 57.27 1d1d n ARG 125 Cb 0.50 -1.23 -0.02 0.00 -0.00 0.00 0.00 32.46 31.71 1d1d n ARG 125 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.63 176.38 1d1d s PRO 126 N -2.44 3.51 0.00 2.89 0.04 -1.26 -3.70 135.00 134.03 1d1d s PRO 126 Ca 0.44 0.86 0.00 0.00 0.04 0.00 0.00 61.00 62.35 1d1d s PRO 126 Cb -0.19 -4.05 0.00 0.00 0.04 0.00 0.00 34.50 30.30 1d1d s PRO 126 CO 0.79 -1.65 0.00 0.41 0.04 0.00 0.00 177.00 176.59 1d1d n GLY 127 N 5.13 1.56 0.34 0.56 0.00 -1.26 -4.96 105.19 106.56 1d1d n GLY 127 Ca 0.16 -0.08 0.12 0.00 0.00 0.00 0.00 46.02 46.22 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 0.29 -0.70 1.61 5.08 -1.85 0.18 114.58 119.17 1d1d h GLU 128 Ca 0.00 -0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.31 1d1d h GLU 128 Cb 0.00 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.15 1d1d h GLU 128 CO 0.00 0.19 0.33 -0.07 -1.00 0.00 0.00 179.01 178.46 1d1d h LEU 129 N 0.29 0.93 -1.03 1.33 3.38 -1.82 -1.82 115.31 116.57 1d1d h LEU 129 Ca 0.21 -0.14 0.02 0.00 0.09 0.00 0.00 57.88 58.06 1d1d h LEU 129 Cb 0.47 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 40.93 1d1d h LEU 129 CO -0.05 0.81 0.65 0.58 0.09 0.00 0.00 178.44 180.53 1d1d h VAL 130 N 0.99 1.22 -0.89 1.22 2.07 -1.25 0.19 116.25 119.79 1d1d h VAL 130 Ca 0.24 -0.45 -0.01 0.00 0.82 0.00 0.00 66.70 67.30 1d1d h VAL 130 Cb 0.14 -0.20 -0.04 0.00 -1.52 0.00 0.00 31.29 29.67 1d1d h VAL 130 CO -0.03 0.24 0.51 0.00 0.02 0.00 0.00 177.57 178.31 1d1d h ALA 131 N 1.40 1.22 -0.37 1.67 0.00 -0.98 0.58 119.26 122.78 1d1d h ALA 131 Ca 0.37 -0.12 -0.14 0.00 0.00 0.00 0.00 54.91 55.02 1d1d h ALA 131 Cb -0.10 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.32 1d1d h ALA 131 CO -0.09 0.65 -0.33 0.82 0.00 0.00 0.00 179.25 180.29 1d1d h ILE 132 N 1.24 1.28 -0.46 0.00 2.04 -0.40 0.15 117.51 121.36 1d1d h ILE 132 Ca 0.32 -1.49 -0.13 0.00 1.00 0.00 0.00 64.86 64.55 1d1d h ILE 132 Cb -0.01 1.34 -0.01 0.00 -0.74 0.00 0.00 36.82 37.40 1d1d h ILE 132 CO -0.05 0.50 -0.23 0.74 0.00 0.00 0.00 178.15 179.10 1d1d h THR 133 N 0.70 1.27 -0.34 -0.27 2.02 0.17 0.43 112.91 116.90 1d1d h THR 133 Ca 0.07 -1.39 -0.11 0.00 0.77 0.00 0.00 66.41 65.75 1d1d h THR 133 Cb 0.89 1.17 -0.01 0.00 -1.74 0.00 0.00 68.15 68.46 1d1d h THR 133 CO 0.08 0.48 -0.21 0.00 0.37 0.00 0.00 175.52 176.24 1d1d h ALA 134 N 0.85 0.48 -0.20 6.16 0.00 0.28 -1.48 119.26 125.35 1d1d h ALA 134 Ca 0.10 -0.37 -0.12 0.00 0.00 0.00 0.00 54.91 54.53 1d1d h ALA 134 Cb 0.81 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1d1d h ALA 134 CO 0.07 0.44 -0.38 0.66 0.00 0.00 0.00 179.25 180.04 1d1d h SER 135 N 0.52 0.47 -0.52 0.00 4.64 -0.58 -0.32 113.55 117.76 1d1d h SER 135 Ca 0.07 -0.20 -0.04 0.00 -0.47 0.00 0.00 61.79 61.16 1d1d h SER 135 Cb 0.76 -0.13 -0.02 0.00 -0.31 0.00 0.00 62.40 62.69 1d1d h SER 135 CO 0.06 0.81 0.18 0.00 -0.87 0.00 0.00 176.83 177.01 1d1d h ALA 136 N 1.22 0.68 -0.11 5.18 0.00 0.05 0.45 119.26 126.73 1d1d h ALA 136 Ca 0.04 -0.18 -0.12 0.00 0.00 0.00 0.00 54.91 54.65 1d1d h ALA 136 Cb 0.84 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1d1d h ALA 136 CO 0.07 0.32 -0.47 1.25 0.00 0.00 0.00 179.25 180.41 1d1d h LEU 137 N 0.71 0.31 -0.72 0.00 5.85 -1.06 -0.23 115.31 120.17 1d1d h LEU 137 Ca 0.17 -0.14 -0.13 0.00 0.84 0.00 0.00 57.88 58.62 1d1d h LEU 137 Cb 0.24 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.17 1d1d h LEU 137 CO -0.01 0.74 -0.62 1.56 -0.34 0.00 0.00 178.44 179.77 1d1d h GLN 138 N 0.23 0.00 0.07 1.25 4.20 -0.47 0.16 115.11 120.55 1d1d h GLN 138 Ca 0.01 0.00 -0.24 0.00 0.06 0.00 0.00 58.65 58.48 1d1d h GLN 138 Cb 0.93 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.70 1d1d h GLN 138 CO 0.08 0.62 -1.10 0.00 -0.67 0.00 0.00 178.83 177.76 1d1d h ALA 139 N 1.38 0.25 -0.09 3.87 0.00 0.25 -2.32 119.26 122.60 1d1d h ALA 139 Ca -0.01 -0.84 -0.22 0.00 0.00 0.00 0.00 54.91 53.84 1d1d h ALA 139 Cb 1.13 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.89 1d1d h ALA 139 CO 0.08 0.99 -0.82 0.35 0.00 0.00 0.00 179.25 179.85 1d1d h PHE 140 N 0.09 1.00 0.00 0.00 3.57 -0.90 -2.60 116.94 118.10 1d1d h PHE 140 Ca -0.09 -0.48 -0.06 0.00 3.53 0.00 0.00 57.97 60.87 1d1d h PHE 140 Cb 1.80 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 40.39 1d1d h PHE 140 CO 0.05 1.31 -0.26 0.07 -2.23 0.00 0.00 178.31 177.24 1d1d h ARG 141 N 0.41 0.00 -0.12 1.11 0.11 -1.03 -1.58 114.38 113.27 1d1d h ARG 141 Ca -0.08 0.00 -0.19 0.00 0.10 0.00 0.00 59.98 59.81 1d1d h ARG 141 Cb 1.47 0.00 0.01 0.00 1.11 0.00 0.00 29.97 32.56 1d1d h ARG 141 CO 0.17 0.26 -0.67 1.49 0.10 0.00 0.00 179.97 181.32 1d1d h GLU 142 N 0.00 0.67 -0.31 0.08 4.57 -1.35 0.22 114.58 118.47 1d1d h GLU 142 Ca -0.00 -0.56 -0.09 0.00 -1.18 0.00 0.00 59.36 57.52 1d1d h GLU 142 Cb 0.74 0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 29.44 1d1d h GLU 142 CO 0.03 1.17 -0.18 0.28 -1.18 0.00 0.00 179.01 179.14 1d1d h VAL 143 N 0.35 1.29 0.00 0.32 2.07 -1.28 -2.47 116.25 116.53 1d1d h VAL 143 Ca -0.05 -1.30 -0.02 0.00 0.82 0.00 0.00 66.70 66.15 1d1d h VAL 143 Cb 1.31 1.48 -0.00 0.00 -1.52 0.00 0.00 31.29 32.55 1d1d h VAL 143 CO 0.14 0.42 -0.10 0.00 0.02 0.00 0.00 177.57 178.05 1d1d h ALA 144 N 0.75 0.99 -0.41 1.67 0.00 -1.32 -2.97 119.26 117.97 1d1d h ALA 144 Ca 0.06 -0.09 -0.10 0.00 0.00 0.00 0.00 54.91 54.79 1d1d h ALA 144 Cb 0.71 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 1d1d h ALA 144 CO 0.05 0.12 -0.14 0.00 0.00 0.00 0.00 179.25 179.28 1d1d h ARG 145 N 0.00 0.82 -5.03 0.00 3.08 -0.14 -3.43 114.38 109.69 1d1d h ARG 145 Ca -0.00 -0.33 -0.48 0.00 0.07 0.00 0.00 59.98 59.24 1d1d h ARG 145 Cb 0.72 -0.04 -0.09 0.00 0.08 0.00 0.00 29.97 30.64 1d1d h ARG 145 CO 0.01 0.96 1.78 -0.11 -1.07 0.00 0.00 179.97 181.54 1d1d n LEU 146 N -4.28 0.17 -3.60 3.04 7.94 -0.97 -4.75 117.00 114.56 1d1d n LEU 146 Ca -0.01 0.04 -0.05 0.00 -1.11 0.00 0.00 56.01 54.87 1d1d n LEU 146 Cb 0.39 -0.91 -0.03 0.00 0.53 0.00 0.00 43.42 43.40 1d1d n LEU 146 CO 0.44 -0.87 0.98 0.00 -1.11 0.00 0.00 177.39 176.82 1d1d s ALA 147 N 8.02 -2.04 -0.14 1.96 0.00 -1.26 -5.07 121.76 123.23 1d1d s ALA 147 Ca 1.33 1.63 0.02 0.00 0.00 0.00 0.00 51.96 54.94 1d1d s ALA 147 Cb -1.14 -0.52 0.00 0.00 0.00 0.00 0.00 23.12 21.46 1d1d s ALA 147 CO 0.49 -0.46 -0.19 -1.21 0.00 0.00 0.00 175.76 174.38 1d1d s GLU 148 N -1.89 3.14 0.26 0.00 2.02 -1.26 -5.11 118.70 115.87 1d1d s GLU 148 Ca 0.07 -0.80 -0.30 0.00 0.02 0.00 0.00 54.97 53.96 1d1d s GLU 148 Cb -0.01 -2.50 -0.09 0.00 0.10 0.00 0.00 34.13 31.63 1d1d s GLU 148 CO -0.04 0.07 1.09 -1.25 0.02 0.00 0.00 175.26 175.14 1d1d s PRO 149 N 0.66 4.65 0.11 0.39 0.04 -1.26 -5.05 135.00 134.55 1d1d s PRO 149 Ca -0.09 1.76 0.03 0.00 0.04 0.00 0.00 61.00 62.74 1d1d s PRO 149 Cb -0.16 -3.21 -0.04 0.00 0.04 0.00 0.00 34.50 31.13 1d1d s PRO 149 CO 0.02 0.22 0.14 0.00 0.04 0.00 0.00 177.00 177.42 1d1d s ALA 150 N -1.00 3.68 0.24 8.56 0.00 -1.26 -5.11 121.76 126.87 1d1d s ALA 150 Ca 0.45 -1.04 -0.15 0.00 0.00 0.00 0.00 51.96 51.21 1d1d s ALA 150 Cb -0.31 -1.52 -0.08 0.00 0.00 0.00 0.00 23.12 21.21 1d1d s ALA 150 CO 0.39 0.67 0.66 0.20 0.00 0.00 0.00 175.76 177.68 1d1d s GLY 151 N -2.71 2.43 -0.04 0.00 0.00 -1.26 -5.01 107.32 100.74 1d1d s GLY 151 Ca 0.31 -0.02 -0.24 0.00 0.00 0.00 0.00 44.72 44.77 1d1d s GLY 151 CO 0.24 0.23 1.07 -0.56 0.00 0.00 0.00 173.10 174.09 1d1d h PRO 152 N 2.93 0.19 0.00 2.90 0.13 -1.99 -3.15 132.00 133.01 1d1d h PRO 152 Ca -0.48 -0.18 -0.34 0.00 -0.87 0.00 0.00 66.00 64.13 1d1d h PRO 152 Cb 1.18 0.05 -0.06 0.00 0.13 0.00 0.00 31.00 32.29 1d1d h PRO 152 CO 0.66 0.89 -2.28 -2.67 -0.23 0.00 0.00 178.00 174.37 1d1d n TRP 153 N -4.52 0.00 -0.10 1.56 2.14 -1.26 -4.16 117.44 111.10 1d1d n TRP 153 Ca -0.09 0.00 0.19 0.00 2.07 0.00 0.00 57.50 59.67 1d1d n TRP 153 Cb 0.48 -0.92 0.61 0.00 -0.81 0.00 0.00 31.31 30.67 1d1d n TRP 153 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 1d1d h ALA 154 N 0.86 2.36 0.00 -1.67 0.00 -1.97 1.06 119.26 119.89 1d1d h ALA 154 Ca -0.51 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.35 1d1d h ALA 154 Cb 2.12 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.91 1d1d h ALA 154 CO 0.02 -0.55 -0.20 0.22 0.00 0.00 0.00 179.25 178.74 1d1d h ASP 155 N 0.19 0.00 -3.08 0.00 1.82 -1.72 -3.43 116.42 110.19 1d1d h ASP 155 Ca 0.33 0.00 -0.58 0.00 -0.39 0.00 0.00 57.03 56.39 1d1d h ASP 155 Cb 1.01 0.00 -0.06 0.00 0.68 0.00 0.00 39.33 40.97 1d1d h ASP 155 CO -0.06 0.20 0.79 -0.63 -1.61 0.00 0.00 179.24 177.93 1d1d s ILE 156 N -3.16 4.66 -0.08 2.25 1.01 0.37 -5.02 121.20 121.23 1d1d s ILE 156 Ca 0.05 2.00 0.01 0.00 0.00 0.00 0.00 60.65 62.71 1d1d s ILE 156 Cb 0.06 -4.29 0.02 0.00 0.01 0.00 0.00 42.46 38.26 1d1d s ILE 156 CO 0.69 -0.16 -0.10 -0.89 0.00 0.00 0.00 174.94 174.48 1d1d s THR 157 N 3.11 1.07 0.13 2.92 2.01 -1.26 -4.94 115.64 118.68 1d1d s THR 157 Ca 0.45 -0.39 -0.31 0.00 0.31 0.00 0.00 61.69 61.74 1d1d s THR 157 Cb -0.16 -1.02 -0.09 0.00 0.01 0.00 0.00 72.50 71.24 1d1d s THR 157 CO 0.08 0.35 1.49 -1.58 -0.69 0.00 0.00 174.62 174.27 1d1d s GLN 158 N 1.05 4.26 0.31 4.92 -0.44 -1.26 -5.01 119.66 123.49 1d1d s GLN 158 Ca -0.07 2.23 0.08 0.00 -2.50 0.00 0.00 55.36 55.09 1d1d s GLN 158 Cb -0.15 -3.23 -0.06 0.00 -1.64 0.00 0.00 33.01 27.94 1d1d s GLN 158 CO -0.01 -0.54 -0.08 0.20 0.50 0.00 0.00 175.29 175.37 1d1d s GLY 159 N 1.21 1.99 0.40 2.59 0.00 -1.26 -3.89 107.32 108.35 1d1d s GLY 159 Ca 0.68 -1.98 0.22 0.00 0.00 0.00 0.00 44.72 43.63 1d1d s GLY 159 CO 0.31 -1.92 1.69 -0.56 0.00 0.00 0.00 173.10 172.62 1d1d h PRO 160 N 2.17 0.00 -0.01 2.90 0.13 -1.95 -2.99 132.00 132.25 1d1d h PRO 160 Ca -0.41 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.56 1d1d h PRO 160 Cb 1.24 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.35 1d1d h PRO 160 CO 0.68 0.27 -0.76 0.77 -0.23 0.00 0.00 178.00 178.74 1d1d h SER 161 N 0.00 0.09 -2.92 1.44 0.02 -2.01 -3.43 113.55 106.74 1d1d h SER 161 Ca -0.00 -0.07 -0.64 0.00 -0.84 0.00 0.00 61.79 60.24 1d1d h SER 161 Cb 0.96 -0.03 -0.09 0.00 0.14 0.00 0.00 62.40 63.38 1d1d h SER 161 CO 0.04 0.82 -0.47 -1.61 -1.14 0.00 0.00 176.83 174.46 1d1d s GLU 162 N -3.34 3.78 0.81 3.45 0.41 -1.13 -5.07 118.70 117.61 1d1d s GLU 162 Ca -0.02 -0.15 -0.14 0.00 -0.41 0.00 0.00 54.97 54.26 1d1d s GLU 162 Cb 0.11 -3.29 0.06 0.00 -1.78 0.00 0.00 34.13 29.23 1d1d s GLU 162 CO 0.79 0.57 0.98 0.43 -0.49 0.00 0.00 175.26 177.54 1d1d n SER 163 N 2.65 0.22 0.04 -0.19 7.64 -1.26 -4.48 113.62 118.24 1d1d n SER 163 Ca -0.18 0.55 -0.13 0.00 1.01 0.00 0.00 58.87 60.12 1d1d n SER 163 Cb 0.54 -1.42 -0.09 0.00 -1.01 0.00 0.00 64.21 62.23 1d1d n SER 163 CO 0.00 0.00 0.00 0.15 -3.01 0.00 0.00 175.04 172.18 1d1d h PHE 164 N -0.92 -0.13 -0.37 1.43 3.57 -1.96 -0.25 116.94 118.31 1d1d h PHE 164 Ca -0.46 -0.00 -0.06 0.00 3.53 0.00 0.00 57.97 60.98 1d1d h PHE 164 Cb 1.31 0.04 -0.01 0.00 2.79 0.00 0.00 35.95 40.07 1d1d h PHE 164 CO 0.43 0.29 -0.00 -0.24 -2.23 0.00 0.00 178.31 176.56 1d1d h VAL 165 N -0.59 1.26 -0.53 1.41 3.04 -1.97 0.23 116.25 119.10 1d1d h VAL 165 Ca -0.01 -1.00 0.06 0.00 -1.01 0.00 0.00 66.70 64.74 1d1d h VAL 165 Cb 0.48 1.17 -0.05 0.00 -2.01 0.00 0.00 31.29 30.87 1d1d h VAL 165 CO 0.02 0.33 0.24 -0.78 -1.01 0.00 0.00 177.57 176.38 1d1d h ASP 166 N 0.48 0.32 -0.34 3.17 3.58 -1.94 0.10 116.42 121.79 1d1d h ASP 166 Ca 0.11 0.04 -0.08 0.00 0.42 0.00 0.00 57.03 57.52 1d1d h ASP 166 Cb 0.47 -0.01 -0.01 0.00 1.72 0.00 0.00 39.33 41.50 1d1d h ASP 166 CO 0.02 0.22 -0.10 0.15 -2.88 0.00 0.00 179.24 176.64 1d1d h PHE 167 N 0.47 0.76 -0.68 0.28 3.57 -0.81 -2.61 116.94 117.92 1d1d h PHE 167 Ca 0.24 -0.17 0.12 0.00 3.53 0.00 0.00 57.97 61.69 1d1d h PHE 167 Cb 0.20 -0.18 -0.04 0.00 2.79 0.00 0.00 35.95 38.71 1d1d h PHE 167 CO -0.12 0.85 0.46 0.00 -2.23 0.00 0.00 178.31 177.26 1d1d h ALA 168 N 0.80 2.03 0.01 2.41 0.00 0.13 0.23 119.26 124.88 1d1d h ALA 168 Ca 0.08 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1d1d h ALA 168 Cb 0.62 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1d1d h ALA 168 CO 0.04 -0.19 -0.01 -0.91 0.00 0.00 0.00 179.25 178.18 1d1d h ASN 169 N 0.45 -0.01 -0.82 0.00 2.35 -0.68 0.42 115.58 117.28 1d1d h ASN 169 Ca 0.32 -0.31 0.01 0.00 -0.55 0.00 0.00 56.30 55.78 1d1d h ASN 169 Cb 0.66 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.99 1d1d h ASN 169 CO -0.10 0.30 0.55 0.03 -1.65 0.00 0.00 177.43 176.56 1d1d h ARG 170 N -0.33 1.07 -0.02 0.81 3.08 -0.79 0.38 114.38 118.57 1d1d h ARG 170 Ca -0.00 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 59.98 1d1d h ARG 170 Cb 0.32 -0.24 -0.00 0.00 0.08 0.00 0.00 29.97 30.13 1d1d h ARG 170 CO 0.00 0.71 -0.02 1.25 -1.07 0.00 0.00 179.97 180.84 1d1d h LEU 171 N 1.10 0.06 -0.97 3.04 6.46 -0.44 -1.25 115.31 123.31 1d1d h LEU 171 Ca 0.31 -0.46 0.06 0.00 -0.12 0.00 0.00 57.88 57.66 1d1d h LEU 171 Cb -0.10 -0.02 -0.06 0.00 -0.73 0.00 0.00 40.66 39.75 1d1d h LEU 171 CO -0.07 0.51 0.62 0.40 -0.62 0.00 0.00 178.44 179.28 1d1d h ILE 172 N -0.39 1.10 -0.56 4.05 2.04 0.30 0.30 117.51 124.36 1d1d h ILE 172 Ca 0.00 -0.40 -0.04 0.00 1.00 0.00 0.00 64.86 65.43 1d1d h ILE 172 Cb 0.49 -0.15 -0.03 0.00 -0.74 0.00 0.00 36.82 36.39 1d1d h ILE 172 CO 0.00 0.21 0.17 0.11 0.00 0.00 0.00 178.15 178.65 1d1d h LYS 173 N 1.15 0.83 0.18 2.37 1.57 -0.15 0.44 116.57 122.96 1d1d h LYS 173 Ca 0.41 -0.15 -0.01 0.00 -1.87 0.00 0.00 60.65 59.03 1d1d h LYS 173 Cb 0.12 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.30 1d1d h LYS 173 CO -0.16 0.72 -0.08 0.00 -0.57 0.00 0.00 179.45 179.36 1d1d h ALA 174 N 1.38 -0.24 -0.52 3.86 0.00 0.26 -0.14 119.26 123.86 1d1d h ALA 174 Ca 0.18 -0.20 0.05 0.00 0.00 0.00 0.00 54.91 54.94 1d1d h ALA 174 Cb 0.24 0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.08 1d1d h ALA 174 CO -0.01 -0.42 0.27 0.28 0.00 0.00 0.00 179.25 179.36 1d1d h VAL 175 N -0.65 0.95 -0.73 0.00 2.07 -0.29 0.03 116.25 117.64 1d1d h VAL 175 Ca -0.02 -0.18 0.03 0.00 0.82 0.00 0.00 66.70 67.35 1d1d h VAL 175 Cb 0.47 0.39 -0.05 0.00 -1.52 0.00 0.00 31.29 30.59 1d1d h VAL 175 CO 0.04 0.09 0.46 -0.33 0.02 0.00 0.00 177.57 177.85 1d1d h GLU 176 N 0.52 0.86 -0.86 1.57 5.08 -0.08 -0.12 114.58 121.54 1d1d h GLU 176 Ca 0.23 -0.05 -0.05 0.00 -1.00 0.00 0.00 59.36 58.49 1d1d h GLU 176 Cb 0.14 -0.19 -0.03 0.00 0.50 0.00 0.00 28.75 29.16 1d1d h GLU 176 CO -0.16 0.57 0.07 0.41 -1.00 0.00 0.00 179.01 178.90 1d1d n GLY 177 N -1.30 2.38 3.59 -3.84 0.00 -0.07 -4.86 105.19 101.09 1d1d n GLY 177 Ca 0.08 -0.43 -0.26 0.00 0.00 0.00 0.00 46.02 45.41 1d1d n GLY 177 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1d1d s SER 178 N -0.27 3.91 -0.85 1.61 1.04 -0.06 -4.98 113.70 114.10 1d1d s SER 178 Ca 0.25 -1.16 -0.15 0.00 0.48 0.00 0.00 55.95 55.37 1d1d s SER 178 Cb 0.19 -0.41 0.20 0.00 0.10 0.00 0.00 66.02 66.09 1d1d s SER 178 CO 0.07 -0.26 0.85 -0.62 0.98 0.00 0.00 173.24 174.25 1d1d s ASP 179 N -3.67 6.72 0.31 7.02 -1.08 -1.26 -4.97 116.67 119.75 1d1d s ASP 179 Ca 0.34 -2.51 0.10 0.00 -0.52 0.00 0.00 52.55 49.96 1d1d s ASP 179 Cb 0.03 -2.26 -0.06 0.00 -1.46 0.00 0.00 42.92 39.18 1d1d s ASP 179 CO 0.18 -0.70 -0.12 -0.76 0.52 0.00 0.00 175.17 174.29 1d1d s LEU 180 N 0.81 2.73 0.96 -1.34 1.43 -1.26 -5.15 118.68 116.86 1d1d s LEU 180 Ca 0.21 -1.08 -0.14 0.00 -1.03 0.00 0.00 54.13 52.09 1d1d s LEU 180 Cb -0.09 -1.12 0.17 0.00 0.03 0.00 0.00 46.19 45.18 1d1d s LEU 180 CO -0.09 -0.10 1.16 -2.16 0.23 0.00 0.00 176.35 175.39 1d1d s PRO 181 N -3.59 0.71 0.20 1.29 0.04 -1.26 -4.98 135.00 127.42 1d1d s PRO 181 Ca 0.32 0.13 -0.30 0.00 0.04 0.00 0.00 61.00 61.18 1d1d s PRO 181 Cb -0.01 -1.80 -0.08 0.00 0.04 0.00 0.00 34.50 32.64 1d1d s PRO 181 CO 0.16 -2.45 1.11 -1.25 0.04 0.00 0.00 177.00 174.61 1d1d s PRO 182 N -5.40 4.60 0.00 0.56 0.04 -1.26 -2.63 135.00 130.91 1d1d s PRO 182 Ca 0.66 1.75 0.00 0.00 0.04 0.00 0.00 61.00 63.46 1d1d s PRO 182 Cb -0.12 -3.25 0.00 0.00 0.04 0.00 0.00 34.50 31.16 1d1d s PRO 182 CO 0.54 0.09 0.00 0.45 0.04 0.00 0.00 177.00 178.12 1d1d n SER 183 N 2.10 -2.53 -0.00 6.66 2.88 -1.26 -4.83 113.62 116.64 1d1d n SER 183 Ca 0.02 0.00 0.11 0.00 -1.33 0.00 0.00 58.87 57.67 1d1d n SER 183 Cb 0.46 -0.79 -0.14 0.00 -0.75 0.00 0.00 64.21 62.99 1d1d n SER 183 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1d1d n ALA 184 N 1.00 3.67 -2.89 -1.46 0.00 -1.08 -4.63 120.51 115.12 1d1d n ALA 184 Ca 0.00 -0.55 -0.44 0.00 0.00 0.00 0.00 53.44 52.45 1d1d n ALA 184 Cb 0.05 -0.77 0.00 0.00 0.00 0.00 0.00 19.45 18.73 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 -1.92 3.36 0.00 0.00 1.74 -1.26 -3.22 116.66 115.36 1d1d n ARG 185 Ca -0.00 -3.79 0.00 0.00 -0.77 0.00 0.00 57.85 53.29 1d1d n ARG 185 Cb 0.46 -3.08 0.00 0.00 -1.02 0.00 0.00 32.46 28.82 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 5.81 0.00 0.14 7.54 0.00 -1.26 -4.90 120.51 127.84 1d1d n ALA 186 Ca 0.38 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.83 1d1d n ALA 186 Cb 0.43 0.00 0.15 0.00 0.00 0.00 0.00 19.45 20.03 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 -1.73 -2.00 132.00 128.10 1d1d h PRO 187 Ca 0.00 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.96 1d1d h PRO 187 Cb 0.00 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.13 1d1d h PRO 187 CO 0.00 0.57 -0.48 0.28 -0.23 0.00 0.00 178.00 178.14 1d1d h VAL 188 N 0.00 1.28 -0.09 1.56 2.07 -1.91 0.39 116.25 119.55 1d1d h VAL 188 Ca -0.01 -1.66 -0.02 0.00 0.82 0.00 0.00 66.70 65.83 1d1d h VAL 188 Cb 1.19 1.59 -0.00 0.00 -1.52 0.00 0.00 31.29 32.55 1d1d h VAL 188 CO 0.07 0.54 -0.03 0.40 0.02 0.00 0.00 177.57 178.58 1d1d h ILE 189 N 0.65 1.31 -0.39 4.57 2.04 -1.81 -1.96 117.51 121.92 1d1d h ILE 189 Ca 0.03 -1.01 -0.06 0.00 1.00 0.00 0.00 64.86 64.82 1d1d h ILE 189 Cb 1.09 1.80 -0.02 0.00 -0.74 0.00 0.00 36.82 38.95 1d1d h ILE 189 CO 0.11 0.28 -0.01 0.40 0.00 0.00 0.00 178.15 178.93 1d1d h ILE 190 N -0.18 1.22 -0.68 -0.67 2.04 -1.36 -2.28 117.51 115.61 1d1d h ILE 190 Ca 0.02 -0.90 0.03 0.00 1.00 0.00 0.00 64.86 65.01 1d1d h ILE 190 Cb 0.46 0.94 -0.04 0.00 -0.74 0.00 0.00 36.82 37.43 1d1d h ILE 190 CO 0.01 0.31 0.43 0.44 0.00 0.00 0.00 178.15 179.34 1d1d h ASP 191 N 0.60 0.71 -0.20 1.72 3.32 -0.03 -1.25 116.42 121.28 1d1d h ASP 191 Ca 0.12 -0.00 0.03 0.00 0.02 0.00 0.00 57.03 57.20 1d1d h ASP 191 Cb 0.39 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 39.76 1d1d h ASP 191 CO 0.02 0.49 -0.00 0.00 -1.72 0.00 0.00 179.24 178.02 1d1d h PHE 193 N 0.06 1.02 -0.53 0.00 0.04 -1.03 0.45 116.94 116.95 1d1d h PHE 193 Ca 0.09 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.90 1d1d h PHE 193 Cb 0.12 -0.31 0.00 0.00 2.20 0.00 0.00 35.95 37.96 1d1d h PHE 193 CO -0.18 0.32 0.00 2.89 -0.60 0.00 0.00 178.31 180.75 1d1d n ARG 194 N -4.73 3.43 -0.09 1.51 1.85 -0.51 -4.15 116.66 113.97 1d1d n ARG 194 Ca 0.19 -2.41 -0.23 0.00 -1.00 0.00 0.00 57.85 54.40 1d1d n ARG 194 Cb 0.43 -1.85 -0.12 0.00 -1.05 0.00 0.00 32.46 29.87 1d1d n ARG 194 CO 0.00 0.00 0.00 0.94 -0.01 0.00 0.00 177.63 178.56 1d1d n GLN 195 N 0.84 0.63 0.00 2.89 -0.06 0.22 -5.01 117.38 116.90 1d1d n GLN 195 Ca 0.22 0.35 0.00 0.00 -2.00 0.00 0.00 57.00 55.56 1d1d n GLN 195 Cb 0.81 -1.63 0.00 0.00 -4.06 0.00 0.00 30.24 25.36 1d1d n GLN 195 CO 0.00 0.00 0.00 1.63 -0.20 0.00 0.00 177.06 178.49 1d1d n LYS 196 N -3.97 0.00 0.00 3.69 5.02 -1.05 -5.07 118.16 116.79 1d1d n LYS 196 Ca -0.41 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 55.88 1d1d n LYS 196 Cb 0.87 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.88 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 0.00 0.00 -4.87 4.39 7.64 -1.25 -4.58 113.62 114.96 1d1d n SER 197 Ca 0.00 0.00 -0.31 0.00 1.01 0.00 0.00 58.87 59.57 1d1d n SER 197 Cb 0.00 0.00 -0.00 0.00 -1.01 0.00 0.00 64.21 63.20 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 3.67 0.10 1.43 -1.52 -1.26 -4.97 119.66 117.11 1d1d s GLN 198 Ca 0.00 0.76 -0.11 0.00 -1.95 0.00 0.00 55.36 54.06 1d1d s GLN 198 Cb 0.00 -2.11 -0.16 0.00 -0.22 0.00 0.00 33.01 30.52 1d1d s GLN 198 CO 0.00 -0.48 1.26 -1.00 -0.25 0.00 0.00 175.29 174.82 1d1d h PRO 199 N -0.02 0.66 -0.16 2.91 0.13 -1.98 -1.69 132.00 131.86 1d1d h PRO 199 Ca -0.45 -0.64 -0.07 0.00 -0.87 0.00 0.00 66.00 63.98 1d1d h PRO 199 Cb 1.19 0.17 -0.01 0.00 0.13 0.00 0.00 31.00 32.47 1d1d h PRO 199 CO 0.62 1.24 -0.20 -0.44 -0.23 0.00 0.00 178.00 178.99 1d1d h ASP 200 N 0.40 0.26 -0.08 1.44 3.32 -1.96 0.98 116.42 120.77 1d1d h ASP 200 Ca -0.09 -0.07 -0.10 0.00 0.02 0.00 0.00 57.03 56.79 1d1d h ASP 200 Cb 1.56 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 41.05 1d1d h ASP 200 CO 0.18 0.47 -0.35 0.40 -1.72 0.00 0.00 179.24 178.22 1d1d h ILE 201 N 0.24 1.41 -0.75 0.35 1.08 -1.94 -2.60 117.51 115.30 1d1d h ILE 201 Ca 0.04 -1.72 -0.03 0.00 -0.39 0.00 0.00 64.86 62.76 1d1d h ILE 201 Cb 0.50 2.26 -0.04 0.00 -3.07 0.00 0.00 36.82 36.48 1d1d h ILE 201 CO 0.03 0.50 0.36 1.56 -0.69 0.00 0.00 178.15 179.92 1d1d h GLN 202 N -0.07 1.07 -0.39 2.37 4.20 -0.98 -0.73 115.11 120.58 1d1d h GLN 202 Ca -0.02 -0.15 -0.04 0.00 0.06 0.00 0.00 58.65 58.50 1d1d h GLN 202 Cb 0.99 -0.20 -0.02 0.00 0.30 0.00 0.00 27.48 28.56 1d1d h GLN 202 CO 0.07 0.82 0.09 0.37 -0.67 0.00 0.00 178.83 179.51 1d1d h GLN 203 N 1.07 0.59 -0.02 1.46 5.75 -0.80 0.55 115.11 123.70 1d1d h GLN 203 Ca 0.26 -0.10 -0.01 0.00 -0.15 0.00 0.00 58.65 58.65 1d1d h GLN 203 Cb 0.10 -0.10 -0.00 0.00 1.07 0.00 0.00 27.48 28.56 1d1d h GLN 203 CO -0.03 0.55 -0.02 1.25 -2.65 0.00 0.00 178.83 177.92 1d1d h LEU 204 N 0.57 0.05 -1.02 -2.39 6.46 -0.92 -1.24 115.31 116.81 1d1d h LEU 204 Ca 0.13 -0.52 -0.03 0.00 -0.12 0.00 0.00 57.88 57.34 1d1d h LEU 204 Cb 0.24 -0.01 -0.03 0.00 -0.73 0.00 0.00 40.66 40.12 1d1d h LEU 204 CO -0.00 0.55 0.31 0.40 -0.62 0.00 0.00 178.44 179.08 1d1d h ILE 205 N -0.46 1.23 -0.30 4.05 2.04 -0.86 0.38 117.51 123.58 1d1d h ILE 205 Ca 0.00 -0.68 -0.05 0.00 1.00 0.00 0.00 64.86 65.13 1d1d h ILE 205 Cb 0.54 0.37 -0.02 0.00 -0.74 0.00 0.00 36.82 36.98 1d1d h ILE 205 CO 0.00 0.28 -0.04 -0.09 0.00 0.00 0.00 178.15 178.31 1d1d h ARG 206 N 0.99 0.47 -0.09 2.37 1.12 0.15 -0.28 114.38 119.11 1d1d h ARG 206 Ca 0.24 -0.10 0.00 0.00 -1.11 0.00 0.00 59.98 59.00 1d1d h ARG 206 Cb 0.14 -0.07 0.00 0.00 -0.01 0.00 0.00 29.97 30.04 1d1d h ARG 206 CO -0.03 0.52 0.00 0.00 -3.11 0.00 0.00 179.97 177.36 1d1d n ALA 207 N -2.48 2.55 -0.98 2.80 0.00 -0.47 -4.92 120.51 117.00 1d1d n ALA 207 Ca 0.01 -0.47 -0.32 0.00 0.00 0.00 0.00 53.44 52.65 1d1d n ALA 207 Cb 0.26 -1.14 0.13 0.00 0.00 0.00 0.00 19.45 18.70 1d1d n ALA 207 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1d1d s ALA 208 N -1.89 1.78 0.54 0.00 0.00 0.03 -4.98 121.76 117.24 1d1d s ALA 208 Ca 0.35 0.64 -0.18 0.00 0.00 0.00 0.00 51.96 52.77 1d1d s ALA 208 Cb 0.19 -3.43 -0.06 0.00 0.00 0.00 0.00 23.12 19.82 1d1d s ALA 208 CO 0.30 -2.35 1.04 -1.25 0.00 0.00 0.00 175.76 173.50 1d1d s PRO 209 N -4.46 3.56 -0.19 0.00 0.04 -1.26 -4.94 135.00 127.75 1d1d s PRO 209 Ca 0.68 1.25 0.05 0.00 0.04 0.00 0.00 61.00 63.02 1d1d s PRO 209 Cb -0.24 -2.07 0.44 0.00 0.04 0.00 0.00 34.50 32.67 1d1d s PRO 209 CO 0.54 -0.62 1.37 0.43 0.04 0.00 0.00 177.00 178.76 1d1d n SER 210 N -1.57 3.61 -0.42 6.66 7.64 -1.26 -3.61 113.62 124.67 1d1d n SER 210 Ca 0.09 -2.72 0.06 0.00 1.01 0.00 0.00 58.87 57.31 1d1d n SER 210 Cb 0.53 -0.65 0.03 0.00 -1.01 0.00 0.00 64.21 63.11 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 -0.01 0.00 -3.77 0.44 5.66 -1.26 -4.97 114.28 110.36 1d1d n THR 211 Ca 0.25 -0.45 -0.13 0.00 -3.05 0.00 0.00 64.05 60.67 1d1d n THR 211 Cb 0.98 1.22 -0.10 0.00 -1.55 0.00 0.00 70.33 70.88 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 -1.33 0.90 -0.40 1.09 0.05 -1.24 -5.07 118.68 112.69 1d1d s LEU 212 Ca 0.13 0.32 0.08 0.00 0.05 0.00 0.00 54.13 54.71 1d1d s LEU 212 Cb 0.10 1.12 0.37 0.00 -2.05 0.00 0.00 46.19 45.73 1d1d s LEU 212 CO 0.21 -0.28 1.33 0.35 -0.55 0.00 0.00 176.35 177.42 1d1d n THR 213 N 2.08 0.00 -4.39 5.48 -2.24 -1.26 -4.81 114.28 109.14 1d1d n THR 213 Ca -0.17 -1.45 -0.21 0.00 -2.27 0.00 0.00 64.05 59.94 1d1d n THR 213 Cb 0.57 1.00 -0.10 0.00 -2.10 0.00 0.00 70.33 69.70 1d1d n THR 213 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1d1d s THR 214 N 0.19 2.05 -0.53 4.28 -4.23 -1.26 -4.19 115.64 111.95 1d1d s THR 214 Ca 0.21 -2.22 -0.06 0.00 -1.18 0.00 0.00 61.69 58.44 1d1d s THR 214 Cb 0.38 -2.11 -0.14 0.00 1.34 0.00 0.00 72.50 71.97 1d1d s THR 214 CO -0.08 -0.45 2.69 -0.81 -0.54 0.00 0.00 174.62 175.42 1d1d n PRO 215 N -0.32 2.06 0.12 3.99 -0.04 -1.26 -2.71 135.00 136.85 1d1d n PRO 215 Ca -0.08 -1.20 0.00 0.00 -0.04 0.00 0.00 63.50 62.18 1d1d n PRO 215 Cb 0.59 -2.19 0.00 0.00 -0.04 0.00 0.00 33.50 31.86 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 3.09 -1.23 0.17 0.55 0.00 -1.26 -4.89 105.19 101.61 1d1d n GLY 216 Ca 0.44 0.21 -0.10 0.00 0.00 0.00 0.00 46.02 46.57 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 0.37 -0.62 1.61 3.07 -1.96 0.17 114.58 117.21 1d1d h GLU 217 Ca 0.00 -0.32 -0.06 0.00 -0.50 0.00 0.00 59.36 58.48 1d1d h GLU 217 Cb 0.00 0.07 -0.03 0.00 -0.84 0.00 0.00 28.75 27.96 1d1d h GLU 217 CO 0.00 0.98 0.17 0.82 -1.40 0.00 0.00 179.01 179.58 1d1d h ILE 218 N 0.24 1.25 0.01 3.13 5.03 -1.87 0.48 117.51 125.78 1d1d h ILE 218 Ca -0.04 -0.88 -0.00 0.00 -0.12 0.00 0.00 64.86 63.82 1d1d h ILE 218 Cb 1.36 0.64 0.00 0.00 -3.03 0.00 0.00 36.82 35.78 1d1d h ILE 218 CO 0.13 0.33 -0.00 0.40 -0.68 0.00 0.00 178.15 178.33 1d1d h ILE 219 N 0.90 1.55 -0.61 -0.67 2.04 -1.78 -1.34 117.51 117.60 1d1d h ILE 219 Ca 0.20 -1.70 0.11 0.00 1.00 0.00 0.00 64.86 64.47 1d1d h ILE 219 Cb 0.32 2.69 -0.04 0.00 -0.74 0.00 0.00 36.82 39.06 1d1d h ILE 219 CO -0.00 0.44 0.41 0.50 0.00 0.00 0.00 178.15 179.49 1d1d h LYS 220 N -0.74 0.37 -0.02 2.37 3.64 -0.59 0.41 116.57 122.01 1d1d h LYS 220 Ca -0.00 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.34 1d1d h LYS 220 Cb 0.72 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.46 1d1d h LYS 220 CO 0.00 0.25 -0.04 -0.92 -2.27 0.00 0.00 179.45 176.47 1d1d h TYR 221 N 0.38 0.07 -0.60 1.91 3.20 -0.01 0.09 116.97 122.02 1d1d h TYR 221 Ca 0.29 -0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.13 1d1d h TYR 221 Cb 0.61 -0.01 -0.03 0.00 1.54 0.00 0.00 36.73 38.83 1d1d h TYR 221 CO -0.00 0.63 0.38 0.28 -1.64 0.00 0.00 178.16 177.82 1d1d h VAL 222 N -0.52 1.16 -0.68 1.81 2.07 -0.29 0.20 116.25 120.00 1d1d h VAL 222 Ca -0.00 -0.32 -0.05 0.00 0.82 0.00 0.00 66.70 67.16 1d1d h VAL 222 Cb 0.63 0.30 -0.03 0.00 -1.52 0.00 0.00 31.29 30.68 1d1d h VAL 222 CO 0.01 0.16 0.24 -0.07 0.02 0.00 0.00 177.57 177.93 1d1d h LEU 223 N 0.81 0.97 -1.20 2.57 3.38 -0.25 0.43 115.31 122.02 1d1d h LEU 223 Ca 0.22 -0.19 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 1d1d h LEU 223 Cb -0.07 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.41 1d1d h LEU 223 CO -0.04 0.90 0.10 0.44 0.09 0.00 0.00 178.44 179.93 1d1d h ASP 224 N 0.99 0.61 0.04 -0.43 5.19 -0.21 -2.33 116.42 120.28 1d1d h ASP 224 Ca 0.22 -0.10 -0.24 0.00 -0.62 0.00 0.00 57.03 56.30 1d1d h ASP 224 Cb 0.26 -0.16 0.01 0.00 0.18 0.00 0.00 39.33 39.62 1d1d h ASP 224 CO -0.01 0.61 -0.92 -0.09 -3.12 0.00 0.00 179.24 175.71 1d1d h ARG 225 N 0.64 0.66 -0.40 3.56 9.65 0.14 -3.26 114.38 125.36 1d1d h ARG 225 Ca 0.15 -0.64 0.08 0.00 -1.10 0.00 0.00 59.98 58.47 1d1d h ARG 225 Cb 0.25 0.16 -0.07 0.00 -1.39 0.00 0.00 29.97 28.92 1d1d h ARG 225 CO -0.00 1.24 -0.07 1.96 2.80 0.00 0.00 179.97 185.90 1d1d h GLN 226 N 0.40 0.03 -4.57 0.20 4.20 0.35 -3.36 115.11 112.36 1d1d h GLN 226 Ca -0.09 -0.00 -0.64 0.00 0.06 0.00 0.00 58.65 57.98 1d1d h GLN 226 Cb 1.56 -0.01 -0.38 0.00 0.30 0.00 0.00 27.48 28.95 1d1d h GLN 226 CO 0.18 0.02 -0.78 0.21 -0.67 0.00 0.00 178.83 177.78 1d1d s LYS 227 N -6.21 1.83 0.03 1.46 2.47 -0.95 -4.94 119.74 113.43 1d1d s LYS 227 Ca -0.14 -1.24 0.19 0.00 -1.56 0.00 0.00 55.97 53.23 1d1d s LYS 227 Cb 0.14 -2.76 -0.18 0.00 -1.46 0.00 0.00 37.83 33.58 1d1d s LYS 227 CO 0.71 -0.64 0.66 0.44 0.16 0.00 0.00 175.35 176.69 1d1d n ILE 228 N 4.53 0.82 -1.48 5.43 -6.64 -1.25 -4.68 119.36 116.10 1d1d n ILE 228 Ca -0.11 -0.64 0.14 0.00 -1.77 0.00 0.00 62.75 60.37 1d1d n ILE 228 Cb 0.43 -0.44 -0.08 0.00 -1.44 0.00 0.00 39.64 38.11 1d1d n ILE 228 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 1d1d n ALA 229 N -2.38 -3.50 1.50 -1.28 0.00 -1.26 -5.13 120.51 108.46 1d1d n ALA 229 Ca -0.10 0.87 0.12 0.00 0.00 0.00 0.00 53.44 54.33 1d1d n ALA 229 Cb 0.77 -1.58 0.71 0.00 0.00 0.00 0.00 19.45 19.35 1d1d n ALA 229 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15