#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 1.06 -0.04 -0.99 -1.32 -1.26 -5.12 115.64 107.97 1d1d s THR 12 Ca 0.00 -0.74 -0.30 0.00 -1.21 0.00 0.00 61.69 59.44 1d1d s THR 12 Cb 0.00 -0.92 -0.04 0.00 -1.51 0.00 0.00 72.50 70.03 1d1d s THR 12 CO 0.00 0.17 1.22 -2.16 -2.21 0.00 0.00 174.62 171.64 1d1d s PRO 13 N -0.65 4.35 0.38 7.08 0.04 -1.26 -4.98 135.00 139.95 1d1d s PRO 13 Ca 0.04 1.70 -0.28 0.00 0.04 0.00 0.00 61.00 62.50 1d1d s PRO 13 Cb -0.06 -3.55 -0.10 0.00 0.04 0.00 0.00 34.50 30.83 1d1d s PRO 13 CO 0.00 -0.45 1.44 -1.17 0.04 0.00 0.00 177.00 176.86 1d1d s LEU 14 N 2.16 4.31 -0.13 -3.56 0.20 -1.26 -5.00 118.68 115.40 1d1d s LEU 14 Ca 0.57 2.95 -0.02 0.00 0.69 0.00 0.00 54.13 58.31 1d1d s LEU 14 Cb -0.25 -3.71 -0.03 0.00 -0.43 0.00 0.00 46.19 41.77 1d1d s LEU 14 CO 0.23 -0.84 -0.04 -0.70 -0.29 0.00 0.00 176.35 174.70 1d1d s GLU 15 N -2.09 3.41 0.00 1.98 2.56 -1.26 -5.01 118.70 118.29 1d1d s GLU 15 Ca 0.53 -0.52 -0.20 0.00 0.00 0.00 0.00 54.97 54.78 1d1d s GLU 15 Cb -0.44 -2.83 -0.22 0.00 2.00 0.00 0.00 34.13 32.64 1d1d s GLU 15 CO 0.60 0.38 1.13 -1.00 -0.56 0.00 0.00 175.26 175.80 1d1d h PRO 16 N 6.24 0.39 -0.77 4.30 0.13 -1.98 -2.13 132.00 138.18 1d1d h PRO 16 Ca -0.36 -0.38 0.06 0.00 -0.87 0.00 0.00 66.00 64.45 1d1d h PRO 16 Cb 1.19 0.10 -0.05 0.00 0.13 0.00 0.00 31.00 32.37 1d1d h PRO 16 CO 0.60 1.04 0.51 1.57 -0.23 0.00 0.00 178.00 181.48 1d1d h LYS 17 N -0.12 0.82 -0.32 0.86 2.10 -1.98 0.86 116.57 118.79 1d1d h LYS 17 Ca -0.05 -0.05 -0.16 0.00 -2.00 0.00 0.00 60.65 58.39 1d1d h LYS 17 Cb 1.18 -0.18 -0.01 0.00 -0.90 0.00 0.00 32.23 32.32 1d1d h LYS 17 CO 0.10 0.54 -0.44 -0.07 -2.00 0.00 0.00 179.45 177.58 1d1d h LEU 18 N 0.84 0.88 -0.58 7.07 3.38 -1.98 -1.73 115.31 123.20 1d1d h LEU 18 Ca 0.33 -0.42 -0.14 0.00 0.09 0.00 0.00 57.88 57.73 1d1d h LEU 18 Cb 0.21 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1d1d h LEU 18 CO -0.11 1.19 -0.41 0.40 0.09 0.00 0.00 178.44 179.60 1d1d h ILE 19 N 0.66 1.29 0.01 1.22 2.04 -0.35 -0.71 117.51 121.66 1d1d h ILE 19 Ca 0.04 -1.59 -0.00 0.00 1.00 0.00 0.00 64.86 64.31 1d1d h ILE 19 Cb 1.02 1.53 0.00 0.00 -0.74 0.00 0.00 36.82 38.62 1d1d h ILE 19 CO 0.10 0.51 -0.00 0.74 0.00 0.00 0.00 178.15 179.49 1d1d h THR 20 N 0.54 1.06 -0.57 -0.27 2.02 0.83 0.53 112.91 117.05 1d1d h THR 20 Ca 0.04 -0.20 -0.06 0.00 0.77 0.00 0.00 66.41 66.96 1d1d h THR 20 Cb 0.94 1.20 -0.03 0.00 -1.74 0.00 0.00 68.15 68.53 1d1d h THR 20 CO 0.09 0.05 0.10 0.08 0.37 0.00 0.00 175.52 176.21 1d1d h ARG 21 N -0.09 0.91 -0.38 6.66 0.11 -1.26 0.79 114.38 121.11 1d1d h ARG 21 Ca -0.00 -0.21 -0.06 0.00 0.10 0.00 0.00 59.98 59.80 1d1d h ARG 21 Cb 0.09 -0.12 -0.01 0.00 1.11 0.00 0.00 29.97 31.04 1d1d h ARG 21 CO 0.00 0.84 -0.01 -0.07 0.10 0.00 0.00 179.97 180.83 1d1d h LEU 22 N 0.87 0.67 -1.31 0.08 3.38 -0.81 -2.07 115.31 116.11 1d1d h LEU 22 Ca 0.18 -0.32 -0.06 0.00 0.09 0.00 0.00 57.88 57.77 1d1d h LEU 22 Cb 0.37 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1d1d h LEU 22 CO 0.01 0.82 -0.18 0.00 0.09 0.00 0.00 178.44 179.18 1d1d h ALA 23 N 0.87 1.43 -0.35 1.53 0.00 0.42 -2.38 119.26 120.77 1d1d h ALA 23 Ca 0.11 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1d1d h ALA 23 Cb 0.49 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 1d1d h ALA 23 CO 0.02 0.40 0.18 0.22 0.00 0.00 0.00 179.25 180.07 1d1d h ASP 24 N 0.23 0.45 -0.95 0.00 3.58 -0.39 -1.93 116.42 117.41 1d1d h ASP 24 Ca 0.04 -0.11 0.02 0.00 0.42 0.00 0.00 57.03 57.40 1d1d h ASP 24 Cb 0.46 -0.11 -0.05 0.00 1.72 0.00 0.00 39.33 41.34 1d1d h ASP 24 CO 0.03 0.43 0.63 0.74 -2.88 0.00 0.00 179.24 178.19 1d1d h THR 25 N 0.43 1.21 -0.96 2.25 2.02 -0.91 -0.26 112.91 116.69 1d1d h THR 25 Ca 0.12 -0.43 0.02 0.00 0.77 0.00 0.00 66.41 66.89 1d1d h THR 25 Cb 0.09 -0.15 -0.05 0.00 -1.74 0.00 0.00 68.15 66.31 1d1d h THR 25 CO -0.02 0.23 0.63 0.58 0.37 0.00 0.00 175.52 177.31 1d1d h VAL 26 N 1.25 1.20 -0.08 3.16 2.07 -0.97 1.26 116.25 124.15 1d1d h VAL 26 Ca 0.36 -0.43 -0.02 0.00 0.82 0.00 0.00 66.70 67.43 1d1d h VAL 26 Cb -0.09 -0.16 -0.00 0.00 -1.52 0.00 0.00 31.29 29.51 1d1d h VAL 26 CO -0.09 0.23 -0.01 -0.09 0.02 0.00 0.00 177.57 177.63 1d1d h ARG 27 N 1.26 0.16 -0.02 1.57 2.43 -0.50 0.53 114.38 119.80 1d1d h ARG 27 Ca 0.37 -0.06 -0.08 0.00 -0.81 0.00 0.00 59.98 59.40 1d1d h ARG 27 Cb -0.07 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.45 1d1d h ARG 27 CO -0.10 0.46 -0.36 1.79 -1.51 0.00 0.00 179.97 180.25 1d1d h THR 28 N -0.16 1.27 0.00 0.20 1.35 -0.61 -1.61 112.91 113.35 1d1d h THR 28 Ca 0.02 -1.28 0.00 0.00 -0.55 0.00 0.00 66.41 64.60 1d1d h THR 28 Cb 0.40 1.66 0.00 0.00 -1.73 0.00 0.00 68.15 68.48 1d1d h THR 28 CO 0.01 0.37 -0.32 0.29 -0.25 0.00 0.00 175.52 175.62 1d1d n LYS 29 N -4.10 0.19 -0.02 4.72 4.76 0.43 -5.01 118.16 119.13 1d1d n LYS 29 Ca -0.02 0.10 0.00 0.00 -2.87 0.00 0.00 58.31 55.52 1d1d n LYS 29 Cb 0.41 -1.66 0.00 0.00 -1.84 0.00 0.00 35.03 31.93 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 1.38 1.11 0.20 0.72 0.00 0.18 -4.45 105.19 104.33 1d1d n GLY 30 Ca 0.05 -1.28 0.01 0.00 0.00 0.00 0.00 46.02 44.81 1d1d n GLY 30 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1d1d h LEU 31 N 0.00 0.13 -1.01 0.99 7.12 -1.72 -1.16 115.31 119.66 1d1d h LEU 31 Ca 0.00 -0.04 0.00 0.00 0.13 0.00 0.00 57.88 57.97 1d1d h LEU 31 Cb 0.00 -0.03 0.00 0.00 -0.53 0.00 0.00 40.66 40.10 1d1d h LEU 31 CO 0.00 0.44 0.00 -1.14 -0.13 0.00 0.00 178.44 177.61 1d1d n ARG 32 N -4.13 1.68 -2.36 1.25 0.00 -1.26 -4.89 116.66 106.95 1d1d n ARG 32 Ca -0.01 -1.00 -0.27 0.00 -0.00 0.00 0.00 57.85 56.56 1d1d n ARG 32 Cb 0.38 -1.44 0.03 0.00 0.00 0.00 0.00 32.46 31.44 1d1d n ARG 32 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 1d1d s SER 33 N -1.79 5.60 0.00 6.15 1.04 -0.44 -5.02 113.70 119.25 1d1d s SER 33 Ca 0.35 0.75 -0.21 0.00 0.48 0.00 0.00 55.95 57.33 1d1d s SER 33 Cb 0.19 -1.74 -0.22 0.00 0.10 0.00 0.00 66.02 64.36 1d1d s SER 33 CO 0.30 -1.07 1.12 1.55 0.98 0.00 0.00 173.24 176.12 1d1d h PRO 34 N -0.20 0.37 -1.78 4.02 0.13 -1.87 -3.15 132.00 129.51 1d1d h PRO 34 Ca -0.45 -0.35 0.52 0.00 -0.87 0.00 0.00 66.00 64.84 1d1d h PRO 34 Cb 1.25 0.09 -0.07 0.00 0.13 0.00 0.00 31.00 32.40 1d1d h PRO 34 CO 0.61 1.02 1.32 0.82 -0.23 0.00 0.00 178.00 181.54 1d1d h ILE 35 N -0.16 0.07 -0.10 -3.56 1.08 -1.88 1.42 117.51 114.39 1d1d h ILE 35 Ca -0.05 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.42 1d1d h ILE 35 Cb 1.16 0.07 -0.00 0.00 -3.07 0.00 0.00 36.82 34.98 1d1d h ILE 35 CO 0.09 0.00 0.06 0.74 -0.69 0.00 0.00 178.15 178.36 1d1d h THR 36 N 0.00 1.04 -0.78 -0.27 2.02 -1.75 0.41 112.91 113.57 1d1d h THR 36 Ca 0.85 -0.09 -0.05 0.00 0.77 0.00 0.00 66.41 67.89 1d1d h THR 36 Cb 3.48 0.92 -0.03 0.00 -1.74 0.00 0.00 68.15 70.78 1d1d h THR 36 CO -0.01 0.04 0.31 -0.03 0.37 0.00 0.00 175.52 176.20 1d1d h MET 37 N 0.12 1.17 -0.32 6.66 4.05 0.18 0.24 114.93 127.02 1d1d h MET 37 Ca 0.04 -0.21 -0.05 0.00 -0.28 0.00 0.00 59.70 59.20 1d1d h MET 37 Cb 0.01 -0.19 -0.01 0.00 -0.80 0.00 0.00 31.60 30.60 1d1d h MET 37 CO -0.01 0.95 0.03 0.00 0.23 0.00 0.00 176.91 178.11 1d1d h ALA 38 N 1.19 0.43 -0.24 0.39 0.00 -1.07 0.33 119.26 120.30 1d1d h ALA 38 Ca 0.26 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1d1d h ALA 38 Cb 0.22 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1d1d h ALA 38 CO -0.02 0.16 0.09 0.93 0.00 0.00 0.00 179.25 180.41 1d1d h GLU 39 N 0.37 0.36 -0.22 0.00 5.08 0.14 0.15 114.58 120.45 1d1d h GLU 39 Ca 0.09 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 1d1d h GLU 39 Cb 0.40 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 1d1d h GLU 39 CO 0.01 0.40 0.12 0.28 -1.00 0.00 0.00 179.01 178.82 1d1d h VAL 40 N 0.23 1.12 0.00 3.13 2.07 -0.43 -1.33 116.25 121.03 1d1d h VAL 40 Ca 0.08 -0.32 -0.01 0.00 0.82 0.00 0.00 66.70 67.27 1d1d h VAL 40 Cb 0.18 0.93 -0.00 0.00 -1.52 0.00 0.00 31.29 30.87 1d1d h VAL 40 CO -0.01 0.11 -0.06 -0.33 0.02 0.00 0.00 177.57 177.30 1d1d h GLU 41 N 0.24 0.00 0.42 1.57 5.08 -0.17 0.66 114.58 122.39 1d1d h GLU 41 Ca 0.08 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.42 1d1d h GLU 41 Cb 0.08 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.33 1d1d h GLU 41 CO -0.01 0.06 -0.20 0.00 -1.00 0.00 0.00 179.01 177.86 1d1d h ALA 42 N 1.94 -0.56 -0.18 3.43 0.00 0.44 1.52 119.26 125.84 1d1d h ALA 42 Ca -0.00 -0.18 -0.16 0.00 0.00 0.00 0.00 54.91 54.57 1d1d h ALA 42 Cb 0.19 0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1d1d h ALA 42 CO 0.01 -0.69 -0.52 1.37 0.00 0.00 0.00 179.25 179.42 1d1d h LEU 43 N -0.82 0.77 -0.01 0.00 8.10 -1.05 -2.84 115.31 119.46 1d1d h LEU 43 Ca -0.06 -0.58 0.00 0.00 0.11 0.00 0.00 57.88 57.35 1d1d h LEU 43 Cb 0.55 -0.22 0.00 0.00 -0.44 0.00 0.00 40.66 40.54 1d1d h LEU 43 CO 0.09 1.22 0.00 0.23 -4.11 0.00 0.00 178.44 175.87 1d1d n MET 44 N -4.15 0.01 -0.35 0.17 2.81 0.23 -3.73 117.12 112.10 1d1d n MET 44 Ca -0.06 0.15 0.30 0.00 -1.81 0.00 0.00 57.70 56.27 1d1d n MET 44 Cb 0.60 -1.51 0.50 0.00 -0.71 0.00 0.00 33.22 32.10 1d1d n MET 44 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 1d1d n SER 45 N -1.52 0.15 -4.79 7.83 7.64 0.52 -4.22 113.62 119.23 1d1d n SER 45 Ca 0.05 1.00 -0.22 0.00 1.01 0.00 0.00 58.87 60.71 1d1d n SER 45 Cb 0.24 -0.49 -0.05 0.00 -1.01 0.00 0.00 64.21 62.90 1d1d n SER 45 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1d1d s SER 46 N -4.34 4.94 0.42 6.43 0.01 -1.24 -5.06 113.70 114.86 1d1d s SER 46 Ca -0.05 -0.68 -0.23 0.00 1.31 0.00 0.00 55.95 56.30 1d1d s SER 46 Cb 0.22 -0.79 -0.09 0.00 0.21 0.00 0.00 66.02 65.57 1d1d s SER 46 CO 0.60 -0.37 1.05 -2.16 0.41 0.00 0.00 173.24 172.77 1d1d s PRO 47 N -3.94 4.06 0.13 12.44 0.04 -1.26 -4.99 135.00 141.48 1d1d s PRO 47 Ca 0.40 1.48 0.03 0.00 0.04 0.00 0.00 61.00 62.95 1d1d s PRO 47 Cb -0.03 -2.42 -0.01 0.00 0.04 0.00 0.00 34.50 32.08 1d1d s PRO 47 CO 0.25 -0.23 0.11 1.47 0.04 0.00 0.00 177.00 178.64 1d1d n LEU 48 N -0.32 0.00 -4.92 -3.56 -0.00 -1.26 -5.01 117.00 101.93 1d1d n LEU 48 Ca 0.06 -1.21 -0.26 0.00 -0.00 0.00 0.00 56.01 54.60 1d1d n LEU 48 Cb 0.50 0.67 0.03 0.00 -0.00 0.00 0.00 43.42 44.62 1d1d n LEU 48 CO 0.44 -0.21 0.52 -0.76 -0.00 0.00 0.00 177.39 177.38 1d1d s LEU 49 N 0.00 3.23 0.17 1.47 2.01 -1.26 -4.78 118.68 119.52 1d1d s LEU 49 Ca 0.15 0.67 0.00 0.00 0.01 0.00 0.00 54.13 54.96 1d1d s LEU 49 Cb 0.01 -3.49 0.01 0.00 0.01 0.00 0.00 46.19 42.73 1d1d s LEU 49 CO 0.11 -1.08 1.39 1.55 1.01 0.00 0.00 176.35 179.33 1d1d h PRO 50 N -0.17 0.30 -0.32 1.29 0.13 -1.89 -2.40 132.00 128.94 1d1d h PRO 50 Ca -0.45 -0.29 -0.08 0.00 -0.87 0.00 0.00 66.00 64.31 1d1d h PRO 50 Cb 1.26 0.08 -0.01 0.00 0.13 0.00 0.00 31.00 32.46 1d1d h PRO 50 CO 0.60 0.98 -0.09 1.25 -0.23 0.00 0.00 178.00 180.51 1d1d h HIS 51 N 0.18 0.71 -0.18 1.56 2.76 -1.94 -2.59 115.15 115.65 1d1d h HIS 51 Ca -0.05 -0.16 -0.05 0.00 -2.20 0.00 0.00 60.37 57.92 1d1d h HIS 51 Cb 1.44 -0.17 -0.01 0.00 1.55 0.00 0.00 27.41 30.21 1d1d h HIS 51 CO 0.04 0.82 -0.11 0.22 -1.30 0.00 0.00 177.93 177.60 1d1d h ASP 52 N 0.41 0.27 -0.24 3.26 3.58 -1.96 -0.55 116.42 121.18 1d1d h ASP 52 Ca 0.08 -0.05 0.01 0.00 0.42 0.00 0.00 57.03 57.49 1d1d h ASP 52 Cb 0.60 -0.07 -0.02 0.00 1.72 0.00 0.00 39.33 41.56 1d1d h ASP 52 CO 0.04 0.41 0.14 0.58 -2.88 0.00 0.00 179.24 177.53 1d1d h VAL 53 N 0.27 1.02 -0.40 2.25 2.07 -1.08 0.67 116.25 121.06 1d1d h VAL 53 Ca 0.06 -0.10 -0.09 0.00 0.82 0.00 0.00 66.70 67.39 1d1d h VAL 53 Cb 0.36 0.71 -0.01 0.00 -1.52 0.00 0.00 31.29 30.83 1d1d h VAL 53 CO 0.02 0.05 -0.10 0.71 0.02 0.00 0.00 177.57 178.27 1d1d h THR 54 N 0.29 1.28 -0.70 2.57 1.35 -1.07 0.43 112.91 117.05 1d1d h THR 54 Ca 0.09 -1.19 -0.01 0.00 -0.55 0.00 0.00 66.41 64.76 1d1d h THR 54 Cb -0.00 1.22 -0.03 0.00 -1.73 0.00 0.00 68.15 67.60 1d1d h THR 54 CO -0.05 0.40 0.42 -1.13 -0.25 0.00 0.00 175.52 174.91 1d1d h ASN 55 N 0.59 0.85 0.01 5.36 -1.24 -0.72 0.42 115.58 120.84 1d1d h ASN 55 Ca 0.10 -0.07 -0.00 0.00 0.71 0.00 0.00 56.30 57.04 1d1d h ASN 55 Cb 0.62 -0.21 0.00 0.00 0.73 0.00 0.00 38.32 39.46 1d1d h ASN 55 CO 0.04 0.66 -0.00 0.25 -1.29 0.00 0.00 177.43 177.09 1d1d h LEU 56 N 0.96 -0.01 -1.91 0.34 5.85 0.53 -2.49 115.31 118.58 1d1d h LEU 56 Ca 0.25 -0.46 0.07 0.00 0.84 0.00 0.00 57.88 58.58 1d1d h LEU 56 Cb -0.02 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 40.99 1d1d h LEU 56 CO -0.05 0.46 0.21 0.24 -0.34 0.00 0.00 178.44 178.97 1d1d h MET 57 N -0.47 0.11 -0.29 1.25 2.86 0.11 0.17 114.93 118.67 1d1d h MET 57 Ca -0.00 -0.01 -0.14 0.00 -2.06 0.00 0.00 59.70 57.49 1d1d h MET 57 Cb 0.47 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.10 1d1d h MET 57 CO 0.00 0.07 -0.39 -0.09 1.06 0.00 0.00 176.91 177.56 1d1d h ARG 58 N 0.11 0.69 -0.11 1.72 2.43 -0.00 1.58 114.38 120.80 1d1d h ARG 58 Ca 0.14 -0.35 -0.04 0.00 -0.81 0.00 0.00 59.98 58.92 1d1d h ARG 58 Cb 0.42 0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 29.98 1d1d h ARG 58 CO -0.02 0.96 -0.09 0.28 -1.51 0.00 0.00 179.97 179.59 1d1d h VAL 59 N 0.57 1.35 -0.19 0.20 2.07 -0.57 -3.23 116.25 116.45 1d1d h VAL 59 Ca 0.05 -1.23 -0.13 0.00 0.82 0.00 0.00 66.70 66.21 1d1d h VAL 59 Cb 0.92 1.92 0.00 0.00 -1.52 0.00 0.00 31.29 32.62 1d1d h VAL 59 CO 0.08 0.35 -0.40 0.40 0.02 0.00 0.00 177.57 178.03 1d1d h ILE 60 N -0.14 1.33 -3.30 4.57 2.04 -1.08 -3.42 117.51 117.51 1d1d h ILE 60 Ca 0.02 -1.63 -0.66 0.00 1.00 0.00 0.00 64.86 63.58 1d1d h ILE 60 Cb 0.60 1.90 -0.29 0.00 -0.74 0.00 0.00 36.82 38.29 1d1d h ILE 60 CO 0.02 0.50 -0.77 -0.76 0.00 0.00 0.00 178.15 177.14 1d1d s LEU 61 N -8.78 2.63 0.00 1.44 1.02 0.54 -4.94 118.68 110.58 1d1d s LEU 61 Ca -0.13 -0.43 -0.06 0.00 0.02 0.00 0.00 54.13 53.54 1d1d s LEU 61 Cb 0.07 -1.62 0.09 0.00 0.02 0.00 0.00 46.19 44.76 1d1d s LEU 61 CO 0.83 0.07 0.21 0.61 0.02 0.00 0.00 176.35 178.09 1d1d n GLY 62 N 4.19 -2.99 0.24 -3.19 0.00 -1.23 -3.63 105.19 98.59 1d1d n GLY 62 Ca -0.19 -0.98 0.15 0.00 0.00 0.00 0.00 46.02 45.00 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 0.39 1.61 0.13 -1.95 -2.41 132.00 129.77 1d1d h PRO 63 Ca -0.10 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.01 1d1d h PRO 63 Cb 0.33 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.46 1d1d h PRO 63 CO 0.06 0.00 -0.19 0.00 -0.23 0.00 0.00 178.00 177.64 1d1d h ALA 64 N 2.04 -0.53 0.00 -0.56 0.00 -1.98 -3.13 119.26 115.10 1d1d h ALA 64 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1d1d h ALA 64 Cb 0.73 0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.72 1d1d h ALA 64 CO 0.00 -0.51 0.00 -0.35 0.00 0.00 0.00 179.25 178.39 1d1d n PRO 65 N -5.13 0.75 -0.04 0.00 -0.04 -1.23 -3.24 135.00 126.06 1d1d n PRO 65 Ca -0.07 0.00 -0.15 0.00 -0.04 0.00 0.00 63.50 63.24 1d1d n PRO 65 Cb 0.24 -1.26 -0.12 0.00 -0.04 0.00 0.00 33.50 32.31 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 0.12 -0.39 0.54 3.20 -1.37 -2.22 116.97 116.85 1d1d h TYR 66 Ca 0.00 -0.07 0.01 0.00 3.14 0.00 0.00 58.73 61.81 1d1d h TYR 66 Cb 0.00 -0.01 -0.02 0.00 1.54 0.00 0.00 36.73 38.24 1d1d h TYR 66 CO 0.00 0.95 0.26 0.00 -1.64 0.00 0.00 178.16 177.73 1d1d h ALA 67 N 0.14 1.74 -0.24 1.82 0.00 -1.61 1.38 119.26 122.48 1d1d h ALA 67 Ca -0.02 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.78 1d1d h ALA 67 Cb 1.00 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.63 1d1d h ALA 67 CO 0.03 0.24 -0.19 -0.07 0.00 0.00 0.00 179.25 179.26 1d1d h LEU 68 N 0.51 0.58 -0.62 0.00 4.07 -1.69 0.95 115.31 119.10 1d1d h LEU 68 Ca 0.14 -0.45 -0.15 0.00 0.08 0.00 0.00 57.88 57.51 1d1d h LEU 68 Cb -0.04 -0.16 -0.01 0.00 1.08 0.00 0.00 40.66 41.53 1d1d h LEU 68 CO -0.03 0.91 -0.49 -0.25 -1.08 0.00 0.00 178.44 177.49 1d1d h TRP 69 N 0.25 0.62 -0.62 1.13 7.01 -0.63 -0.33 115.95 123.38 1d1d h TRP 69 Ca 0.04 -0.20 -0.06 0.00 2.11 0.00 0.00 58.89 60.79 1d1d h TRP 69 Cb 0.72 -0.12 -0.03 0.00 -2.10 0.00 0.00 29.16 27.64 1d1d h TRP 69 CO 0.07 0.90 0.17 0.52 -2.79 0.00 0.00 178.44 177.31 1d1d h MET 70 N 0.40 0.97 -0.26 2.65 2.86 0.20 1.09 114.93 122.84 1d1d h MET 70 Ca 0.02 -0.22 -0.14 0.00 -2.06 0.00 0.00 59.70 57.30 1d1d h MET 70 Cb 1.01 -0.13 -0.00 0.00 0.06 0.00 0.00 31.60 32.53 1d1d h MET 70 CO 0.09 0.88 -0.37 0.22 1.06 0.00 0.00 176.91 178.78 1d1d h ASP 71 N 0.89 0.77 -0.39 1.22 1.82 -0.66 -0.53 116.42 119.54 1d1d h ASP 71 Ca 0.20 -0.51 -0.12 0.00 -0.39 0.00 0.00 57.03 56.20 1d1d h ASP 71 Cb 0.33 -0.22 -0.01 0.00 0.68 0.00 0.00 39.33 40.11 1d1d h ASP 71 CO -0.00 1.13 -0.22 0.00 -1.61 0.00 0.00 179.24 178.54 1d1d h ALA 72 N 0.66 0.78 -0.70 -0.78 0.00 -0.85 -2.09 119.26 116.28 1d1d h ALA 72 Ca 0.03 -0.38 -0.04 0.00 0.00 0.00 0.00 54.91 54.52 1d1d h ALA 72 Cb 0.96 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.56 1d1d h ALA 72 CO 0.09 0.66 0.30 2.35 0.00 0.00 0.00 179.25 182.64 1d1d h TRP 73 N 0.78 1.04 -0.53 0.00 7.01 0.13 0.27 115.95 124.65 1d1d h TRP 73 Ca 0.10 -0.07 0.03 0.00 2.11 0.00 0.00 58.89 61.07 1d1d h TRP 73 Cb 0.77 -0.32 -0.04 0.00 -2.10 0.00 0.00 29.16 27.47 1d1d h TRP 73 CO 0.05 0.80 0.31 0.78 -2.79 0.00 0.00 178.44 177.58 1d1d h GLY 74 N 0.99 0.76 0.74 2.65 0.00 -0.75 0.46 103.07 107.92 1d1d h GLY 74 Ca 0.24 -0.23 -0.04 0.00 0.00 0.00 0.00 47.33 47.30 1d1d h GLY 74 CO -0.02 0.18 -0.06 -2.08 0.00 0.00 0.00 176.54 174.56 1d1d h VAL 75 N 0.60 1.31 -0.55 4.60 2.07 -0.94 -1.24 116.25 122.10 1d1d h VAL 75 Ca 0.22 -1.07 0.06 0.00 0.82 0.00 0.00 66.70 66.73 1d1d h VAL 75 Cb 0.06 1.72 -0.05 0.00 -1.52 0.00 0.00 31.29 31.49 1d1d h VAL 75 CO -0.11 0.31 0.26 1.56 0.02 0.00 0.00 177.57 179.61 1d1d h GLN 76 N -0.03 0.48 -0.33 1.57 1.08 -0.09 0.40 115.11 118.20 1d1d h GLN 76 Ca 0.03 -0.03 -0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1d1d h GLN 76 Cb 0.52 -0.11 -0.02 0.00 -0.05 0.00 0.00 27.48 27.82 1d1d h GLN 76 CO 0.02 0.32 0.20 -0.07 -0.95 0.00 0.00 178.83 178.35 1d1d h LEU 77 N 0.50 0.39 -1.64 1.46 3.38 -0.00 -1.34 115.31 118.05 1d1d h LEU 77 Ca 0.26 -0.04 -0.03 0.00 0.09 0.00 0.00 57.88 58.15 1d1d h LEU 77 Cb 0.21 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 1d1d h LEU 77 CO -0.20 0.31 -0.12 1.56 0.09 0.00 0.00 178.44 180.08 1d1d h GLN 78 N 0.43 0.07 -0.41 1.13 4.20 -0.31 -1.74 115.11 118.48 1d1d h GLN 78 Ca 0.12 -0.01 -0.10 0.00 0.06 0.00 0.00 58.65 58.72 1d1d h GLN 78 Cb -0.01 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.74 1d1d h GLN 78 CO -0.02 0.20 -0.15 1.15 -0.67 0.00 0.00 178.83 179.34 1d1d h THR 79 N 0.07 1.26 -0.21 -0.54 2.02 0.82 0.37 112.91 116.70 1d1d h THR 79 Ca 0.02 -1.22 -0.02 0.00 0.77 0.00 0.00 66.41 65.96 1d1d h THR 79 Cb 0.26 1.10 -0.01 0.00 -1.74 0.00 0.00 68.15 67.76 1d1d h THR 79 CO 0.02 0.41 0.04 0.58 0.37 0.00 0.00 175.52 176.94 1d1d h VAL 80 N 0.68 1.21 -0.28 3.16 2.07 -0.42 0.53 116.25 123.20 1d1d h VAL 80 Ca 0.11 -0.70 -0.05 0.00 0.82 0.00 0.00 66.70 66.88 1d1d h VAL 80 Cb 0.63 1.28 -0.01 0.00 -1.52 0.00 0.00 31.29 31.67 1d1d h VAL 80 CO 0.04 0.22 -0.00 0.40 0.02 0.00 0.00 177.57 178.25 1d1d h ILE 81 N 0.15 1.26 -0.64 4.57 5.03 -1.28 -0.42 117.51 126.18 1d1d h ILE 81 Ca 0.06 -0.94 -0.01 0.00 -0.12 0.00 0.00 64.86 63.86 1d1d h ILE 81 Cb 0.29 1.31 -0.03 0.00 -3.03 0.00 0.00 36.82 35.36 1d1d h ILE 81 CO 0.00 0.30 0.35 0.00 -0.68 0.00 0.00 178.15 178.13 1d1d h ALA 82 N 0.83 1.43 -0.04 1.87 0.00 -0.13 0.41 119.26 123.62 1d1d h ALA 82 Ca 0.08 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1d1d h ALA 82 Cb 0.43 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 1d1d h ALA 82 CO 0.02 0.48 0.01 0.00 0.00 0.00 0.00 179.25 179.75 1d1d h ALA 83 N 1.51 0.05 -0.40 0.00 0.00 0.42 0.29 119.26 121.13 1d1d h ALA 83 Ca 0.23 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 1d1d h ALA 83 Cb 0.01 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1d1d h ALA 83 CO -0.04 -0.32 0.08 0.00 0.00 0.00 0.00 179.25 178.96 1d1d h ALA 84 N 0.78 1.39 -0.46 0.00 0.00 -0.53 0.44 119.26 120.87 1d1d h ALA 84 Ca 0.01 -0.17 -0.13 0.00 0.00 0.00 0.00 54.91 54.62 1d1d h ALA 84 Cb 0.24 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1d1d h ALA 84 CO 0.00 0.44 -0.21 1.15 0.00 0.00 0.00 179.25 180.63 1d1d h THR 85 N 0.58 1.27 -0.15 0.00 2.02 0.16 -3.12 112.91 113.67 1d1d h THR 85 Ca 0.13 -1.36 -0.13 0.00 0.77 0.00 0.00 66.41 65.81 1d1d h THR 85 Cb 0.26 1.17 0.00 0.00 -1.74 0.00 0.00 68.15 67.84 1d1d h THR 85 CO 0.00 0.47 -0.43 0.03 0.37 0.00 0.00 175.52 175.96 1d1d h ARG 86 N 0.80 0.56 -3.68 6.66 3.08 0.18 -3.43 114.38 118.54 1d1d h ARG 86 Ca 0.10 -0.40 -0.41 0.00 0.07 0.00 0.00 59.98 59.34 1d1d h ARG 86 Cb 0.78 0.06 -0.37 0.00 0.08 0.00 0.00 29.97 30.52 1d1d h ARG 86 CO 0.06 1.02 -0.76 -0.51 -1.07 0.00 0.00 179.97 178.71 1d1d s ASP 87 N -6.62 1.30 -0.57 7.04 1.11 0.15 -5.03 116.67 114.06 1d1d s ASP 87 Ca -0.13 -0.06 -0.06 0.00 0.18 0.00 0.00 52.55 52.49 1d1d s ASP 87 Cb 0.06 -0.37 -0.14 0.00 1.07 0.00 0.00 42.92 43.54 1d1d s ASP 87 CO 0.82 -0.18 2.67 -0.81 1.18 0.00 0.00 175.17 178.86 1d1d n PRO 88 N 4.92 2.09 0.00 8.23 -0.04 -1.19 -3.54 135.00 145.48 1d1d n PRO 88 Ca -0.11 -1.23 0.00 0.00 -0.04 0.00 0.00 63.50 62.13 1d1d n PRO 88 Cb 0.50 -2.21 0.00 0.00 -0.04 0.00 0.00 33.50 31.75 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 3.24 3.38 -2.37 0.54 5.12 -1.26 -5.02 116.66 120.28 1d1d n ARG 89 Ca 0.45 -0.21 -0.42 0.00 -1.93 0.00 0.00 57.85 55.74 1d1d n ARG 89 Cb 0.45 -0.70 -0.03 0.00 -1.16 0.00 0.00 32.46 31.01 1d1d n ARG 89 CO 0.00 0.00 0.00 -1.01 -1.93 0.00 0.00 177.63 174.69 1d1d s HIS 90 N -0.54 3.40 -0.11 -1.55 3.76 -1.23 -4.91 115.29 114.11 1d1d s HIS 90 Ca 0.00 1.25 0.26 0.00 -0.15 0.00 0.00 55.06 56.42 1d1d s HIS 90 Cb 0.00 -3.47 0.77 0.00 1.11 0.00 0.00 32.58 30.99 1d1d s HIS 90 CO 0.00 -1.47 1.76 -1.00 -0.85 0.00 0.00 174.74 173.18 1d1d h PRO 91 N 6.58 0.00 0.00 8.40 0.13 -1.95 -2.74 132.00 142.41 1d1d h PRO 91 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 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 0.81 0.11 0.00 0.00 -0.23 0.00 0.00 178.00 178.69 1d1d n ALA 92 N -2.14 1.44 -2.33 -0.56 0.00 -1.26 -4.63 120.51 111.04 1d1d n ALA 92 Ca 0.02 -0.02 -0.29 0.00 0.00 0.00 0.00 53.44 53.15 1d1d n ALA 92 Cb 0.46 -1.18 -0.03 0.00 0.00 0.00 0.00 19.45 18.70 1d1d n ALA 92 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1d1d s ASN 93 N -3.12 6.46 0.00 0.00 4.22 -1.04 -4.45 114.94 117.02 1d1d s ASN 93 Ca 0.04 0.94 0.00 0.00 -2.14 0.00 0.00 52.86 51.70 1d1d s ASN 93 Cb 0.07 -2.24 0.00 0.00 1.28 0.00 0.00 41.25 40.35 1d1d s ASN 93 CO 0.19 -0.34 0.00 0.61 -2.04 0.00 0.00 177.10 175.52 1d1d n GLY 94 N -1.27 -2.90 1.94 0.45 0.00 -1.26 -4.85 105.19 97.30 1d1d n GLY 94 Ca 0.00 -0.93 -0.01 0.00 0.00 0.00 0.00 46.02 45.08 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 0.27 0.00 1.61 7.27 -1.26 -4.69 117.38 120.58 1d1d n GLN 95 Ca 0.00 -0.36 0.00 0.00 0.07 0.00 0.00 57.00 56.71 1d1d n GLN 95 Cb 0.00 0.07 0.00 0.00 2.41 0.00 0.00 30.24 32.72 1d1d n GLN 95 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1d1d n GLY 96 N -0.36 2.41 0.45 1.69 0.00 -1.26 -4.89 105.19 103.22 1d1d n GLY 96 Ca -0.09 -0.12 0.14 0.00 0.00 0.00 0.00 46.02 45.95 1d1d n GLY 96 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1d1d n ARG 97 N 0.00 1.49 0.00 1.61 0.00 -1.26 -4.34 116.66 114.17 1d1d n ARG 97 Ca 0.00 -0.90 0.00 0.00 -0.00 0.00 0.00 57.85 56.95 1d1d n ARG 97 Cb 0.00 -1.48 0.00 0.00 0.00 0.00 0.00 32.46 30.98 1d1d n ARG 97 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1d1d n GLY 98 N 1.23 0.00 4.42 5.14 0.00 -1.26 -5.01 105.19 109.71 1d1d n GLY 98 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.67 -0.77 -4.30 1.61 0.28 -1.26 -4.89 120.64 108.63 1d1d n GLU 99 Ca 0.00 0.12 -0.25 0.00 -0.16 0.00 0.00 57.16 56.87 1d1d n GLU 99 Cb 0.36 -4.33 -0.17 0.00 1.43 0.00 0.00 31.44 28.73 1d1d n GLU 99 CO 0.00 0.00 0.00 1.03 -0.16 0.00 0.00 177.13 178.00 1d1d s ARG 100 N -7.14 1.61 0.90 3.44 0.52 -1.26 -4.07 118.95 112.95 1d1d s ARG 100 Ca 0.62 -0.34 -0.12 0.00 -0.52 0.00 0.00 55.73 55.36 1d1d s ARG 100 Cb -0.36 -1.46 0.13 0.00 0.52 0.00 0.00 34.95 33.78 1d1d s ARG 100 CO 1.00 -0.09 1.13 -0.08 0.02 0.00 0.00 175.30 177.28 1d1d s THR 101 N 1.08 2.10 -0.08 0.02 -1.32 -1.26 -4.45 115.64 111.72 1d1d s THR 101 Ca -0.07 0.03 -0.15 0.00 -1.21 0.00 0.00 61.69 60.30 1d1d s THR 101 Cb -0.14 -2.79 0.03 0.00 -1.51 0.00 0.00 72.50 68.09 1d1d s THR 101 CO -0.01 -0.04 0.36 0.20 -2.21 0.00 0.00 174.62 172.92 1d1d s ASN 102 N -4.03 -0.32 0.24 8.08 -0.87 -1.26 -4.96 114.94 111.81 1d1d s ASN 102 Ca 0.63 0.48 -0.07 0.00 -1.57 0.00 0.00 52.86 52.33 1d1d s ASN 102 Cb -0.15 0.57 0.23 0.00 -0.02 0.00 0.00 41.25 41.88 1d1d s ASN 102 CO 0.53 -0.28 1.91 0.25 -2.57 0.00 0.00 177.10 176.94 1d1d h LEU 103 N 4.75 1.06 -0.46 0.60 5.85 -1.98 0.76 115.31 125.89 1d1d h LEU 103 Ca -0.28 -0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.41 1d1d h LEU 103 Cb 1.18 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.92 1d1d h LEU 103 CO 0.33 0.77 0.28 -0.78 -0.34 0.00 0.00 178.44 178.70 1d1d h ASP 104 N 1.26 0.55 -0.78 1.25 1.82 -1.98 0.34 116.42 118.88 1d1d h ASP 104 Ca 0.34 -0.06 -0.02 0.00 -0.39 0.00 0.00 57.03 56.90 1d1d h ASP 104 Cb -0.14 -0.14 -0.04 0.00 0.68 0.00 0.00 39.33 39.69 1d1d h ASP 104 CO -0.07 0.45 0.40 0.03 -1.61 0.00 0.00 179.24 178.43 1d1d h ARG 105 N 0.61 1.10 0.00 0.28 -0.00 -1.76 0.47 114.38 115.09 1d1d h ARG 105 Ca 0.17 -0.15 0.00 0.00 -0.50 0.00 0.00 59.98 59.50 1d1d h ARG 105 Cb -0.01 -0.21 0.00 0.00 0.00 0.00 0.00 29.97 29.76 1d1d h ARG 105 CO -0.03 0.84 0.00 -0.07 0.00 0.00 0.00 179.97 180.70 1d1d h LEU 106 N 1.09 0.00 0.02 3.04 3.38 -0.31 -3.09 115.31 119.43 1d1d h LEU 106 Ca 0.27 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.24 1d1d h LEU 106 Cb 0.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.82 1d1d h LEU 106 CO -0.04 0.00 -0.01 0.11 0.09 0.00 0.00 178.44 178.59 1d1d h LYS 107 N 0.00 -0.02 0.00 1.13 1.57 0.13 -3.46 116.57 115.91 1d1d h LYS 107 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1d1d h LYS 107 Cb 0.60 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.91 1d1d h LYS 107 CO 0.00 0.74 0.00 0.41 -0.57 0.00 0.00 179.45 180.03 1d1d n GLY 108 N 1.26 1.89 0.78 3.86 0.00 -0.01 -4.87 105.19 108.10 1d1d n GLY 108 Ca -0.09 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.01 1d1d n GLY 108 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1d1d n LEU 109 N 0.00 2.86 -4.75 0.99 7.94 -1.16 -3.83 117.00 119.07 1d1d n LEU 109 Ca 0.00 -1.57 -0.35 0.00 -1.11 0.00 0.00 56.01 52.98 1d1d n LEU 109 Cb 0.00 -0.18 0.05 0.00 0.53 0.00 0.00 43.42 43.82 1d1d n LEU 109 CO 0.00 0.65 0.83 0.00 -1.11 0.00 0.00 177.39 177.75 1d1d s ALA 110 N -1.13 2.44 0.15 1.96 0.00 -1.26 -4.58 121.76 119.33 1d1d s ALA 110 Ca 0.26 0.95 -0.33 0.00 0.00 0.00 0.00 51.96 52.85 1d1d s ALA 110 Cb 0.15 -3.45 -0.13 0.00 0.00 0.00 0.00 23.12 19.69 1d1d s ALA 110 CO 0.21 -1.35 1.69 -0.25 0.00 0.00 0.00 175.76 176.05 1d1d n ASP 111 N -1.92 3.52 0.00 0.00 9.92 -1.26 -0.32 116.55 126.48 1d1d n ASP 111 Ca 0.13 1.05 0.00 0.00 -0.53 0.00 0.00 54.79 55.45 1d1d n ASP 111 Cb 0.50 -1.48 0.00 0.00 -0.64 0.00 0.00 41.12 39.50 1d1d n ASP 111 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1d1d n GLY 112 N 3.78 2.47 0.04 0.44 0.00 -1.26 -4.80 105.19 105.86 1d1d n GLY 112 Ca 0.17 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.22 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 0.78 -2.28 1.61 2.81 0.56 -4.67 117.12 113.93 1d1d n MET 113 Ca 0.00 -0.11 -0.42 0.00 -1.81 0.00 0.00 57.70 55.35 1d1d n MET 113 Cb 0.00 -1.45 -0.03 0.00 -0.71 0.00 0.00 33.22 31.03 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 -2.99 3.95 0.00 2.03 1.01 -0.93 -1.88 120.40 121.60 1d1d s VAL 114 Ca -0.08 1.23 0.00 0.00 0.00 0.00 0.00 61.98 63.14 1d1d s VAL 114 Cb 0.10 -3.79 0.00 0.00 0.00 0.00 0.00 36.38 32.68 1d1d s VAL 114 CO 0.77 -0.06 0.00 0.61 0.00 0.00 0.00 175.10 176.42 1d1d n GLY 115 N 3.70 0.75 2.60 4.51 0.00 -1.26 -5.01 105.19 110.49 1d1d n GLY 115 Ca 0.14 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.75 3.17 -0.01 1.61 -0.87 -0.79 -5.04 114.94 110.26 1d1d s ASN 116 Ca 0.00 -1.08 -0.02 0.00 -1.57 0.00 0.00 52.86 50.20 1d1d s ASN 116 Cb 0.00 -0.40 -0.01 0.00 -0.02 0.00 0.00 41.25 40.82 1d1d s ASN 116 CO 0.00 -0.40 0.27 1.55 -2.57 0.00 0.00 177.10 175.96 1d1d h PRO 117 N 8.36 -0.05 -0.36 -0.60 0.13 -1.95 -1.66 132.00 135.86 1d1d h PRO 117 Ca -0.17 0.00 0.07 0.00 -0.87 0.00 0.00 66.00 65.03 1d1d h PRO 117 Cb 1.06 0.01 -0.06 0.00 0.13 0.00 0.00 31.00 32.15 1d1d h PRO 117 CO 0.39 -0.04 -0.02 1.96 -0.23 0.00 0.00 178.00 180.07 1d1d h GLN 118 N -0.18 0.08 -0.63 0.86 7.50 -1.96 0.06 115.11 120.84 1d1d h GLN 118 Ca -0.01 -0.00 0.03 0.00 0.50 0.00 0.00 58.65 59.17 1d1d h GLN 118 Cb 0.04 -0.02 -0.03 0.00 0.05 0.00 0.00 27.48 27.52 1d1d h GLN 118 CO 0.01 0.05 0.41 0.78 -1.50 0.00 0.00 178.83 178.59 1d1d h GLY 119 N 0.08 0.84 0.93 3.46 0.00 -1.95 -0.04 103.07 106.39 1d1d h GLY 119 Ca 0.18 -0.29 -0.05 0.00 0.00 0.00 0.00 47.33 47.16 1d1d h GLY 119 CO -0.31 0.26 0.04 -1.61 0.00 0.00 0.00 176.54 174.91 1d1d h GLN 120 N 0.75 0.65 -0.14 4.80 -0.00 -0.06 -0.13 115.11 120.98 1d1d h GLN 120 Ca 0.25 -0.19 -0.06 0.00 -0.00 0.00 0.00 58.65 58.65 1d1d h GLN 120 Cb 0.07 -0.07 -0.01 0.00 0.00 0.00 0.00 27.48 27.47 1d1d h GLN 120 CO -0.07 0.73 -0.20 0.00 0.00 0.00 0.00 178.83 179.29 1d1d h ALA 121 N 0.90 1.40 0.00 3.38 0.00 -0.24 -0.19 119.26 124.50 1d1d h ALA 121 Ca 0.11 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1d1d h ALA 121 Cb 0.41 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1d1d h ALA 121 CO 0.01 0.42 0.00 0.00 0.00 0.00 0.00 179.25 179.68 1d1d h ALA 122 N 1.58 1.00 0.00 0.00 0.00 -0.60 -2.90 119.26 118.33 1d1d h ALA 122 Ca 0.04 0.00 -0.22 0.00 0.00 0.00 0.00 54.91 54.73 1d1d h ALA 122 Cb 0.49 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.24 1d1d h ALA 122 CO 0.03 0.00 -1.31 1.25 0.00 0.00 0.00 179.25 179.22 1d1d h LEU 123 N 0.00 0.00 -9.00 0.00 6.46 0.69 -3.44 115.31 110.02 1d1d h LEU 123 Ca 0.00 0.00 -0.61 0.00 -0.12 0.00 0.00 57.88 57.15 1d1d h LEU 123 Cb 0.69 0.00 -0.12 0.00 -0.73 0.00 0.00 40.66 40.49 1d1d h LEU 123 CO 0.00 0.82 -0.03 -0.76 -0.62 0.00 0.00 178.44 177.85 1d1d s LEU 124 N -6.20 4.07 0.85 2.25 1.43 -0.51 -5.04 118.68 115.53 1d1d s LEU 124 Ca -0.02 0.54 -0.16 0.00 -1.03 0.00 0.00 54.13 53.47 1d1d s LEU 124 Cb 0.09 -2.66 -0.07 0.00 0.03 0.00 0.00 46.19 43.57 1d1d s LEU 124 CO 0.81 -0.26 -0.06 -2.11 0.23 0.00 0.00 176.35 174.96 1d1d n ARG 125 N 5.37 0.00 -2.34 1.70 1.85 -1.26 -4.80 116.66 117.17 1d1d n ARG 125 Ca -0.04 0.03 -0.43 0.00 -1.00 0.00 0.00 57.85 56.40 1d1d n ARG 125 Cb 0.50 -1.43 -0.02 0.00 -1.05 0.00 0.00 32.46 30.46 1d1d n ARG 125 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 1d1d s PRO 126 N -2.46 3.49 0.00 2.89 0.04 -1.26 -3.46 135.00 134.24 1d1d s PRO 126 Ca 0.53 0.85 0.00 0.00 0.04 0.00 0.00 61.00 62.42 1d1d s PRO 126 Cb -0.28 -4.06 0.00 0.00 0.04 0.00 0.00 34.50 30.21 1d1d s PRO 126 CO 0.70 -1.67 0.00 0.41 0.04 0.00 0.00 177.00 176.48 1d1d n GLY 127 N 5.14 2.87 0.35 0.56 0.00 -1.26 -4.96 105.19 107.89 1d1d n GLY 127 Ca 0.16 -0.36 0.10 0.00 0.00 0.00 0.00 46.02 45.92 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 0.48 -0.62 1.61 5.08 -1.82 -0.30 114.58 119.02 1d1d h GLU 128 Ca 0.00 -0.03 0.03 0.00 -1.00 0.00 0.00 59.36 58.36 1d1d h GLU 128 Cb 0.00 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.10 1d1d h GLU 128 CO 0.00 0.32 0.38 -0.07 -1.00 0.00 0.00 179.01 178.64 1d1d h LEU 129 N 0.50 0.63 -1.03 1.33 3.38 -1.86 -1.12 115.31 117.14 1d1d h LEU 129 Ca 0.28 0.00 0.02 0.00 0.09 0.00 0.00 57.88 58.27 1d1d h LEU 129 Cb 0.45 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 41.01 1d1d h LEU 129 CO -0.08 0.44 0.66 0.58 0.09 0.00 0.00 178.44 180.12 1d1d h VAL 130 N 0.76 1.23 -0.83 1.22 2.07 -1.38 -0.37 116.25 118.95 1d1d h VAL 130 Ca 0.25 -0.45 0.09 0.00 0.82 0.00 0.00 66.70 67.40 1d1d h VAL 130 Cb 0.01 -0.21 -0.06 0.00 -1.52 0.00 0.00 31.29 29.52 1d1d h VAL 130 CO -0.10 0.24 0.54 0.00 0.02 0.00 0.00 177.57 178.27 1d1d h ALA 131 N 1.39 1.68 -0.34 1.67 0.00 -0.81 0.40 119.26 123.25 1d1d h ALA 131 Ca 0.37 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 55.15 1d1d h ALA 131 Cb -0.11 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 1d1d h ALA 131 CO -0.09 0.16 -0.26 0.82 0.00 0.00 0.00 179.25 179.88 1d1d h ILE 132 N 0.82 1.29 -0.12 0.00 2.04 -0.51 -0.77 117.51 120.26 1d1d h ILE 132 Ca 0.37 -1.42 -0.01 0.00 1.00 0.00 0.00 64.86 64.81 1d1d h ILE 132 Cb 0.37 1.45 -0.01 0.00 -0.74 0.00 0.00 36.82 37.89 1d1d h ILE 132 CO -0.15 0.46 0.05 0.74 0.00 0.00 0.00 178.15 179.26 1d1d h THR 133 N 0.55 1.13 -0.96 -0.27 2.02 -0.00 0.48 112.91 115.86 1d1d h THR 133 Ca 0.06 -0.39 0.01 0.00 0.77 0.00 0.00 66.41 66.87 1d1d h THR 133 Cb 0.83 1.17 -0.05 0.00 -1.74 0.00 0.00 68.15 68.36 1d1d h THR 133 CO 0.07 0.12 0.64 0.00 0.37 0.00 0.00 175.52 176.72 1d1d h ALA 134 N 0.91 1.23 -0.31 6.16 0.00 -0.27 0.16 119.26 127.14 1d1d h ALA 134 Ca 0.04 -0.06 -0.12 0.00 0.00 0.00 0.00 54.91 54.76 1d1d h ALA 134 Cb 0.14 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 1d1d h ALA 134 CO -0.00 0.60 -0.31 0.77 0.00 0.00 0.00 179.25 180.31 1d1d h SER 135 N 1.29 0.68 -0.46 0.00 0.02 -0.77 0.13 113.55 114.45 1d1d h SER 135 Ca 0.36 -0.27 -0.05 0.00 -0.84 0.00 0.00 61.79 60.98 1d1d h SER 135 Cb -0.13 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.20 1d1d h SER 135 CO -0.08 0.95 0.08 0.00 -1.14 0.00 0.00 176.83 176.64 1d1d h ALA 136 N 1.10 0.61 -0.15 3.77 0.00 0.10 0.31 119.26 125.01 1d1d h ALA 136 Ca 0.07 -0.22 -0.12 0.00 0.00 0.00 0.00 54.91 54.63 1d1d h ALA 136 Cb 0.81 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1d1d h ALA 136 CO 0.07 0.33 -0.45 -0.07 0.00 0.00 0.00 179.25 179.13 1d1d h LEU 137 N 0.63 0.38 -0.36 0.00 4.07 -0.54 -0.70 115.31 118.79 1d1d h LEU 137 Ca 0.14 -0.17 -0.13 0.00 0.08 0.00 0.00 57.88 57.80 1d1d h LEU 137 Cb 0.37 -0.11 -0.01 0.00 1.08 0.00 0.00 40.66 42.00 1d1d h LEU 137 CO 0.01 0.78 -0.27 1.56 -1.08 0.00 0.00 178.44 179.43 1d1d h GLN 138 N 0.29 0.83 -0.15 1.13 4.20 -0.30 -2.28 115.11 118.83 1d1d h GLN 138 Ca 0.02 -0.40 -0.11 0.00 0.06 0.00 0.00 58.65 58.22 1d1d h GLN 138 Cb 0.90 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.67 1d1d h GLN 138 CO 0.07 1.04 -0.38 0.00 -0.67 0.00 0.00 178.83 178.89 1d1d h ALA 139 N 0.77 1.09 0.44 3.87 0.00 -0.23 -2.43 119.26 122.76 1d1d h ALA 139 Ca 0.07 -0.40 -0.02 0.00 0.00 0.00 0.00 54.91 54.56 1d1d h ALA 139 Cb 0.84 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.54 1d1d h ALA 139 CO 0.07 0.58 -0.21 0.35 0.00 0.00 0.00 179.25 180.05 1d1d h PHE 140 N 0.27 -0.55 -0.36 0.00 3.04 -0.91 -2.11 116.94 116.32 1d1d h PHE 140 Ca 0.03 -0.01 0.10 0.00 3.98 0.00 0.00 57.97 62.07 1d1d h PHE 140 Cb 0.79 0.18 -0.01 0.00 2.56 0.00 0.00 35.95 39.47 1d1d h PHE 140 CO 0.02 -0.34 0.43 0.07 -2.02 0.00 0.00 178.31 176.47 1d1d h ARG 141 N -0.62 0.00 -0.19 1.11 0.11 -1.46 0.60 114.38 113.93 1d1d h ARG 141 Ca -0.06 0.00 -0.11 0.00 0.10 0.00 0.00 59.98 59.91 1d1d h ARG 141 Cb 0.45 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.52 1d1d h ARG 141 CO 0.10 0.00 -0.36 1.49 0.10 0.00 0.00 179.97 181.30 1d1d h GLU 142 N 0.00 0.41 0.04 0.08 4.57 -1.04 0.40 114.58 119.03 1d1d h GLU 142 Ca 0.17 -0.18 -0.22 0.00 -1.18 0.00 0.00 59.36 57.94 1d1d h GLU 142 Cb 1.03 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 29.60 1d1d h GLU 142 CO -0.00 0.71 -1.01 0.28 -1.18 0.00 0.00 179.01 177.81 1d1d h VAL 143 N 0.35 1.54 -0.08 0.32 2.07 0.85 0.20 116.25 121.49 1d1d h VAL 143 Ca 0.04 -2.90 -0.09 0.00 0.82 0.00 0.00 66.70 64.57 1d1d h VAL 143 Cb 0.79 2.68 0.00 0.00 -1.52 0.00 0.00 31.29 33.25 1d1d h VAL 143 CO 0.06 0.84 -0.29 0.00 0.02 0.00 0.00 177.57 178.21 1d1d h ALA 144 N 0.85 0.14 -0.06 1.67 0.00 -1.04 -3.22 119.26 117.60 1d1d h ALA 144 Ca -0.07 -0.42 -0.15 0.00 0.00 0.00 0.00 54.91 54.27 1d1d h ALA 144 Cb 1.70 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.47 1d1d h ALA 144 CO 0.16 0.17 -0.64 -0.09 0.00 0.00 0.00 179.25 178.84 1d1d h ARG 145 N -0.15 0.24 -0.41 0.00 9.65 -0.27 -3.30 114.38 120.13 1d1d h ARG 145 Ca -0.01 -0.17 0.04 0.00 -1.10 0.00 0.00 59.98 58.73 1d1d h ARG 145 Cb 0.92 0.03 -0.05 0.00 -1.39 0.00 0.00 29.97 29.48 1d1d h ARG 145 CO 0.06 0.80 -0.25 1.25 2.80 0.00 0.00 179.97 184.63 1d1d h LEU 146 N 0.17 -0.92 0.00 3.80 5.85 -0.60 -3.46 115.31 120.15 1d1d h LEU 146 Ca -0.01 0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.85 1d1d h LEU 146 Cb 1.16 0.41 0.00 0.00 0.37 0.00 0.00 40.66 42.60 1d1d h LEU 146 CO 0.10 -0.10 0.00 0.00 -0.34 0.00 0.00 178.44 178.10 1d1d n ALA 147 N -3.09 0.00 -2.55 1.25 0.00 -1.24 -5.09 120.51 109.79 1d1d n ALA 147 Ca 0.01 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.19 1d1d n ALA 147 Cb 0.11 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.47 1d1d n ALA 147 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 1d1d s GLU 148 N -2.00 1.98 -1.12 0.00 1.03 -1.26 -4.79 118.70 112.55 1d1d s GLU 148 Ca 0.00 -1.41 -0.07 0.00 0.03 0.00 0.00 54.97 53.52 1d1d s GLU 148 Cb 0.00 -2.06 -0.08 0.00 -0.80 0.00 0.00 34.13 31.19 1d1d s GLU 148 CO 0.00 0.40 2.51 -0.35 -1.33 0.00 0.00 175.26 176.49 1d1d n PRO 149 N -0.23 2.67 -4.02 -4.83 -0.04 -1.26 -4.86 135.00 122.42 1d1d n PRO 149 Ca -0.09 -1.69 -0.29 0.00 -0.04 0.00 0.00 63.50 61.39 1d1d n PRO 149 Cb 0.57 -2.54 -0.05 0.00 -0.04 0.00 0.00 33.50 31.44 1d1d n PRO 149 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1d1d s ALA 150 N 2.76 3.69 0.36 0.55 0.00 -1.26 -5.07 121.76 122.80 1d1d s ALA 150 Ca 0.52 -1.04 0.05 0.00 0.00 0.00 0.00 51.96 51.49 1d1d s ALA 150 Cb 0.14 -1.52 -0.02 0.00 0.00 0.00 0.00 23.12 21.72 1d1d s ALA 150 CO -0.04 0.67 0.19 0.41 0.00 0.00 0.00 175.76 176.98 1d1d n GLY 151 N 0.08 3.16 0.11 0.00 0.00 -1.26 -5.01 105.19 102.27 1d1d n GLY 151 Ca -0.08 -2.03 -0.15 0.00 0.00 0.00 0.00 46.02 43.76 1d1d n GLY 151 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1d1d h PRO 152 N 0.00 0.25 0.00 1.61 0.13 -2.00 -3.05 132.00 128.95 1d1d h PRO 152 Ca -0.28 -0.25 -0.02 0.00 -0.87 0.00 0.00 66.00 64.58 1d1d h PRO 152 Cb 1.16 0.06 -0.00 0.00 0.13 0.00 0.00 31.00 32.35 1d1d h PRO 152 CO 0.43 0.94 -1.33 -2.67 -0.23 0.00 0.00 178.00 175.14 1d1d n TRP 153 N -4.44 0.70 0.09 1.56 2.14 -1.26 -3.88 117.44 112.36 1d1d n TRP 153 Ca -0.09 0.21 0.04 0.00 2.07 0.00 0.00 57.50 59.73 1d1d n TRP 153 Cb 0.53 -0.86 0.46 0.00 -0.81 0.00 0.00 31.31 30.63 1d1d n TRP 153 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 1d1d h ALA 154 N 1.92 1.71 0.00 -1.67 0.00 -1.96 0.23 119.26 119.49 1d1d h ALA 154 Ca -0.03 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1d1d h ALA 154 Cb 1.09 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.77 1d1d h ALA 154 CO 0.01 0.23 0.00 -3.47 0.00 0.00 0.00 179.25 176.02 1d1d n ASP 155 N -4.43 0.75 -4.62 0.00 -0.08 -1.15 -4.68 116.55 102.34 1d1d n ASP 155 Ca 0.01 0.57 -0.40 0.00 -1.51 0.00 0.00 54.79 53.46 1d1d n ASP 155 Cb 0.13 -0.77 -0.08 0.00 2.34 0.00 0.00 41.12 42.74 1d1d n ASP 155 CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 1d1d s ILE 156 N -3.10 5.09 -0.02 5.18 1.01 0.79 -5.05 121.20 125.10 1d1d s ILE 156 Ca 0.11 0.84 0.04 0.00 0.00 0.00 0.00 60.65 61.63 1d1d s ILE 156 Cb 0.13 -3.81 -0.00 0.00 0.01 0.00 0.00 42.46 38.79 1d1d s ILE 156 CO 0.59 0.11 -0.13 -0.89 0.00 0.00 0.00 174.94 174.62 1d1d s THR 157 N 2.15 1.08 -0.04 2.92 2.01 -1.26 -4.93 115.64 117.57 1d1d s THR 157 Ca 0.21 -0.55 -0.30 0.00 0.31 0.00 0.00 61.69 61.36 1d1d s THR 157 Cb -0.16 -0.92 -0.03 0.00 0.01 0.00 0.00 72.50 71.41 1d1d s THR 157 CO 0.09 0.31 1.09 -1.58 -0.69 0.00 0.00 174.62 173.84 1d1d s GLN 158 N -0.08 4.43 0.26 4.92 -0.44 -1.26 -5.04 119.66 122.45 1d1d s GLN 158 Ca 0.01 1.54 0.10 0.00 -2.50 0.00 0.00 55.36 54.51 1d1d s GLN 158 Cb -0.08 -3.50 -0.05 0.00 -1.64 0.00 0.00 33.01 27.75 1d1d s GLN 158 CO 0.00 -0.28 -0.17 0.20 0.50 0.00 0.00 175.29 175.54 1d1d s GLY 159 N 1.18 1.74 0.49 2.59 0.00 -1.26 -4.46 107.32 107.61 1d1d s GLY 159 Ca 0.53 -1.82 0.28 0.00 0.00 0.00 0.00 44.72 43.72 1d1d s GLY 159 CO 0.23 -1.90 1.80 -0.56 0.00 0.00 0.00 173.10 172.67 1d1d h PRO 160 N 2.36 0.00 0.00 2.90 0.13 -1.96 -2.70 132.00 132.73 1d1d h PRO 160 Ca -0.39 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.74 1d1d h PRO 160 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1d1d h PRO 160 CO 0.61 0.00 0.00 0.66 -0.23 0.00 0.00 178.00 179.04 1d1d h SER 161 N 0.00 0.00 -3.86 1.44 4.64 -2.01 -3.44 113.55 110.32 1d1d h SER 161 Ca 0.00 0.00 -0.68 0.00 -0.47 0.00 0.00 61.79 60.64 1d1d h SER 161 Cb 0.75 0.00 -0.25 0.00 -0.31 0.00 0.00 62.40 62.58 1d1d h SER 161 CO 0.00 0.00 -0.79 -1.61 -0.87 0.00 0.00 176.83 173.56 1d1d s GLU 162 N -3.16 2.74 0.22 4.77 8.01 -1.02 -5.08 118.70 125.18 1d1d s GLU 162 Ca 0.09 -0.73 -0.32 0.00 0.01 0.00 0.00 54.97 54.02 1d1d s GLU 162 Cb 0.10 -2.41 -0.13 0.00 -4.31 0.00 0.00 34.13 27.38 1d1d s GLU 162 CO 0.61 0.48 1.52 0.45 0.01 0.00 0.00 175.26 178.33 1d1d n SER 163 N 2.72 3.15 0.08 -0.19 2.88 -1.26 -4.53 113.62 116.47 1d1d n SER 163 Ca -0.17 1.12 -0.12 0.00 -1.33 0.00 0.00 58.87 58.37 1d1d n SER 163 Cb 0.52 -1.47 -0.05 0.00 -0.75 0.00 0.00 64.21 62.46 1d1d n SER 163 CO 0.00 0.00 0.00 0.15 -1.23 0.00 0.00 175.04 173.96 1d1d h PHE 164 N 5.00 -0.43 -0.63 0.66 3.57 -1.95 0.65 116.94 123.81 1d1d h PHE 164 Ca -0.45 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.02 1d1d h PHE 164 Cb 1.25 0.18 -0.03 0.00 2.79 0.00 0.00 35.95 40.15 1d1d h PHE 164 CO 0.59 -0.24 0.26 -0.24 -2.23 0.00 0.00 178.31 176.45 1d1d h VAL 165 N -0.29 1.22 -0.15 1.41 3.04 -1.97 0.48 116.25 119.99 1d1d h VAL 165 Ca 0.04 -0.69 -0.01 0.00 -1.01 0.00 0.00 66.70 65.03 1d1d h VAL 165 Cb 0.34 0.46 -0.01 0.00 -2.01 0.00 0.00 31.29 30.07 1d1d h VAL 165 CO -0.12 0.28 0.06 0.44 -1.01 0.00 0.00 177.57 177.22 1d1d h ASP 166 N 0.91 0.20 -0.35 3.17 5.19 -1.72 -1.63 116.42 122.20 1d1d h ASP 166 Ca 0.22 -0.15 -0.11 0.00 -0.62 0.00 0.00 57.03 56.37 1d1d h ASP 166 Cb 0.17 -0.05 -0.02 0.00 0.18 0.00 0.00 39.33 39.61 1d1d h ASP 166 CO -0.02 0.30 -0.16 0.15 -3.12 0.00 0.00 179.24 176.38 1d1d h PHE 167 N 0.10 0.90 -0.76 4.55 3.57 0.75 -2.53 116.94 123.52 1d1d h PHE 167 Ca 0.05 -0.19 0.06 0.00 3.53 0.00 0.00 57.97 61.42 1d1d h PHE 167 Cb 0.15 -0.22 -0.05 0.00 2.79 0.00 0.00 35.95 38.62 1d1d h PHE 167 CO -0.02 0.91 0.50 0.00 -2.23 0.00 0.00 178.31 177.47 1d1d h ALA 168 N 1.10 1.64 -0.15 2.41 0.00 0.21 0.38 119.26 124.84 1d1d h ALA 168 Ca 0.11 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 1d1d h ALA 168 Cb 0.67 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 1d1d h ALA 168 CO 0.05 0.25 -0.02 -0.91 0.00 0.00 0.00 179.25 178.62 1d1d h ASN 169 N 0.84 0.29 -0.66 0.00 2.35 -0.92 0.39 115.58 117.86 1d1d h ASN 169 Ca 0.32 -0.35 -0.02 0.00 -0.55 0.00 0.00 56.30 55.70 1d1d h ASN 169 Cb 0.20 -0.08 -0.03 0.00 0.05 0.00 0.00 38.32 38.46 1d1d h ASN 169 CO -0.11 0.57 0.35 0.03 -1.65 0.00 0.00 177.43 176.62 1d1d h ARG 170 N -0.00 0.96 0.02 0.81 3.08 -0.88 0.39 114.38 118.75 1d1d h ARG 170 Ca 0.04 -0.12 -0.00 0.00 0.07 0.00 0.00 59.98 59.97 1d1d h ARG 170 Cb 0.44 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 30.30 1d1d h ARG 170 CO 0.01 0.73 -0.01 1.25 -1.07 0.00 0.00 179.97 180.88 1d1d h LEU 171 N 0.96 -0.02 -1.14 3.04 6.46 -0.10 -0.86 115.31 123.65 1d1d h LEU 171 Ca 0.24 -0.49 0.05 0.00 -0.12 0.00 0.00 57.88 57.56 1d1d h LEU 171 Cb 0.07 0.01 -0.06 0.00 -0.73 0.00 0.00 40.66 39.95 1d1d h LEU 171 CO -0.03 0.48 0.59 0.40 -0.62 0.00 0.00 178.44 179.26 1d1d h ILE 172 N -0.54 1.10 -0.42 4.05 2.04 0.06 0.38 117.51 124.18 1d1d h ILE 172 Ca -0.00 -0.37 -0.08 0.00 1.00 0.00 0.00 64.86 65.41 1d1d h ILE 172 Cb 0.51 -0.06 -0.02 0.00 -0.74 0.00 0.00 36.82 36.51 1d1d h ILE 172 CO 0.00 0.19 -0.07 0.11 0.00 0.00 0.00 178.15 178.38 1d1d h LYS 173 N 1.06 0.73 0.06 2.37 1.57 -0.15 0.40 116.57 122.61 1d1d h LYS 173 Ca 0.38 -0.22 -0.00 0.00 -1.87 0.00 0.00 60.65 58.93 1d1d h LYS 173 Cb 0.13 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.37 1d1d h LYS 173 CO -0.13 0.79 -0.03 0.00 -0.57 0.00 0.00 179.45 179.51 1d1d h ALA 174 N 1.25 -0.08 -0.23 3.86 0.00 0.52 -1.82 119.26 122.76 1d1d h ALA 174 Ca 0.12 -0.22 0.01 0.00 0.00 0.00 0.00 54.91 54.83 1d1d h ALA 174 Cb 0.52 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 1d1d h ALA 174 CO 0.03 -0.32 0.12 0.28 0.00 0.00 0.00 179.25 179.36 1d1d h VAL 175 N -0.52 1.01 -0.81 0.00 2.07 -0.20 -0.08 116.25 117.71 1d1d h VAL 175 Ca -0.01 -0.09 0.15 0.00 0.82 0.00 0.00 66.70 67.58 1d1d h VAL 175 Cb 0.46 0.73 -0.06 0.00 -1.52 0.00 0.00 31.29 30.90 1d1d h VAL 175 CO 0.01 0.05 0.54 -0.33 0.02 0.00 0.00 177.57 177.86 1d1d h GLU 176 N 0.26 0.48 -0.76 1.57 4.39 -0.19 0.34 114.58 120.66 1d1d h GLU 176 Ca 0.09 -0.03 -0.30 0.00 0.34 0.00 0.00 59.36 59.46 1d1d h GLU 176 Cb 0.01 -0.11 -0.18 0.00 -0.10 0.00 0.00 28.75 28.37 1d1d h GLU 176 CO -0.05 0.32 0.35 0.41 -1.16 0.00 0.00 179.01 178.87 1d1d n GLY 177 N -1.50 4.07 3.64 -3.84 0.00 -0.52 -4.95 105.19 102.10 1d1d n GLY 177 Ca 0.16 -1.05 -0.25 0.00 0.00 0.00 0.00 46.02 44.87 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 -1.32 4.15 -1.21 1.61 1.04 0.12 -4.98 113.70 113.12 1d1d s SER 178 Ca 0.54 -1.05 -0.14 0.00 0.48 0.00 0.00 55.95 55.77 1d1d s SER 178 Cb 0.45 -0.50 0.16 0.00 0.10 0.00 0.00 66.02 66.23 1d1d s SER 178 CO 0.11 -0.30 1.45 -1.81 0.98 0.00 0.00 173.24 173.68 1d1d s ASP 179 N -3.73 7.03 0.16 7.02 1.11 -1.26 -4.96 116.67 122.04 1d1d s ASP 179 Ca 0.36 -2.91 0.09 0.00 0.18 0.00 0.00 52.55 50.27 1d1d s ASP 179 Cb 0.02 -2.42 -0.04 0.00 1.07 0.00 0.00 42.92 41.55 1d1d s ASP 179 CO 0.19 -0.80 -0.20 -0.76 1.18 0.00 0.00 175.17 174.78 1d1d s LEU 180 N 1.87 2.41 0.74 1.23 1.43 -1.26 -5.14 118.68 119.97 1d1d s LEU 180 Ca 0.43 -0.84 -0.11 0.00 -1.03 0.00 0.00 54.13 52.59 1d1d s LEU 180 Cb -0.02 -0.93 0.04 0.00 0.03 0.00 0.00 46.19 45.30 1d1d s LEU 180 CO 0.00 0.02 1.08 -2.16 0.23 0.00 0.00 176.35 175.53 1d1d s PRO 181 N -2.62 2.54 -1.16 1.29 0.04 -1.26 -4.90 135.00 128.93 1d1d s PRO 181 Ca 0.16 0.80 -0.13 0.00 0.04 0.00 0.00 61.00 61.87 1d1d s PRO 181 Cb -0.07 -1.96 -0.07 0.00 0.04 0.00 0.00 34.50 32.45 1d1d s PRO 181 CO 0.07 -1.34 2.28 -0.35 0.04 0.00 0.00 177.00 177.70 1d1d n PRO 182 N -3.27 2.47 0.00 0.56 -0.04 -1.26 -2.52 135.00 130.94 1d1d n PRO 182 Ca 0.07 -1.99 0.00 0.00 -0.04 0.00 0.00 63.50 61.55 1d1d n PRO 182 Cb 0.55 -2.84 0.00 0.00 -0.04 0.00 0.00 33.50 31.16 1d1d n PRO 182 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1d1d n SER 183 N 5.36 0.00 0.03 3.54 2.88 -1.26 -4.92 113.62 119.25 1d1d n SER 183 Ca 0.55 0.00 0.14 0.00 -1.33 0.00 0.00 58.87 58.23 1d1d n SER 183 Cb 0.28 0.00 0.51 0.00 -0.75 0.00 0.00 64.21 64.26 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 -0.42 2.42 -2.02 -1.46 0.00 -1.05 -4.31 120.51 113.67 1d1d n ALA 184 Ca 0.00 -0.10 -0.42 0.00 0.00 0.00 0.00 53.44 52.92 1d1d n ALA 184 Cb 0.00 -1.44 0.00 0.00 0.00 0.00 0.00 19.45 18.02 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 -1.75 3.21 0.00 0.00 1.74 -1.19 -2.60 116.66 116.06 1d1d n ARG 185 Ca 0.06 -3.04 0.00 0.00 -0.77 0.00 0.00 57.85 54.11 1d1d n ARG 185 Cb 0.37 -3.13 0.00 0.00 -1.02 0.00 0.00 32.46 28.68 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 0.15 7.54 0.00 -1.26 -4.93 120.51 127.15 1d1d n ALA 186 Ca 0.46 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.93 1d1d n ALA 186 Cb 0.38 0.00 0.18 0.00 0.00 0.00 0.00 19.45 20.01 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 -0.51 0.00 0.13 -1.68 -2.78 132.00 127.16 1d1d h PRO 187 Ca 0.00 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 65.03 1d1d h PRO 187 Cb 0.00 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.11 1d1d h PRO 187 CO 0.00 0.52 -0.07 0.28 -0.23 0.00 0.00 178.00 178.50 1d1d h VAL 188 N 0.00 1.26 -0.09 1.56 2.07 -1.84 0.92 116.25 120.13 1d1d h VAL 188 Ca -0.01 -1.17 -0.03 0.00 0.82 0.00 0.00 66.70 66.32 1d1d h VAL 188 Cb 1.15 0.94 -0.00 0.00 -1.52 0.00 0.00 31.29 31.85 1d1d h VAL 188 CO 0.07 0.41 -0.04 0.40 0.02 0.00 0.00 177.57 178.43 1d1d h ILE 189 N 0.83 1.32 -0.36 4.57 2.04 -1.77 -1.55 117.51 122.58 1d1d h ILE 189 Ca 0.14 -1.05 -0.09 0.00 1.00 0.00 0.00 64.86 64.87 1d1d h ILE 189 Cb 0.58 1.82 -0.02 0.00 -0.74 0.00 0.00 36.82 38.46 1d1d h ILE 189 CO 0.04 0.30 -0.14 0.40 0.00 0.00 0.00 178.15 178.74 1d1d h ILE 190 N -0.16 1.25 -0.60 -0.67 2.04 -1.34 -2.18 117.51 115.86 1d1d h ILE 190 Ca 0.02 -1.14 -0.01 0.00 1.00 0.00 0.00 64.86 64.73 1d1d h ILE 190 Cb 0.49 1.13 -0.03 0.00 -0.74 0.00 0.00 36.82 37.67 1d1d h ILE 190 CO 0.01 0.38 0.34 0.44 0.00 0.00 0.00 178.15 179.32 1d1d h ASP 191 N 0.58 0.72 -0.14 1.72 5.19 0.10 -1.40 116.42 123.19 1d1d h ASP 191 Ca 0.10 -0.04 -0.01 0.00 -0.62 0.00 0.00 57.03 56.46 1d1d h ASP 191 Cb 0.57 -0.18 -0.01 0.00 0.18 0.00 0.00 39.33 39.90 1d1d h ASP 191 CO 0.04 0.57 0.06 0.00 -3.12 0.00 0.00 179.24 176.79 1d1d h PHE 193 N 0.08 -0.26 0.00 0.00 0.04 -1.02 0.35 116.94 116.13 1d1d h PHE 193 Ca 0.05 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.84 1d1d h PHE 193 Cb 0.15 0.16 0.00 0.00 2.20 0.00 0.00 35.95 38.45 1d1d h PHE 193 CO -0.02 -0.17 0.00 2.89 -0.60 0.00 0.00 178.31 180.41 1d1d n ARG 194 N -5.28 0.84 0.11 1.51 1.85 -0.60 -2.24 116.66 112.85 1d1d n ARG 194 Ca -0.01 0.00 -0.24 0.00 -1.00 0.00 0.00 57.85 56.61 1d1d n ARG 194 Cb 0.20 -1.45 -0.15 0.00 -1.05 0.00 0.00 32.46 30.01 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 0.00 0.46 -0.15 2.89 5.75 0.24 -3.45 115.11 120.84 1d1d h GLN 195 Ca 0.00 -0.78 0.00 0.00 -0.15 0.00 0.00 58.65 57.72 1d1d h GLN 195 Cb 0.00 0.29 -0.15 0.00 1.07 0.00 0.00 27.48 28.69 1d1d h GLN 195 CO 0.00 1.37 -0.11 0.36 -2.65 0.00 0.00 178.83 177.80 1d1d n LYS 196 N -3.76 0.10 -3.41 1.69 2.85 -1.03 -5.08 118.16 109.52 1d1d n LYS 196 Ca -0.19 -0.76 -0.21 0.00 -1.05 0.00 0.00 58.31 56.10 1d1d n LYS 196 Cb 1.05 0.10 -0.10 0.00 -0.65 0.00 0.00 35.03 35.43 1d1d n LYS 196 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 177.40 175.81 1d1d s SER 197 N 0.79 1.89 0.36 -5.58 1.04 -0.95 -4.11 113.70 107.14 1d1d s SER 197 Ca 0.24 -1.62 0.00 0.00 0.48 0.00 0.00 55.95 55.05 1d1d s SER 197 Cb 0.14 0.23 0.00 0.00 0.10 0.00 0.00 66.02 66.49 1d1d s SER 197 CO -0.10 -0.30 0.00 0.00 0.98 0.00 0.00 173.24 173.81 1d1d n GLN 198 N 4.39 -2.12 -0.01 4.02 1.13 -1.26 -2.82 117.38 120.71 1d1d n GLN 198 Ca 0.09 1.70 -0.17 0.00 -1.94 0.00 0.00 57.00 56.68 1d1d n GLN 198 Cb 0.43 -2.51 -0.10 0.00 0.11 0.00 0.00 30.24 28.16 1d1d n GLN 198 CO 0.00 0.00 0.00 -1.00 -1.44 0.00 0.00 177.06 174.62 1d1d h PRO 199 N -0.72 0.42 -0.24 -1.09 0.13 -1.99 -2.14 132.00 126.37 1d1d h PRO 199 Ca -0.07 -0.41 -0.05 0.00 -0.87 0.00 0.00 66.00 64.60 1d1d h PRO 199 Cb 0.71 0.11 -0.01 0.00 0.13 0.00 0.00 31.00 31.94 1d1d h PRO 199 CO 0.03 1.07 -0.05 -0.44 -0.23 0.00 0.00 178.00 178.38 1d1d h ASP 200 N -0.07 0.46 -0.03 1.44 5.19 -1.99 -0.80 116.42 120.62 1d1d h ASP 200 Ca -0.06 -0.36 0.01 0.00 -0.62 0.00 0.00 57.03 56.00 1d1d h ASP 200 Cb 1.23 -0.12 -0.00 0.00 0.18 0.00 0.00 39.33 40.62 1d1d h ASP 200 CO 0.11 0.71 0.02 0.40 -3.12 0.00 0.00 179.24 177.36 1d1d h ILE 201 N 0.20 0.97 -0.02 0.35 1.08 -1.68 0.40 117.51 118.81 1d1d h ILE 201 Ca 0.06 0.00 -0.02 0.00 -0.39 0.00 0.00 64.86 64.51 1d1d h ILE 201 Cb 0.50 0.99 0.00 0.00 -3.07 0.00 0.00 36.82 35.24 1d1d h ILE 201 CO 0.02 0.00 -0.06 1.56 -0.69 0.00 0.00 178.15 178.98 1d1d h GLN 202 N 0.00 0.07 0.00 2.37 1.08 -0.90 -2.15 115.11 115.57 1d1d h GLN 202 Ca 0.01 -0.05 -0.05 0.00 -1.45 0.00 0.00 58.65 57.11 1d1d h GLN 202 Cb 0.06 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.49 1d1d h GLN 202 CO -0.00 0.69 -0.24 1.96 -0.95 0.00 0.00 178.83 180.28 1d1d h GLN 203 N -0.54 0.00 -0.04 1.46 4.20 -0.44 0.32 115.11 120.08 1d1d h GLN 203 Ca -0.00 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 1d1d h GLN 203 Cb 0.70 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.48 1d1d h GLN 203 CO 0.01 0.24 -0.02 1.25 -0.67 0.00 0.00 178.83 179.65 1d1d h LEU 204 N 0.00 0.08 -0.05 1.46 6.46 -0.20 0.38 115.31 123.43 1d1d h LEU 204 Ca -0.00 -0.42 -0.02 0.00 -0.12 0.00 0.00 57.88 57.32 1d1d h LEU 204 Cb 0.51 -0.02 -0.00 0.00 -0.73 0.00 0.00 40.66 40.41 1d1d h LEU 204 CO 0.03 0.48 -0.03 0.40 -0.62 0.00 0.00 178.44 178.70 1d1d h ILE 205 N -0.33 1.34 -0.38 4.05 2.04 -1.10 -0.21 117.51 122.92 1d1d h ILE 205 Ca 0.01 -1.08 0.02 0.00 1.00 0.00 0.00 64.86 64.80 1d1d h ILE 205 Cb 0.45 1.95 -0.02 0.00 -0.74 0.00 0.00 36.82 38.46 1d1d h ILE 205 CO 0.01 0.30 0.25 0.08 0.00 0.00 0.00 178.15 178.79 1d1d h ARG 206 N -0.29 0.45 -0.14 2.37 0.11 -0.41 0.37 114.38 116.85 1d1d h ARG 206 Ca 0.01 -0.03 0.00 0.00 0.10 0.00 0.00 59.98 60.06 1d1d h ARG 206 Cb 0.49 -0.10 0.00 0.00 1.11 0.00 0.00 29.97 31.47 1d1d h ARG 206 CO 0.01 0.29 0.00 0.00 0.10 0.00 0.00 179.97 180.37 1d1d n ALA 207 N -2.49 2.53 -1.08 0.08 0.00 0.13 -4.92 120.51 114.76 1d1d n ALA 207 Ca 0.03 -0.50 -0.32 0.00 0.00 0.00 0.00 53.44 52.65 1d1d n ALA 207 Cb 0.11 -1.11 0.12 0.00 0.00 0.00 0.00 19.45 18.57 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 -1.82 1.94 0.56 0.00 0.00 0.13 -4.99 121.76 117.58 1d1d s ALA 208 Ca 0.33 0.55 -0.17 0.00 0.00 0.00 0.00 51.96 52.68 1d1d s ALA 208 Cb 0.18 -3.39 -0.05 0.00 0.00 0.00 0.00 23.12 19.86 1d1d s ALA 208 CO 0.27 -2.14 1.05 -1.25 0.00 0.00 0.00 175.76 173.69 1d1d s PRO 209 N -4.51 3.48 -0.05 0.00 0.04 -1.26 -4.94 135.00 127.76 1d1d s PRO 209 Ca 0.67 1.21 0.09 0.00 0.04 0.00 0.00 61.00 63.01 1d1d s PRO 209 Cb -0.22 -2.06 0.34 0.00 0.04 0.00 0.00 34.50 32.60 1d1d s PRO 209 CO 0.53 -0.68 1.18 0.43 0.04 0.00 0.00 177.00 178.50 1d1d n SER 210 N -1.77 2.40 -0.32 6.66 7.64 -1.26 -3.49 113.62 123.49 1d1d n SER 210 Ca 0.09 -2.18 0.12 0.00 1.01 0.00 0.00 58.87 57.90 1d1d n SER 210 Cb 0.53 -0.38 0.12 0.00 -1.01 0.00 0.00 64.21 63.47 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 0.42 0.00 -3.78 0.44 5.66 -1.26 -4.91 114.28 110.85 1d1d n THR 211 Ca 0.12 -0.17 -0.13 0.00 -3.05 0.00 0.00 64.05 60.83 1d1d n THR 211 Cb 0.46 0.89 -0.10 0.00 -1.55 0.00 0.00 70.33 70.02 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 -2.59 0.92 -0.37 1.09 0.05 -1.23 -5.06 118.68 111.49 1d1d s LEU 212 Ca 0.18 0.30 0.10 0.00 0.05 0.00 0.00 54.13 54.76 1d1d s LEU 212 Cb 0.18 1.10 0.37 0.00 -2.05 0.00 0.00 46.19 45.80 1d1d s LEU 212 CO 0.60 -0.28 1.39 0.35 -0.55 0.00 0.00 176.35 177.86 1d1d n THR 213 N 2.04 0.00 -4.45 5.48 -2.24 -1.26 -4.76 114.28 109.09 1d1d n THR 213 Ca -0.18 -1.28 -0.24 0.00 -2.27 0.00 0.00 64.05 60.08 1d1d n THR 213 Cb 0.57 0.97 -0.11 0.00 -2.10 0.00 0.00 70.33 69.66 1d1d n THR 213 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1d1d s THR 214 N 0.17 2.39 -0.57 4.28 -4.23 -1.26 -3.91 115.64 112.51 1d1d s THR 214 Ca 0.17 -2.29 -0.06 0.00 -1.18 0.00 0.00 61.69 58.33 1d1d s THR 214 Cb 0.39 -2.23 -0.14 0.00 1.34 0.00 0.00 72.50 71.87 1d1d s THR 214 CO -0.10 -0.33 2.67 -0.81 -0.54 0.00 0.00 174.62 175.51 1d1d n PRO 215 N -0.34 2.09 0.00 3.99 -0.04 -1.26 -2.85 135.00 136.59 1d1d n PRO 215 Ca -0.07 -1.23 0.00 0.00 -0.04 0.00 0.00 63.50 62.16 1d1d n PRO 215 Cb 0.59 -2.21 0.00 0.00 -0.04 0.00 0.00 33.50 31.84 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 3.12 -0.74 0.18 0.55 0.00 -1.26 -4.90 105.19 102.15 1d1d n GLY 216 Ca 0.45 0.09 -0.13 0.00 0.00 0.00 0.00 46.02 46.42 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 0.52 0.12 1.61 5.08 -1.95 0.15 114.58 120.11 1d1d h GLU 217 Ca 0.00 -0.47 -0.01 0.00 -1.00 0.00 0.00 59.36 57.88 1d1d h GLU 217 Cb 0.00 0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.36 1d1d h GLU 217 CO 0.00 1.10 -0.06 0.82 -1.00 0.00 0.00 179.01 179.87 1d1d h ILE 218 N 0.33 0.98 -0.32 3.13 5.03 -1.88 0.53 117.51 125.30 1d1d h ILE 218 Ca -0.06 -0.40 -0.02 0.00 -0.12 0.00 0.00 64.86 64.26 1d1d h ILE 218 Cb 1.44 1.23 -0.01 0.00 -3.03 0.00 0.00 36.82 36.45 1d1d h ILE 218 CO 0.15 0.10 0.11 0.40 -0.68 0.00 0.00 178.15 178.23 1d1d h ILE 219 N -0.35 1.20 -0.51 -0.67 2.04 -1.80 0.46 117.51 117.88 1d1d h ILE 219 Ca -0.02 -0.62 0.01 0.00 1.00 0.00 0.00 64.86 65.24 1d1d h ILE 219 Cb 0.28 1.00 -0.03 0.00 -0.74 0.00 0.00 36.82 37.34 1d1d h ILE 219 CO 0.03 0.21 0.34 0.50 0.00 0.00 0.00 178.15 179.23 1d1d h LYS 220 N 0.36 0.65 -0.02 2.37 3.11 -0.84 0.46 116.57 122.66 1d1d h LYS 220 Ca 0.10 -0.04 -0.04 0.00 -2.81 0.00 0.00 60.65 57.87 1d1d h LYS 220 Cb 0.22 -0.15 0.00 0.00 -1.00 0.00 0.00 32.23 31.31 1d1d h LYS 220 CO -0.01 0.43 -0.13 -0.92 -2.81 0.00 0.00 179.45 176.02 1d1d h TYR 221 N 0.67 0.16 -0.45 1.91 3.20 0.71 -1.20 116.97 121.97 1d1d h TYR 221 Ca 0.19 -0.08 0.00 0.00 3.14 0.00 0.00 58.73 61.99 1d1d h TYR 221 Cb -0.03 -0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.19 1d1d h TYR 221 CO -0.00 0.80 0.30 0.28 -1.64 0.00 0.00 178.16 177.89 1d1d h VAL 222 N -0.52 1.12 -0.47 1.81 2.07 0.34 0.23 116.25 120.82 1d1d h VAL 222 Ca -0.01 -0.21 -0.04 0.00 0.82 0.00 0.00 66.70 67.26 1d1d h VAL 222 Cb 0.82 0.45 -0.02 0.00 -1.52 0.00 0.00 31.29 31.02 1d1d h VAL 222 CO 0.03 0.11 0.14 -0.07 0.02 0.00 0.00 177.57 177.79 1d1d h LEU 223 N 0.61 0.64 -0.81 2.57 3.38 -0.16 0.49 115.31 122.02 1d1d h LEU 223 Ca 0.16 -0.09 -0.11 0.00 0.09 0.00 0.00 57.88 57.93 1d1d h LEU 223 Cb -0.07 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 1d1d h LEU 223 CO -0.04 0.62 -0.28 -0.78 0.09 0.00 0.00 178.44 178.05 1d1d h ASP 224 N 0.68 0.58 -0.04 -0.43 1.82 -0.12 -2.25 116.42 116.66 1d1d h ASP 224 Ca 0.16 -0.21 -0.13 0.00 -0.39 0.00 0.00 57.03 56.45 1d1d h ASP 224 Cb 0.22 -0.16 0.01 0.00 0.68 0.00 0.00 39.33 40.08 1d1d h ASP 224 CO -0.01 0.84 -0.48 -0.09 -1.61 0.00 0.00 179.24 177.89 1d1d h ARG 225 N 0.49 0.41 -0.86 0.28 1.12 0.48 -3.19 114.38 113.10 1d1d h ARG 225 Ca 0.06 -0.38 0.14 0.00 -1.11 0.00 0.00 59.98 58.70 1d1d h ARG 225 Cb 0.74 0.09 -0.07 0.00 -0.01 0.00 0.00 29.97 30.73 1d1d h ARG 225 CO 0.06 1.03 0.56 1.96 -3.11 0.00 0.00 179.97 180.47 1d1d h GLN 226 N -0.09 0.62 -5.67 0.20 4.20 0.03 -3.39 115.11 111.01 1d1d h GLN 226 Ca -0.05 -0.04 -0.64 0.00 0.06 0.00 0.00 58.65 57.99 1d1d h GLN 226 Cb 1.17 -0.14 -0.08 0.00 0.30 0.00 0.00 27.48 28.73 1d1d h GLN 226 CO 0.10 0.41 -0.39 -1.59 -0.67 0.00 0.00 178.83 176.69 1d1d s LYS 227 N -5.63 3.75 0.26 1.46 0.00 -0.86 -5.09 119.74 113.63 1d1d s LYS 227 Ca -0.10 0.03 0.08 0.00 0.00 0.00 0.00 55.97 55.98 1d1d s LYS 227 Cb 0.22 -3.25 -0.04 0.00 0.00 0.00 0.00 37.83 34.76 1d1d s LYS 227 CO 0.78 0.63 0.15 -1.50 0.00 0.00 0.00 175.35 175.41 1d1d s ILE 228 N -0.69 4.13 0.07 3.79 2.07 -1.26 -4.79 121.20 124.51 1d1d s ILE 228 Ca 0.17 -1.54 -0.02 0.00 -1.41 0.00 0.00 60.65 57.84 1d1d s ILE 228 Cb -0.13 -3.24 -0.03 0.00 0.13 0.00 0.00 42.46 39.18 1d1d s ILE 228 CO 0.06 -0.35 0.01 0.00 -1.91 0.00 0.00 174.94 172.75 1d1d s ALA 229 N -2.20 0.44 -2.00 1.50 0.00 -1.26 -5.17 121.76 113.08 1d1d s ALA 229 Ca 0.33 -1.15 0.24 0.00 0.00 0.00 0.00 51.96 51.37 1d1d s ALA 229 Cb -0.07 0.37 1.43 0.00 0.00 0.00 0.00 23.12 24.85 1d1d s ALA 229 CO 0.24 -0.41 1.80 -0.35 0.00 0.00 0.00 175.76 177.04