#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d1d s THR 12 N 0.00 0.77 0.39 -0.99 2.01 -1.26 -5.13 115.64 111.43 1d1d s THR 12 Ca 0.00 -0.99 -0.25 0.00 0.31 0.00 0.00 61.69 60.76 1d1d s THR 12 Cb 0.00 -1.38 -0.09 0.00 0.01 0.00 0.00 72.50 71.04 1d1d s THR 12 CO 0.00 -0.41 1.06 -2.16 -0.69 0.00 0.00 174.62 172.42 1d1d s PRO 13 N 1.71 4.21 -0.44 4.92 0.04 -1.26 -4.97 135.00 139.21 1d1d s PRO 13 Ca 0.03 1.55 -0.29 0.00 0.04 0.00 0.00 61.00 62.34 1d1d s PRO 13 Cb -0.17 -2.62 0.01 0.00 0.04 0.00 0.00 34.50 31.76 1d1d s PRO 13 CO -0.16 -0.11 1.41 -1.17 0.04 0.00 0.00 177.00 177.01 1d1d s LEU 14 N -2.51 3.55 0.14 -3.56 0.20 -1.26 -4.97 118.68 110.27 1d1d s LEU 14 Ca 0.56 0.71 0.02 0.00 0.69 0.00 0.00 54.13 56.12 1d1d s LEU 14 Cb -0.23 -3.44 -0.04 0.00 -0.43 0.00 0.00 46.19 42.04 1d1d s LEU 14 CO 0.29 -1.49 -0.05 -1.83 -0.29 0.00 0.00 176.35 172.98 1d1d s GLU 15 N 5.06 1.00 0.11 1.98 -1.05 -1.26 -5.06 118.70 119.49 1d1d s GLU 15 Ca 0.59 -1.44 -0.09 0.00 -0.15 0.00 0.00 54.97 53.88 1d1d s GLU 15 Cb -0.13 -0.34 -0.12 0.00 -0.44 0.00 0.00 34.13 33.10 1d1d s GLU 15 CO 0.31 -0.04 1.29 -1.00 0.95 0.00 0.00 175.26 176.77 1d1d h PRO 16 N 2.81 0.58 -0.10 -4.83 0.13 -1.96 0.68 132.00 129.31 1d1d h PRO 16 Ca -0.36 -0.57 0.02 0.00 -0.87 0.00 0.00 66.00 64.22 1d1d h PRO 16 Cb 1.19 0.15 -0.02 0.00 0.13 0.00 0.00 31.00 32.45 1d1d h PRO 16 CO 0.64 1.19 -0.00 1.57 -0.23 0.00 0.00 178.00 181.16 1d1d h LYS 17 N 0.36 0.03 -0.17 0.86 2.10 -1.98 1.33 116.57 119.10 1d1d h LYS 17 Ca -0.08 -0.00 -0.07 0.00 -2.00 0.00 0.00 60.65 58.49 1d1d h LYS 17 Cb 1.53 -0.01 -0.00 0.00 -0.90 0.00 0.00 32.23 32.85 1d1d h LYS 17 CO 0.17 0.02 -0.18 -0.07 -2.00 0.00 0.00 179.45 177.39 1d1d h LEU 18 N 0.03 0.46 -1.34 7.07 3.38 -1.93 -1.83 115.31 121.14 1d1d h LEU 18 Ca 0.05 -0.48 0.05 0.00 0.09 0.00 0.00 57.88 57.58 1d1d h LEU 18 Cb 0.06 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.63 1d1d h LEU 18 CO -0.08 0.85 0.48 0.40 0.09 0.00 0.00 178.44 180.18 1d1d h ILE 19 N 0.07 1.07 -0.48 1.22 2.04 -0.56 0.32 117.51 121.19 1d1d h ILE 19 Ca 0.03 -0.28 -0.09 0.00 1.00 0.00 0.00 64.86 65.51 1d1d h ILE 19 Cb 0.72 0.17 -0.02 0.00 -0.74 0.00 0.00 36.82 36.95 1d1d h ILE 19 CO 0.04 0.15 -0.05 0.74 0.00 0.00 0.00 178.15 179.03 1d1d h THR 20 N 0.83 1.27 -0.06 -0.27 2.02 0.19 0.69 112.91 117.58 1d1d h THR 20 Ca 0.30 -1.15 -0.01 0.00 0.77 0.00 0.00 66.41 66.32 1d1d h THR 20 Cb 0.16 1.04 -0.00 0.00 -1.74 0.00 0.00 68.15 67.61 1d1d h THR 20 CO -0.10 0.40 -0.01 0.03 0.37 0.00 0.00 175.52 176.21 1d1d h ARG 21 N 0.74 0.11 -0.39 6.66 3.08 -0.34 0.13 114.38 124.36 1d1d h ARG 21 Ca 0.13 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 60.10 1d1d h ARG 21 Cb 0.58 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.61 1d1d h ARG 21 CO 0.04 0.45 0.09 1.25 -1.07 0.00 0.00 179.97 180.73 1d1d h LEU 22 N -0.24 0.59 -1.68 3.04 6.46 -0.39 -2.08 115.31 121.02 1d1d h LEU 22 Ca 0.01 -0.24 -0.02 0.00 -0.12 0.00 0.00 57.88 57.52 1d1d h LEU 22 Cb 0.41 -0.16 -0.01 0.00 -0.73 0.00 0.00 40.66 40.18 1d1d h LEU 22 CO 0.01 0.67 0.00 0.00 -0.62 0.00 0.00 178.44 178.50 1d1d h ALA 23 N 0.94 1.74 -0.66 1.25 0.00 0.44 -1.41 119.26 121.57 1d1d h ALA 23 Ca 0.12 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1d1d h ALA 23 Cb 0.32 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 1d1d h ALA 23 CO 0.00 0.20 0.37 0.22 0.00 0.00 0.00 179.25 180.04 1d1d h ASP 24 N 0.20 0.82 -0.58 0.00 3.58 -0.05 -1.97 116.42 118.42 1d1d h ASP 24 Ca 0.05 -0.09 -0.04 0.00 0.42 0.00 0.00 57.03 57.37 1d1d h ASP 24 Cb 0.14 -0.21 -0.03 0.00 1.72 0.00 0.00 39.33 40.95 1d1d h ASP 24 CO 0.00 0.68 0.22 0.74 -2.88 0.00 0.00 179.24 178.00 1d1d h THR 25 N 0.90 1.23 -0.23 2.25 2.02 -0.87 -1.32 112.91 116.89 1d1d h THR 25 Ca 0.23 -0.74 0.04 0.00 0.77 0.00 0.00 66.41 66.71 1d1d h THR 25 Cb 0.03 0.51 -0.04 0.00 -1.74 0.00 0.00 68.15 66.92 1d1d h THR 25 CO -0.04 0.29 0.00 0.58 0.37 0.00 0.00 175.52 176.72 1d1d h VAL 26 N 0.90 0.84 -0.15 3.16 2.07 -0.90 0.76 116.25 122.93 1d1d h VAL 26 Ca 0.21 -0.03 -0.00 0.00 0.82 0.00 0.00 66.70 67.70 1d1d h VAL 26 Cb 0.21 0.76 -0.01 0.00 -1.52 0.00 0.00 31.29 30.74 1d1d h VAL 26 CO -0.01 0.01 0.08 -0.09 0.02 0.00 0.00 177.57 177.58 1d1d h ARG 27 N 0.07 0.20 -0.47 1.57 1.12 -1.04 0.54 114.38 116.37 1d1d h ARG 27 Ca 0.11 -0.02 -0.00 0.00 -1.11 0.00 0.00 59.98 58.95 1d1d h ARG 27 Cb 0.14 -0.04 -0.02 0.00 -0.01 0.00 0.00 29.97 30.03 1d1d h ARG 27 CO -0.18 0.21 0.28 1.79 -3.11 0.00 0.00 179.97 178.96 1d1d h THR 28 N 0.14 1.13 0.00 0.20 1.35 -0.74 0.11 112.91 115.10 1d1d h THR 28 Ca 0.05 -0.29 0.00 0.00 -0.55 0.00 0.00 66.41 65.62 1d1d h THR 28 Cb 0.06 0.47 0.00 0.00 -1.73 0.00 0.00 68.15 66.96 1d1d h THR 28 CO -0.01 0.14 -0.17 0.29 -0.25 0.00 0.00 175.52 175.52 1d1d n LYS 29 N -4.44 0.25 0.00 4.72 4.76 0.26 -5.01 118.16 118.70 1d1d n LYS 29 Ca 0.04 0.17 0.00 0.00 -2.87 0.00 0.00 58.31 55.65 1d1d n LYS 29 Cb 0.07 -1.75 0.00 0.00 -1.84 0.00 0.00 35.03 31.51 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 1.85 0.19 0.72 0.00 0.18 -4.43 105.19 105.04 1d1d n GLY 30 Ca 0.05 -1.39 0.03 0.00 0.00 0.00 0.00 46.02 44.72 1d1d n GLY 30 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1d1d h LEU 31 N 0.00 0.00 -1.13 0.99 7.12 -1.74 -1.13 115.31 119.42 1d1d h LEU 31 Ca 0.00 0.00 0.00 0.00 0.13 0.00 0.00 57.88 58.01 1d1d h LEU 31 Cb 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.13 1d1d h LEU 31 CO 0.00 0.34 0.00 -1.14 -0.13 0.00 0.00 178.44 177.51 1d1d n ARG 32 N -4.06 1.76 -2.36 1.25 0.63 -1.26 -4.72 116.66 107.91 1d1d n ARG 32 Ca -0.02 -1.12 -0.27 0.00 -0.92 0.00 0.00 57.85 55.52 1d1d n ARG 32 Cb 0.39 -1.44 0.03 0.00 0.45 0.00 0.00 32.46 31.89 1d1d n ARG 32 CO 0.00 0.00 0.00 -1.12 -2.51 0.00 0.00 177.63 174.00 1d1d s SER 33 N -1.75 5.67 -0.02 6.15 0.01 -0.43 -4.97 113.70 118.37 1d1d s SER 33 Ca 0.35 0.80 -0.22 0.00 1.31 0.00 0.00 55.95 58.18 1d1d s SER 33 Cb 0.19 -1.81 -0.22 0.00 0.21 0.00 0.00 66.02 64.39 1d1d s SER 33 CO 0.29 -1.03 1.10 1.55 0.41 0.00 0.00 173.24 175.56 1d1d h PRO 34 N -0.18 0.30 -1.87 12.44 0.13 -1.87 -3.16 132.00 137.78 1d1d h PRO 34 Ca -0.45 -0.29 0.54 0.00 -0.87 0.00 0.00 66.00 64.93 1d1d h PRO 34 Cb 1.25 0.08 -0.07 0.00 0.13 0.00 0.00 31.00 32.38 1d1d h PRO 34 CO 0.61 0.98 1.36 0.82 -0.23 0.00 0.00 178.00 181.54 1d1d h ILE 35 N -0.27 0.05 -0.05 -3.56 1.08 -1.89 1.52 117.51 114.40 1d1d h ILE 35 Ca -0.04 0.00 -0.00 0.00 -0.39 0.00 0.00 64.86 64.43 1d1d h ILE 35 Cb 1.09 0.05 -0.00 0.00 -3.07 0.00 0.00 36.82 34.89 1d1d h ILE 35 CO 0.08 0.00 0.03 0.74 -0.69 0.00 0.00 178.15 178.31 1d1d h THR 36 N 0.00 1.07 -0.59 -0.27 2.02 -1.76 0.37 112.91 113.74 1d1d h THR 36 Ca 0.89 -0.19 -0.05 0.00 0.77 0.00 0.00 66.41 67.83 1d1d h THR 36 Cb 3.60 1.11 -0.02 0.00 -1.74 0.00 0.00 68.15 71.09 1d1d h THR 36 CO -0.01 0.06 0.17 0.24 0.37 0.00 0.00 175.52 176.35 1d1d h MET 37 N 0.00 0.93 0.15 6.66 2.86 0.20 0.31 114.93 126.04 1d1d h MET 37 Ca 0.02 -0.21 -0.01 0.00 -2.06 0.00 0.00 59.70 57.44 1d1d h MET 37 Cb 0.07 -0.13 0.00 0.00 0.06 0.00 0.00 31.60 31.60 1d1d h MET 37 CO -0.00 0.84 -0.07 0.00 1.06 0.00 0.00 176.91 178.74 1d1d h ALA 38 N 1.05 -0.20 -0.29 6.32 0.00 -1.15 0.39 119.26 125.37 1d1d h ALA 38 Ca 0.19 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1d1d h ALA 38 Cb 0.31 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 1d1d h ALA 38 CO -0.00 -0.55 0.18 0.93 0.00 0.00 0.00 179.25 179.81 1d1d h GLU 39 N -0.33 0.37 -0.98 0.00 3.07 -0.13 0.29 114.58 116.88 1d1d h GLU 39 Ca -0.02 -0.02 0.02 0.00 -0.50 0.00 0.00 59.36 58.83 1d1d h GLU 39 Cb 0.26 -0.08 -0.05 0.00 -0.84 0.00 0.00 28.75 28.04 1d1d h GLU 39 CO 0.03 0.24 0.65 0.28 -1.40 0.00 0.00 179.01 178.81 1d1d h VAL 40 N 0.38 1.23 0.00 3.13 2.07 -0.23 0.11 116.25 122.93 1d1d h VAL 40 Ca 0.11 -0.45 -0.05 0.00 0.82 0.00 0.00 66.70 67.13 1d1d h VAL 40 Cb -0.04 -0.18 -0.01 0.00 -1.52 0.00 0.00 31.29 29.54 1d1d h VAL 40 CO -0.03 0.24 -0.26 -0.33 0.02 0.00 0.00 177.57 177.21 1d1d h GLU 41 N 1.30 0.00 0.42 1.57 5.08 0.52 0.00 114.58 123.47 1d1d h GLU 41 Ca 0.37 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.71 1d1d h GLU 41 Cb -0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.15 1d1d h GLU 41 CO -0.09 0.26 -0.20 0.00 -1.00 0.00 0.00 179.01 177.98 1d1d h ALA 42 N 1.74 -0.56 -0.06 3.43 0.00 0.16 1.68 119.26 125.65 1d1d h ALA 42 Ca -0.00 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.72 1d1d h ALA 42 Cb 0.76 0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.77 1d1d h ALA 42 CO 0.03 -0.77 -0.11 1.37 0.00 0.00 0.00 179.25 179.77 1d1d h LEU 43 N -0.64 0.20 -0.13 0.00 8.10 -1.42 -2.85 115.31 118.56 1d1d h LEU 43 Ca -0.06 -0.55 0.00 0.00 0.11 0.00 0.00 57.88 57.38 1d1d h LEU 43 Cb 0.48 -0.06 0.00 0.00 -0.44 0.00 0.00 40.66 40.64 1d1d h LEU 43 CO 0.09 0.71 0.00 0.23 -4.11 0.00 0.00 178.44 175.37 1d1d n MET 44 N -4.66 0.03 -0.60 0.17 2.81 -0.02 -3.33 117.12 111.52 1d1d n MET 44 Ca -0.08 0.33 0.46 0.00 -1.81 0.00 0.00 57.70 56.59 1d1d n MET 44 Cb 0.35 -1.56 0.71 0.00 -0.71 0.00 0.00 33.22 32.01 1d1d n MET 44 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 1d1d n SER 45 N -1.61 0.03 -4.75 7.83 3.41 0.57 -4.25 113.62 114.85 1d1d n SER 45 Ca 0.03 0.95 -0.23 0.00 -0.26 0.00 0.00 58.87 59.35 1d1d n SER 45 Cb 0.14 -0.47 -0.06 0.00 -0.26 0.00 0.00 64.21 63.56 1d1d n SER 45 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1d1d s SER 46 N -3.95 4.78 0.48 4.04 0.01 -1.21 -5.07 113.70 112.78 1d1d s SER 46 Ca -0.05 -0.73 -0.20 0.00 1.31 0.00 0.00 55.95 56.28 1d1d s SER 46 Cb 0.24 -0.77 -0.09 0.00 0.21 0.00 0.00 66.02 65.62 1d1d s SER 46 CO 0.78 -0.30 1.04 -2.16 0.41 0.00 0.00 173.24 173.01 1d1d s PRO 47 N -3.87 3.81 0.29 12.44 0.04 -1.26 -4.95 135.00 141.51 1d1d s PRO 47 Ca 0.38 1.36 -0.09 0.00 0.04 0.00 0.00 61.00 62.69 1d1d s PRO 47 Cb -0.03 -2.10 0.00 0.00 0.04 0.00 0.00 34.50 32.41 1d1d s PRO 47 CO 0.23 -0.42 0.50 -0.48 0.04 0.00 0.00 177.00 176.87 1d1d s LEU 48 N -3.47 0.57 0.74 -3.56 0.05 -1.26 -4.99 118.68 106.76 1d1d s LEU 48 Ca 0.67 -1.17 -0.12 0.00 0.05 0.00 0.00 54.13 53.57 1d1d s LEU 48 Cb -0.16 1.72 0.03 0.00 -2.05 0.00 0.00 46.19 45.73 1d1d s LEU 48 CO 0.20 -1.24 1.10 -0.76 -0.55 0.00 0.00 176.35 175.10 1d1d s LEU 49 N -3.11 2.79 0.22 1.48 1.43 -1.26 -4.59 118.68 115.64 1d1d s LEU 49 Ca 0.25 1.14 0.08 0.00 -1.03 0.00 0.00 54.13 54.57 1d1d s LEU 49 Cb -0.01 -3.86 0.15 0.00 0.03 0.00 0.00 46.19 42.50 1d1d s LEU 49 CO 0.13 -1.54 1.49 1.55 0.23 0.00 0.00 176.35 178.22 1d1d h PRO 50 N -0.79 0.03 -0.13 1.29 0.13 -1.87 -2.40 132.00 128.25 1d1d h PRO 50 Ca -0.46 -0.03 -0.02 0.00 -0.87 0.00 0.00 66.00 64.63 1d1d h PRO 50 Cb 1.26 0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.40 1d1d h PRO 50 CO 0.63 0.77 0.01 1.25 -0.23 0.00 0.00 178.00 180.43 1d1d h HIS 51 N 0.02 0.25 -0.08 1.56 2.76 -1.90 -2.23 115.15 115.53 1d1d h HIS 51 Ca -0.01 -0.04 -0.05 0.00 -2.20 0.00 0.00 60.37 58.06 1d1d h HIS 51 Cb 1.34 -0.07 -0.01 0.00 1.55 0.00 0.00 27.41 30.22 1d1d h HIS 51 CO 0.00 0.45 -0.19 -0.44 -1.30 0.00 0.00 177.93 176.45 1d1d h ASP 52 N -0.02 0.13 -0.26 3.26 5.19 -1.95 -1.41 116.42 121.35 1d1d h ASP 52 Ca 0.04 -0.03 0.01 0.00 -0.62 0.00 0.00 57.03 56.43 1d1d h ASP 52 Cb 0.35 -0.03 -0.02 0.00 0.18 0.00 0.00 39.33 39.81 1d1d h ASP 52 CO 0.01 0.33 0.15 0.58 -3.12 0.00 0.00 179.24 177.19 1d1d h VAL 53 N 0.13 1.03 -0.51 -1.35 2.07 -1.06 1.48 116.25 118.04 1d1d h VAL 53 Ca 0.02 -0.11 -0.09 0.00 0.82 0.00 0.00 66.70 67.35 1d1d h VAL 53 Cb 0.42 0.69 -0.02 0.00 -1.52 0.00 0.00 31.29 30.87 1d1d h VAL 53 CO 0.03 0.06 -0.02 0.71 0.02 0.00 0.00 177.57 178.37 1d1d h THR 54 N 0.31 1.26 -0.25 2.57 1.35 -0.93 0.37 112.91 117.59 1d1d h THR 54 Ca 0.10 -1.12 -0.11 0.00 -0.55 0.00 0.00 66.41 64.73 1d1d h THR 54 Cb -0.01 0.96 -0.01 0.00 -1.73 0.00 0.00 68.15 67.36 1d1d h THR 54 CO -0.04 0.39 -0.30 -1.13 -0.25 0.00 0.00 175.52 174.20 1d1d h ASN 55 N 0.79 0.53 0.17 5.36 -1.24 -0.82 0.44 115.58 120.81 1d1d h ASN 55 Ca 0.14 -0.20 -0.01 0.00 0.71 0.00 0.00 56.30 56.95 1d1d h ASN 55 Cb 0.55 -0.15 0.00 0.00 0.73 0.00 0.00 38.32 39.45 1d1d h ASN 55 CO 0.03 0.80 -0.08 0.25 -1.29 0.00 0.00 177.43 177.14 1d1d h LEU 56 N 0.45 -0.20 -0.79 0.34 6.46 0.24 -2.64 115.31 119.17 1d1d h LEU 56 Ca 0.06 -0.33 -0.01 0.00 -0.12 0.00 0.00 57.88 57.48 1d1d h LEU 56 Cb 0.74 0.05 -0.04 0.00 -0.73 0.00 0.00 40.66 40.69 1d1d h LEU 56 CO 0.06 0.28 0.46 -0.03 -0.62 0.00 0.00 178.44 178.59 1d1d h MET 57 N -0.75 1.09 -0.83 1.25 4.05 -0.22 -1.87 114.93 117.65 1d1d h MET 57 Ca -0.02 -0.11 0.11 0.00 -0.28 0.00 0.00 59.70 59.40 1d1d h MET 57 Cb 0.51 -0.22 -0.06 0.00 -0.80 0.00 0.00 31.60 31.03 1d1d h MET 57 CO 0.04 0.78 0.54 -0.09 0.23 0.00 0.00 176.91 178.41 1d1d h ARG 58 N 1.09 0.72 -0.17 0.39 2.43 -0.16 1.49 114.38 120.16 1d1d h ARG 58 Ca 0.28 -0.04 -0.12 0.00 -0.81 0.00 0.00 59.98 59.29 1d1d h ARG 58 Cb -0.01 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.37 1d1d h ARG 58 CO -0.05 0.47 -0.42 0.28 -1.51 0.00 0.00 179.97 178.75 1d1d h VAL 59 N 0.74 1.31 0.06 0.20 2.07 -0.97 -3.09 116.25 116.57 1d1d h VAL 59 Ca 0.39 -1.57 -0.18 0.00 0.82 0.00 0.00 66.70 66.16 1d1d h VAL 59 Cb 0.52 1.63 0.02 0.00 -1.52 0.00 0.00 31.29 31.94 1d1d h VAL 59 CO -0.16 0.48 -0.75 0.40 0.02 0.00 0.00 177.57 177.56 1d1d h ILE 60 N 0.34 1.44 -3.26 4.57 2.04 -0.14 -3.44 117.51 119.06 1d1d h ILE 60 Ca 0.03 -2.29 -0.68 0.00 1.00 0.00 0.00 64.86 62.92 1d1d h ILE 60 Cb 0.88 2.83 -0.33 0.00 -0.74 0.00 0.00 36.82 39.45 1d1d h ILE 60 CO 0.07 0.66 -0.87 -1.48 0.00 0.00 0.00 178.15 176.54 1d1d s LEU 61 N -8.12 2.12 0.00 1.44 2.34 0.48 -4.96 118.68 111.99 1d1d s LEU 61 Ca -0.13 -0.58 -0.00 0.00 0.06 0.00 0.00 54.13 53.48 1d1d s LEU 61 Cb 0.03 -1.44 0.00 0.00 -0.56 0.00 0.00 46.19 44.22 1d1d s LEU 61 CO 0.84 0.11 0.01 0.61 -1.06 0.00 0.00 176.35 176.85 1d1d n GLY 62 N 3.86 -2.48 0.23 -3.48 0.00 -1.24 -4.03 105.19 98.05 1d1d n GLY 62 Ca -0.20 -0.82 0.14 0.00 0.00 0.00 0.00 46.02 45.15 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 0.49 1.61 0.13 -1.98 -2.31 132.00 129.93 1d1d h PRO 63 Ca -0.00 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.10 1d1d h PRO 63 Cb 0.01 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.14 1d1d h PRO 63 CO 0.00 0.00 -0.23 0.00 -0.23 0.00 0.00 178.00 177.54 1d1d h ALA 64 N 2.07 -0.65 0.00 -0.56 0.00 -1.99 -3.11 119.26 115.02 1d1d h ALA 64 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1d1d h ALA 64 Cb 0.72 0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1d1d h ALA 64 CO 0.00 -0.61 0.00 -0.35 0.00 0.00 0.00 179.25 178.29 1d1d n PRO 65 N -5.21 0.75 -0.04 0.00 -0.04 -1.23 -3.27 135.00 125.96 1d1d n PRO 65 Ca -0.08 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.24 1d1d n PRO 65 Cb 0.27 -1.41 -0.09 0.00 -0.04 0.00 0.00 33.50 32.22 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 0.26 -0.71 0.54 3.20 -1.34 -1.83 116.97 117.10 1d1d h TYR 66 Ca 0.00 -0.10 0.03 0.00 3.14 0.00 0.00 58.73 61.80 1d1d h TYR 66 Cb 0.00 -0.05 -0.04 0.00 1.54 0.00 0.00 36.73 38.18 1d1d h TYR 66 CO 0.00 0.74 0.47 0.00 -1.64 0.00 0.00 178.16 177.73 1d1d h ALA 67 N 0.47 1.56 -0.32 1.82 0.00 -1.63 1.25 119.26 122.41 1d1d h ALA 67 Ca 0.00 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 1d1d h ALA 67 Cb 0.73 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1d1d h ALA 67 CO 0.03 0.37 0.03 -0.07 0.00 0.00 0.00 179.25 179.61 1d1d h LEU 68 N 0.89 0.53 -0.63 0.00 4.07 -1.70 0.44 115.31 118.92 1d1d h LEU 68 Ca 0.28 -0.28 -0.14 0.00 0.08 0.00 0.00 57.88 57.82 1d1d h LEU 68 Cb 0.01 -0.14 -0.01 0.00 1.08 0.00 0.00 40.66 41.60 1d1d h LEU 68 CO -0.07 0.68 -0.38 -0.25 -1.08 0.00 0.00 178.44 177.34 1d1d h TRP 69 N 0.37 0.78 -0.38 1.13 7.01 -0.39 -0.59 115.95 123.87 1d1d h TRP 69 Ca 0.10 -0.22 -0.04 0.00 2.11 0.00 0.00 58.89 60.84 1d1d h TRP 69 Cb 0.39 -0.17 -0.02 0.00 -2.10 0.00 0.00 29.16 27.27 1d1d h TRP 69 CO 0.03 0.94 0.10 0.52 -2.79 0.00 0.00 178.44 177.24 1d1d h MET 70 N 0.54 0.61 -0.50 2.65 2.86 0.19 1.08 114.93 122.36 1d1d h MET 70 Ca 0.05 -0.14 -0.07 0.00 -2.06 0.00 0.00 59.70 57.48 1d1d h MET 70 Cb 0.90 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 32.46 1d1d h MET 70 CO 0.08 0.63 0.05 0.22 1.06 0.00 0.00 176.91 178.96 1d1d h ASP 71 N 0.47 0.81 -0.11 1.22 1.82 0.02 0.31 116.42 120.96 1d1d h ASP 71 Ca 0.12 -0.28 -0.14 0.00 -0.39 0.00 0.00 57.03 56.35 1d1d h ASP 71 Cb 0.29 -0.22 -0.01 0.00 0.68 0.00 0.00 39.33 40.08 1d1d h ASP 71 CO 0.00 0.89 -0.40 0.00 -1.61 0.00 0.00 179.24 178.11 1d1d h ALA 72 N 0.96 0.80 -0.43 -0.78 0.00 -0.90 -2.27 119.26 116.63 1d1d h ALA 72 Ca 0.15 -0.44 -0.10 0.00 0.00 0.00 0.00 54.91 54.52 1d1d h ALA 72 Cb 0.44 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1d1d h ALA 72 CO 0.01 0.65 -0.12 2.35 0.00 0.00 0.00 179.25 182.14 1d1d h TRP 73 N 0.52 0.86 -0.72 0.00 7.01 0.16 -0.56 115.95 123.22 1d1d h TRP 73 Ca 0.04 -0.16 -0.01 0.00 2.11 0.00 0.00 58.89 60.88 1d1d h TRP 73 Cb 0.92 -0.22 -0.03 0.00 -2.10 0.00 0.00 29.16 27.73 1d1d h TRP 73 CO 0.04 0.86 0.43 0.78 -2.79 0.00 0.00 178.44 177.76 1d1d h GLY 74 N 0.97 1.05 0.74 2.65 0.00 -0.04 0.29 103.07 108.74 1d1d h GLY 74 Ca 0.12 -0.44 -0.04 0.00 0.00 0.00 0.00 47.33 46.97 1d1d h GLY 74 CO 0.04 0.43 -0.06 -2.08 0.00 0.00 0.00 176.54 174.87 1d1d h VAL 75 N 0.99 1.31 -0.66 4.60 2.07 -1.09 0.20 116.25 123.66 1d1d h VAL 75 Ca 0.26 -1.06 0.04 0.00 0.82 0.00 0.00 66.70 66.75 1d1d h VAL 75 Cb -0.02 1.72 -0.05 0.00 -1.52 0.00 0.00 31.29 31.41 1d1d h VAL 75 CO -0.05 0.31 0.40 1.56 0.02 0.00 0.00 177.57 179.81 1d1d h GLN 76 N -0.04 0.74 -0.34 1.57 1.08 -0.82 0.25 115.11 117.55 1d1d h GLN 76 Ca 0.03 -0.04 -0.03 0.00 -1.45 0.00 0.00 58.65 57.16 1d1d h GLN 76 Cb 0.51 -0.17 -0.01 0.00 -0.05 0.00 0.00 27.48 27.76 1d1d h GLN 76 CO 0.02 0.49 0.10 -0.07 -0.95 0.00 0.00 178.83 178.42 1d1d h LEU 77 N 0.76 0.50 -1.72 1.46 3.38 -0.33 -2.22 115.31 117.14 1d1d h LEU 77 Ca 0.28 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 1d1d h LEU 77 Cb 0.08 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1d1d h LEU 77 CO -0.13 0.58 0.04 1.56 0.09 0.00 0.00 178.44 180.58 1d1d h GLN 78 N 0.40 0.22 -0.66 1.13 4.20 -0.22 -1.36 115.11 118.81 1d1d h GLN 78 Ca 0.11 -0.02 -0.05 0.00 0.06 0.00 0.00 58.65 58.74 1d1d h GLN 78 Cb 0.27 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 27.97 1d1d h GLN 78 CO -0.00 0.21 0.21 1.15 -0.67 0.00 0.00 178.83 179.72 1d1d h THR 79 N 0.22 1.24 -0.22 -0.54 2.02 0.06 0.43 112.91 116.12 1d1d h THR 79 Ca 0.06 -0.84 -0.12 0.00 0.77 0.00 0.00 66.41 66.28 1d1d h THR 79 Cb 0.09 0.52 -0.01 0.00 -1.74 0.00 0.00 68.15 67.00 1d1d h THR 79 CO -0.00 0.33 -0.36 0.58 0.37 0.00 0.00 175.52 176.43 1d1d h VAL 80 N 0.97 1.29 0.01 3.16 2.07 -0.90 0.49 116.25 123.33 1d1d h VAL 80 Ca 0.22 -1.47 -0.00 0.00 0.82 0.00 0.00 66.70 66.26 1d1d h VAL 80 Cb 0.27 1.52 0.00 0.00 -1.52 0.00 0.00 31.29 31.56 1d1d h VAL 80 CO -0.01 0.46 -0.00 0.40 0.02 0.00 0.00 177.57 178.44 1d1d h ILE 81 N 0.40 1.45 -0.26 4.57 1.08 -0.81 -0.38 117.51 123.57 1d1d h ILE 81 Ca 0.04 -1.38 -0.01 0.00 -0.39 0.00 0.00 64.86 63.13 1d1d h ILE 81 Cb 0.82 2.39 -0.01 0.00 -3.07 0.00 0.00 36.82 36.94 1d1d h ILE 81 CO 0.07 0.36 0.14 0.00 -0.69 0.00 0.00 178.15 178.02 1d1d h ALA 82 N 0.39 0.33 -0.31 1.87 0.00 -0.10 0.47 119.26 121.91 1d1d h ALA 82 Ca -0.00 -0.08 0.04 0.00 0.00 0.00 0.00 54.91 54.87 1d1d h ALA 82 Cb 0.59 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.24 1d1d h ALA 82 CO 0.00 -0.12 0.07 0.00 0.00 0.00 0.00 179.25 179.20 1d1d h ALA 83 N 1.01 0.33 -0.20 0.00 0.00 -0.06 0.47 119.26 120.80 1d1d h ALA 83 Ca 0.09 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 1d1d h ALA 83 Cb 0.09 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1d1d h ALA 83 CO -0.01 -0.34 0.11 0.00 0.00 0.00 0.00 179.25 179.01 1d1d h ALA 84 N 1.22 0.25 -0.22 0.00 0.00 -0.72 0.15 119.26 119.95 1d1d h ALA 84 Ca 0.14 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 55.03 1d1d h ALA 84 Cb 0.15 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1d1d h ALA 84 CO -0.18 -0.22 0.15 1.15 0.00 0.00 0.00 179.25 180.15 1d1d h THR 85 N 0.22 0.97 -0.04 0.00 2.02 0.62 -1.73 112.91 114.97 1d1d h THR 85 Ca 0.07 -0.05 -0.17 0.00 0.77 0.00 0.00 66.41 67.02 1d1d h THR 85 Cb 0.06 0.80 0.01 0.00 -1.74 0.00 0.00 68.15 67.29 1d1d h THR 85 CO -0.01 0.03 -0.65 -0.09 0.37 0.00 0.00 175.52 175.17 1d1d h ARG 86 N 0.15 0.51 -4.85 6.66 2.43 0.81 -3.42 114.38 116.68 1d1d h ARG 86 Ca 0.09 -0.50 -0.65 0.00 -0.81 0.00 0.00 59.98 58.11 1d1d h ARG 86 Cb 0.19 0.13 -0.36 0.00 -0.42 0.00 0.00 29.97 29.50 1d1d h ARG 86 CO -0.01 1.13 -0.82 0.34 -1.51 0.00 0.00 179.97 179.10 1d1d s ASP 87 N -6.83 3.71 -0.54 -3.80 2.15 0.44 -5.01 116.67 106.80 1d1d s ASP 87 Ca -0.12 -1.01 -0.06 0.00 0.43 0.00 0.00 52.55 51.79 1d1d s ASP 87 Cb 0.05 -1.43 -0.14 0.00 -0.30 0.00 0.00 42.92 41.09 1d1d s ASP 87 CO 0.84 -0.12 2.69 -0.81 -0.17 0.00 0.00 175.17 177.60 1d1d n PRO 88 N 4.57 2.06 -0.23 4.34 -0.04 -1.22 -3.19 135.00 141.29 1d1d n PRO 88 Ca -0.16 -1.20 0.00 0.00 -0.04 0.00 0.00 63.50 62.10 1d1d n PRO 88 Cb 0.46 -2.19 0.00 0.00 -0.04 0.00 0.00 33.50 31.73 1d1d n PRO 88 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1d1d n ARG 89 N 3.20 0.00 -3.04 0.54 5.12 -1.26 -5.09 116.66 116.13 1d1d n ARG 89 Ca 0.44 -0.64 -0.39 0.00 -1.93 0.00 0.00 57.85 55.33 1d1d n ARG 89 Cb 0.46 -0.44 -0.06 0.00 -1.16 0.00 0.00 32.46 31.27 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 0.00 3.87 -0.11 -1.55 3.76 -1.19 -4.96 115.29 115.11 1d1d s HIS 90 Ca 0.00 1.56 0.26 0.00 -0.15 0.00 0.00 55.06 56.73 1d1d s HIS 90 Cb 0.00 -2.71 0.77 0.00 1.11 0.00 0.00 32.58 31.74 1d1d s HIS 90 CO 0.00 0.52 1.76 -1.00 -0.85 0.00 0.00 174.74 175.17 1d1d h PRO 91 N 4.29 0.00 0.00 8.40 0.13 -1.95 -2.85 132.00 140.03 1d1d h PRO 91 Ca -0.48 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.65 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 0.65 0.10 -0.04 0.00 -0.23 0.00 0.00 178.00 178.49 1d1d h ALA 92 N 1.90 1.16 -2.58 -0.56 0.00 -1.94 -3.42 119.26 113.81 1d1d h ALA 92 Ca -0.00 -0.03 -0.55 0.00 0.00 0.00 0.00 54.91 54.33 1d1d h ALA 92 Cb 0.83 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 1d1d h ALA 92 CO 0.01 0.05 -0.41 0.54 0.00 0.00 0.00 179.25 179.44 1d1d s ASN 93 N -5.70 6.36 0.00 0.00 2.20 -1.08 -4.29 114.94 112.43 1d1d s ASN 93 Ca -0.03 0.29 0.00 0.00 -0.94 0.00 0.00 52.86 52.17 1d1d s ASN 93 Cb 0.13 -1.96 0.00 0.00 -2.00 0.00 0.00 41.25 37.41 1d1d s ASN 93 CO 0.51 0.03 0.00 0.61 -2.94 0.00 0.00 177.10 175.30 1d1d n GLY 94 N -0.49 0.30 0.14 0.45 0.00 -1.26 -4.85 105.19 99.48 1d1d n GLY 94 Ca -0.06 -0.05 -0.04 0.00 0.00 0.00 0.00 46.02 45.87 1d1d n GLY 94 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1d1d h GLN 95 N 0.00 -0.26 0.00 1.61 5.75 -1.96 -3.47 115.11 116.79 1d1d h GLN 95 Ca 0.00 0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.52 1d1d h GLN 95 Cb 0.00 0.06 0.00 0.00 1.07 0.00 0.00 27.48 28.61 1d1d h GLN 95 CO 0.00 -0.17 0.00 0.41 -2.65 0.00 0.00 178.83 176.42 1d1d n GLY 96 N 1.03 1.01 0.69 2.39 0.00 -1.26 -4.94 105.19 104.11 1d1d n GLY 96 Ca -0.03 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.11 1d1d n GLY 96 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1d1d n ARG 97 N 0.00 1.89 0.00 1.61 1.74 -1.26 -4.68 116.66 115.96 1d1d n ARG 97 Ca 0.00 -1.39 0.00 0.00 -0.77 0.00 0.00 57.85 55.69 1d1d n ARG 97 Cb 0.00 -1.47 0.00 0.00 -1.02 0.00 0.00 32.46 29.97 1d1d n ARG 97 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1d1d n GLY 98 N 1.29 0.00 1.48 -0.13 0.00 -1.26 -5.08 105.19 101.49 1d1d n GLY 98 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1d1d n GLY 98 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1d1d n GLU 99 N 0.00 0.00 -1.58 1.61 4.07 -1.26 -5.04 120.64 118.44 1d1d n GLU 99 Ca 0.00 0.00 0.03 0.00 -0.06 0.00 0.00 57.16 57.13 1d1d n GLU 99 Cb 0.00 0.00 -0.02 0.00 -0.06 0.00 0.00 31.44 31.36 1d1d n GLU 99 CO 0.00 0.00 0.00 -2.13 -0.06 0.00 0.00 177.13 174.94 1d1d n ARG 100 N -2.11 -4.02 -2.50 5.31 0.63 -1.26 -4.85 116.66 107.86 1d1d n ARG 100 Ca 0.00 3.15 -0.35 0.00 -0.92 0.00 0.00 57.85 59.73 1d1d n ARG 100 Cb 0.00 -4.04 -0.03 0.00 0.45 0.00 0.00 32.46 28.84 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 -5.25 3.66 0.05 5.15 -1.32 -1.26 -4.44 115.64 112.24 1d1d s THR 101 Ca 0.00 1.16 0.05 0.00 -1.21 0.00 0.00 61.69 61.69 1d1d s THR 101 Cb 0.00 -3.54 -0.02 0.00 -1.51 0.00 0.00 72.50 67.42 1d1d s THR 101 CO 0.00 -0.11 -0.14 0.21 -2.21 0.00 0.00 174.62 172.38 1d1d s ASN 102 N -1.73 1.64 0.11 8.08 3.84 -1.26 -4.97 114.94 120.65 1d1d s ASN 102 Ca 0.63 -0.52 -0.18 0.00 0.21 0.00 0.00 52.86 53.00 1d1d s ASN 102 Cb -0.20 -0.08 -0.05 0.00 -0.55 0.00 0.00 41.25 40.37 1d1d s ASN 102 CO 0.25 -0.02 1.61 0.25 -2.79 0.00 0.00 177.10 176.40 1d1d h LEU 103 N 4.65 0.46 -1.22 3.21 5.85 -1.97 -2.43 115.31 123.87 1d1d h LEU 103 Ca -0.39 -0.22 0.06 0.00 0.84 0.00 0.00 57.88 58.17 1d1d h LEU 103 Cb 1.19 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 42.04 1d1d h LEU 103 CO 0.42 0.56 0.55 -0.78 -0.34 0.00 0.00 178.44 178.86 1d1d h ASP 104 N 0.34 0.83 -0.85 1.25 1.82 -1.98 0.78 116.42 118.60 1d1d h ASP 104 Ca 0.10 0.00 0.17 0.00 -0.39 0.00 0.00 57.03 56.91 1d1d h ASP 104 Cb 0.28 -0.17 -0.06 0.00 0.68 0.00 0.00 39.33 40.05 1d1d h ASP 104 CO -0.00 0.54 0.56 0.03 -1.61 0.00 0.00 179.24 178.76 1d1d h ARG 105 N 0.95 0.45 0.00 0.28 3.08 -1.85 0.20 114.38 117.48 1d1d h ARG 105 Ca 0.36 -0.03 -0.26 0.00 0.07 0.00 0.00 59.98 60.13 1d1d h ARG 105 Cb 0.20 -0.10 -0.04 0.00 0.08 0.00 0.00 29.97 30.11 1d1d h ARG 105 CO -0.13 0.30 -1.42 -0.07 -1.07 0.00 0.00 179.97 177.58 1d1d h LEU 106 N 0.47 0.00 -0.84 3.04 3.38 -0.87 -3.33 115.31 117.16 1d1d h LEU 106 Ca 0.43 0.00 0.21 0.00 0.09 0.00 0.00 57.88 58.61 1d1d h LEU 106 Cb 0.97 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 41.59 1d1d h LEU 106 CO -0.16 1.00 0.26 0.11 0.09 0.00 0.00 178.44 179.73 1d1d h LYS 107 N 0.00 0.27 0.00 1.13 1.79 0.15 -3.43 116.57 116.48 1d1d h LYS 107 Ca -0.17 -0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.28 1d1d h LYS 107 Cb 1.91 -0.06 0.00 0.00 -1.58 0.00 0.00 32.23 32.50 1d1d h LYS 107 CO 0.10 0.18 0.00 0.41 -1.08 0.00 0.00 179.45 179.06 1d1d n GLY 108 N -1.36 0.84 0.74 3.86 0.00 -1.00 -4.56 105.19 103.70 1d1d n GLY 108 Ca 0.19 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.32 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 2.21 -4.72 0.99 -0.00 -1.25 -4.03 117.00 110.19 1d1d n LEU 109 Ca 0.00 -0.94 -0.43 0.00 -0.00 0.00 0.00 56.01 54.65 1d1d n LEU 109 Cb 0.00 -0.15 -0.03 0.00 -0.00 0.00 0.00 43.42 43.24 1d1d n LEU 109 CO 0.00 0.47 1.28 0.00 -0.00 0.00 0.00 177.39 179.14 1d1d n ALA 110 N 0.68 2.42 -1.54 1.96 0.00 -1.26 -4.69 120.51 118.09 1d1d n ALA 110 Ca 0.17 0.40 -0.50 0.00 0.00 0.00 0.00 53.44 53.51 1d1d n ALA 110 Cb 0.41 -2.46 -0.04 0.00 0.00 0.00 0.00 19.45 17.36 1d1d n ALA 110 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1d1d n ASP 111 N 3.14 0.70 0.00 0.00 5.75 -1.26 0.83 116.55 125.71 1d1d n ASP 111 Ca 0.13 1.15 0.00 0.00 -0.01 0.00 0.00 54.79 56.06 1d1d n ASP 111 Cb 0.34 -1.13 0.00 0.00 -1.03 0.00 0.00 41.12 39.30 1d1d n ASP 111 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1d1d n GLY 112 N 1.88 3.04 0.64 6.12 0.00 -1.26 -4.75 105.19 110.86 1d1d n GLY 112 Ca 0.16 0.00 0.10 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 1.67 -3.31 1.61 2.81 0.24 -4.36 117.12 113.78 1d1d n MET 113 Ca 0.00 -1.34 -0.39 0.00 -1.81 0.00 0.00 57.70 54.16 1d1d n MET 113 Cb 0.00 -1.40 -0.08 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 -2.00 5.14 0.00 2.03 1.01 -1.16 -3.80 120.40 121.61 1d1d s VAL 114 Ca 0.20 0.77 0.00 0.00 0.00 0.00 0.00 61.98 62.96 1d1d s VAL 114 Cb 0.17 -3.77 0.00 0.00 0.00 0.00 0.00 36.38 32.77 1d1d s VAL 114 CO 0.38 0.16 0.00 0.61 0.00 0.00 0.00 175.10 176.26 1d1d n GLY 115 N 4.24 0.82 2.98 4.51 0.00 -1.26 -4.98 105.19 111.51 1d1d n GLY 115 Ca -0.06 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.65 1d1d n GLY 115 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1d1d s ASN 116 N -2.73 4.25 0.00 1.61 -0.87 -1.25 -5.03 114.94 110.92 1d1d s ASN 116 Ca 0.00 -1.49 0.00 0.00 -1.57 0.00 0.00 52.86 49.80 1d1d s ASN 116 Cb 0.00 -1.37 0.00 0.00 -0.02 0.00 0.00 41.25 39.86 1d1d s ASN 116 CO 0.00 -0.27 0.16 -0.81 -2.57 0.00 0.00 177.10 173.61 1d1d n PRO 117 N 4.52 0.00 -0.21 -0.60 -0.04 -1.26 -1.43 135.00 135.98 1d1d n PRO 117 Ca -0.08 0.14 0.15 0.00 -0.04 0.00 0.00 63.50 63.66 1d1d n PRO 117 Cb 0.43 -0.77 0.46 0.00 -0.04 0.00 0.00 33.50 33.58 1d1d n PRO 117 CO 0.00 0.00 0.00 -0.56 -0.04 0.00 0.00 175.50 174.90 1d1d h GLN 118 N 0.00 0.50 -0.54 0.54 3.07 -1.99 0.97 115.11 117.67 1d1d h GLN 118 Ca 0.00 -0.03 -0.11 0.00 0.09 0.00 0.00 58.65 58.60 1d1d h GLN 118 Cb 0.00 -0.11 -0.02 0.00 0.08 0.00 0.00 27.48 27.43 1d1d h GLN 118 CO 0.00 0.33 -0.09 0.78 0.09 0.00 0.00 178.83 179.94 1d1d h GLY 119 N 0.51 1.08 0.95 0.06 0.00 -1.91 -1.05 103.07 102.72 1d1d h GLY 119 Ca 0.41 -0.85 -0.04 0.00 0.00 0.00 0.00 47.33 46.85 1d1d h GLY 119 CO -0.16 0.78 0.11 -1.61 0.00 0.00 0.00 176.54 175.66 1d1d h GLN 120 N 0.90 0.72 -0.27 4.80 4.15 0.33 0.36 115.11 126.10 1d1d h GLN 120 Ca 0.14 -0.17 -0.06 0.00 0.77 0.00 0.00 58.65 59.33 1d1d h GLN 120 Cb 0.64 -0.09 -0.02 0.00 0.21 0.00 0.00 27.48 28.22 1d1d h GLN 120 CO 0.04 0.72 -0.09 0.00 -1.93 0.00 0.00 178.83 177.57 1d1d h ALA 121 N 0.97 1.35 0.00 3.38 0.00 -1.10 0.17 119.26 124.03 1d1d h ALA 121 Ca 0.14 -0.23 -0.09 0.00 0.00 0.00 0.00 54.91 54.73 1d1d h ALA 121 Cb 0.33 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1d1d h ALA 121 CO 0.00 0.44 -0.43 0.00 0.00 0.00 0.00 179.25 179.27 1d1d h ALA 122 N 1.50 0.79 0.03 0.00 0.00 -0.69 -3.06 119.26 117.83 1d1d h ALA 122 Ca 0.08 -0.39 -0.22 0.00 0.00 0.00 0.00 54.91 54.39 1d1d h ALA 122 Cb 0.41 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1d1d h ALA 122 CO 0.02 0.53 -1.02 1.25 0.00 0.00 0.00 179.25 180.04 1d1d h LEU 123 N 0.00 0.13-10.75 0.00 6.46 0.91 -3.46 115.31 108.60 1d1d h LEU 123 Ca -0.00 -0.13 -0.46 0.00 -0.12 0.00 0.00 57.88 57.17 1d1d h LEU 123 Cb 1.19 -0.04 0.12 0.00 -0.73 0.00 0.00 40.66 41.19 1d1d h LEU 123 CO 0.06 1.06 0.24 -0.76 -0.62 0.00 0.00 178.44 178.42 1d1d s LEU 124 N -6.96 2.86 0.21 2.25 1.43 0.48 -5.07 118.68 113.87 1d1d s LEU 124 Ca -0.01 -0.08 0.07 0.00 -1.03 0.00 0.00 54.13 53.08 1d1d s LEU 124 Cb 0.09 -2.14 -0.04 0.00 0.03 0.00 0.00 46.19 44.14 1d1d s LEU 124 CO 0.83 -2.22 0.07 0.00 0.23 0.00 0.00 176.35 175.26 1d1d s ARG 125 N -5.46 2.60 -0.45 1.70 1.70 -1.26 -4.91 118.95 112.87 1d1d s ARG 125 Ca 0.69 -1.10 -0.29 0.00 -0.47 0.00 0.00 55.73 54.56 1d1d s ARG 125 Cb -0.05 -2.42 0.01 0.00 -0.57 0.00 0.00 34.95 31.92 1d1d s ARG 125 CO 0.48 0.43 1.43 -1.25 -1.08 0.00 0.00 175.30 175.31 1d1d s PRO 126 N -3.30 3.49 0.00 3.89 0.04 -1.26 -3.16 135.00 134.69 1d1d s PRO 126 Ca 0.30 0.84 0.00 0.00 0.04 0.00 0.00 61.00 62.18 1d1d s PRO 126 Cb -0.09 -4.06 0.00 0.00 0.04 0.00 0.00 34.50 30.40 1d1d s PRO 126 CO 0.21 -1.67 0.00 0.41 0.04 0.00 0.00 177.00 175.99 1d1d n GLY 127 N 5.14 3.26 0.21 0.56 0.00 -1.26 -4.96 105.19 108.15 1d1d n GLY 127 Ca 0.16 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.74 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 0.20 -0.10 1.61 5.08 -1.88 -2.36 114.58 117.14 1d1d h GLU 128 Ca 0.00 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1d1d h GLU 128 Cb 0.00 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.23 1d1d h GLU 128 CO 0.00 0.49 0.06 -0.07 -1.00 0.00 0.00 179.01 178.49 1d1d h LEU 129 N 0.18 0.11 -1.03 1.33 3.38 -1.81 -0.17 115.31 117.29 1d1d h LEU 129 Ca 0.02 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1d1d h LEU 129 Cb 0.63 -0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.31 1d1d h LEU 129 CO 0.05 0.08 0.58 0.58 0.09 0.00 0.00 178.44 179.82 1d1d h VAL 130 N 0.13 1.25 -0.60 1.22 2.07 -1.79 0.24 116.25 118.76 1d1d h VAL 130 Ca 0.04 -0.51 0.03 0.00 0.82 0.00 0.00 66.70 67.08 1d1d h VAL 130 Cb -0.01 -0.08 -0.04 0.00 -1.52 0.00 0.00 31.29 29.64 1d1d h VAL 130 CO -0.01 0.25 0.36 0.00 0.02 0.00 0.00 177.57 178.19 1d1d h ALA 131 N 1.37 0.78 -0.41 1.67 0.00 -0.85 0.64 119.26 122.47 1d1d h ALA 131 Ca 0.33 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 55.10 1d1d h ALA 131 Cb -0.09 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 1d1d h ALA 131 CO -0.07 0.07 -0.28 0.82 0.00 0.00 0.00 179.25 179.80 1d1d h ILE 132 N 0.69 1.27 -0.48 0.00 2.04 -0.15 0.13 117.51 121.02 1d1d h ILE 132 Ca 0.25 -1.44 -0.03 0.00 1.00 0.00 0.00 64.86 64.64 1d1d h ILE 132 Cb 0.06 1.26 -0.02 0.00 -0.74 0.00 0.00 36.82 37.37 1d1d h ILE 132 CO -0.12 0.48 0.18 0.74 0.00 0.00 0.00 178.15 179.43 1d1d h THR 133 N 0.74 1.22 -0.10 -0.27 2.02 0.43 0.26 112.91 117.21 1d1d h THR 133 Ca 0.09 -0.69 -0.03 0.00 0.77 0.00 0.00 66.41 66.55 1d1d h THR 133 Cb 0.84 0.76 -0.00 0.00 -1.74 0.00 0.00 68.15 68.01 1d1d h THR 133 CO 0.07 0.25 -0.04 0.00 0.37 0.00 0.00 175.52 176.18 1d1d h ALA 134 N 1.03 0.15 -0.47 6.16 0.00 0.39 -2.05 119.26 124.47 1d1d h ALA 134 Ca 0.16 -0.24 0.04 0.00 0.00 0.00 0.00 54.91 54.87 1d1d h ALA 134 Cb 0.22 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 1d1d h ALA 134 CO -0.01 -0.10 0.31 0.77 0.00 0.00 0.00 179.25 180.22 1d1d h SER 135 N -0.13 0.43 -0.46 0.00 0.02 -0.59 0.41 113.55 113.23 1d1d h SER 135 Ca 0.02 -0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 60.91 1d1d h SER 135 Cb 0.48 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 62.90 1d1d h SER 135 CO 0.01 0.29 0.06 0.00 -1.14 0.00 0.00 176.83 176.06 1d1d h ALA 136 N 1.73 0.61 -0.45 3.77 0.00 -0.23 -0.30 119.26 124.39 1d1d h ALA 136 Ca 0.19 -0.24 -0.08 0.00 0.00 0.00 0.00 54.91 54.79 1d1d h ALA 136 Cb 0.14 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1d1d h ALA 136 CO -0.05 0.35 -0.03 -0.07 0.00 0.00 0.00 179.25 179.45 1d1d h LEU 137 N 0.63 0.73 -0.47 0.00 4.07 -0.45 -0.03 115.31 119.79 1d1d h LEU 137 Ca 0.14 -0.18 -0.04 0.00 0.08 0.00 0.00 57.88 57.87 1d1d h LEU 137 Cb 0.41 -0.19 -0.02 0.00 1.08 0.00 0.00 40.66 41.94 1d1d h LEU 137 CO 0.01 0.82 0.13 1.56 -1.08 0.00 0.00 178.44 179.88 1d1d h GLN 138 N 0.70 0.74 -0.12 1.13 1.08 -0.57 -1.75 115.11 116.33 1d1d h GLN 138 Ca 0.13 -0.17 -0.09 0.00 -1.45 0.00 0.00 58.65 57.08 1d1d h GLN 138 Cb 0.47 -0.10 -0.01 0.00 -0.05 0.00 0.00 27.48 27.79 1d1d h GLN 138 CO 0.02 0.72 -0.33 0.00 -0.95 0.00 0.00 178.83 178.29 1d1d h ALA 139 N 0.99 1.22 -0.08 3.87 0.00 -0.73 -2.60 119.26 121.94 1d1d h ALA 139 Ca 0.15 -0.35 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 1d1d h ALA 139 Cb 0.30 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 1d1d h ALA 139 CO -0.00 0.52 0.04 0.35 0.00 0.00 0.00 179.25 180.16 1d1d h PHE 140 N 0.21 0.12 -0.13 0.00 3.04 -0.47 -2.27 116.94 117.44 1d1d h PHE 140 Ca 0.03 -0.00 -0.02 0.00 3.98 0.00 0.00 57.97 61.96 1d1d h PHE 140 Cb 0.69 -0.04 -0.01 0.00 2.56 0.00 0.00 35.95 39.15 1d1d h PHE 140 CO 0.01 0.17 0.01 0.00 -2.02 0.00 0.00 178.31 176.48 1d1d h ARG 141 N 0.03 0.18 -0.73 1.11 3.08 -1.18 0.23 114.38 117.09 1d1d h ARG 141 Ca 0.03 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 60.04 1d1d h ARG 141 Cb 0.10 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.08 1d1d h ARG 141 CO -0.00 0.19 0.39 1.49 -1.07 0.00 0.00 179.97 180.96 1d1d h GLU 142 N 0.18 1.03 0.08 0.04 4.57 -1.03 0.35 114.58 119.80 1d1d h GLU 142 Ca 0.04 -0.13 -0.21 0.00 -1.18 0.00 0.00 59.36 57.89 1d1d h GLU 142 Cb 0.12 -0.20 0.02 0.00 -0.16 0.00 0.00 28.75 28.53 1d1d h GLU 142 CO 0.00 0.77 -0.86 0.28 -1.18 0.00 0.00 179.01 178.03 1d1d h VAL 143 N 1.01 1.42 -0.24 0.32 2.07 -0.89 -2.51 116.25 117.42 1d1d h VAL 143 Ca 0.26 -2.35 0.05 0.00 0.82 0.00 0.00 66.70 65.48 1d1d h VAL 143 Cb 0.06 2.84 -0.05 0.00 -1.52 0.00 0.00 31.29 32.62 1d1d h VAL 143 CO -0.04 0.68 -0.06 0.00 0.02 0.00 0.00 177.57 178.18 1d1d h ALA 144 N 0.22 0.16 -0.78 1.67 0.00 -0.39 -1.54 119.26 118.61 1d1d h ALA 144 Ca -0.13 0.09 0.01 0.00 0.00 0.00 0.00 54.91 54.88 1d1d h ALA 144 Cb 1.60 0.18 -0.04 0.00 0.00 0.00 0.00 17.79 19.53 1d1d h ALA 144 CO 0.16 -0.47 0.51 0.00 0.00 0.00 0.00 179.25 179.46 1d1d h ARG 145 N 0.00 1.03 -5.91 0.00 3.08 -0.38 -3.40 114.38 108.79 1d1d h ARG 145 Ca 0.12 -0.06 -0.56 0.00 0.07 0.00 0.00 59.98 59.54 1d1d h ARG 145 Cb 0.18 -0.23 0.00 0.00 0.08 0.00 0.00 29.97 30.00 1d1d h ARG 145 CO -0.25 0.68 1.52 -1.17 -1.07 0.00 0.00 179.97 179.69 1d1d s LEU 146 N -10.13 3.43 -0.43 3.04 1.98 -0.58 -4.84 118.68 111.14 1d1d s LEU 146 Ca -0.13 1.71 0.07 0.00 -2.89 0.00 0.00 54.13 52.89 1d1d s LEU 146 Cb 0.15 -3.30 0.18 0.00 0.66 0.00 0.00 46.19 43.88 1d1d s LEU 146 CO 0.78 -2.16 0.60 0.00 -1.89 0.00 0.00 176.35 173.68 1d1d s ALA 147 N 9.15 -1.91 0.08 5.97 0.00 -1.26 -4.91 121.76 128.88 1d1d s ALA 147 Ca 1.00 -0.18 0.08 0.00 0.00 0.00 0.00 51.96 52.86 1d1d s ALA 147 Cb -0.29 -2.59 -0.04 0.00 0.00 0.00 0.00 23.12 20.20 1d1d s ALA 147 CO 0.33 -2.21 -0.19 -1.21 0.00 0.00 0.00 175.76 172.49 1d1d s GLU 148 N 1.54 1.91 -0.36 0.00 0.41 -1.26 -5.08 118.70 115.85 1d1d s GLU 148 Ca 0.19 -1.09 -0.29 0.00 -0.41 0.00 0.00 54.97 53.38 1d1d s GLU 148 Cb -0.05 -2.14 0.00 0.00 -1.78 0.00 0.00 34.13 30.17 1d1d s GLU 148 CO -0.06 0.51 1.38 -1.25 -0.49 0.00 0.00 175.26 175.35 1d1d s PRO 149 N -1.78 3.70 0.09 0.39 0.04 -1.26 -5.00 135.00 131.17 1d1d s PRO 149 Ca 0.16 1.08 0.01 0.00 0.04 0.00 0.00 61.00 62.28 1d1d s PRO 149 Cb -0.10 -3.98 -0.04 0.00 0.04 0.00 0.00 34.50 30.42 1d1d s PRO 149 CO 0.07 -1.40 0.23 0.00 0.04 0.00 0.00 177.00 175.95 1d1d s ALA 150 N 5.06 4.00 -0.35 8.56 0.00 -1.26 -4.71 121.76 133.05 1d1d s ALA 150 Ca 0.60 -0.89 -0.21 0.00 0.00 0.00 0.00 51.96 51.46 1d1d s ALA 150 Cb -0.15 -1.82 0.03 0.00 0.00 0.00 0.00 23.12 21.18 1d1d s ALA 150 CO 0.29 0.75 0.45 0.41 0.00 0.00 0.00 175.76 177.66 1d1d n GLY 151 N 0.06 -0.89 0.11 0.00 0.00 -1.26 -4.91 105.19 98.29 1d1d n GLY 151 Ca -0.05 0.92 -0.15 0.00 0.00 0.00 0.00 46.02 46.73 1d1d n GLY 151 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1d1d h PRO 152 N 2.44 0.23 -0.84 1.61 0.13 -1.93 -3.11 132.00 130.52 1d1d h PRO 152 Ca -0.23 -0.22 0.23 0.00 -0.87 0.00 0.00 66.00 64.92 1d1d h PRO 152 Cb 1.04 0.06 -0.04 0.00 0.13 0.00 0.00 31.00 32.18 1d1d h PRO 152 CO 0.17 0.92 0.60 0.11 -0.23 0.00 0.00 178.00 179.56 1d1d h TRP 153 N -0.38 0.11 -0.15 1.56 0.09 -1.90 1.47 115.95 116.74 1d1d h TRP 153 Ca -0.03 0.00 -0.04 0.00 0.09 0.00 0.00 58.89 58.92 1d1d h TRP 153 Cb 1.00 -0.03 -0.01 0.00 0.08 0.00 0.00 29.16 30.20 1d1d h TRP 153 CO 0.16 0.03 -0.07 0.00 0.09 0.00 0.00 178.44 178.65 1d1d h ALA 154 N 1.59 1.61 0.00 0.11 0.00 -1.89 -0.20 119.26 120.48 1d1d h ALA 154 Ca 0.41 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 55.12 1d1d h ALA 154 Cb 1.50 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.21 1d1d h ALA 154 CO -0.04 0.29 -0.20 0.22 0.00 0.00 0.00 179.25 179.52 1d1d h ASP 155 N 0.22 0.00 -3.24 0.00 3.58 0.20 -3.43 116.42 113.75 1d1d h ASP 155 Ca 0.05 0.00 -0.59 0.00 0.42 0.00 0.00 57.03 56.91 1d1d h ASP 155 Cb 0.27 0.00 -0.08 0.00 1.72 0.00 0.00 39.33 41.24 1d1d h ASP 155 CO 0.01 0.20 0.54 -0.63 -2.88 0.00 0.00 179.24 176.48 1d1d s ILE 156 N -3.15 4.80 0.03 2.25 1.01 -0.09 -5.03 121.20 121.02 1d1d s ILE 156 Ca 0.05 1.70 0.04 0.00 0.00 0.00 0.00 60.65 62.45 1d1d s ILE 156 Cb 0.06 -4.17 -0.02 0.00 0.01 0.00 0.00 42.46 38.34 1d1d s ILE 156 CO 0.69 -0.08 -0.12 0.42 0.00 0.00 0.00 174.94 175.85 1d1d s THR 157 N 2.80 0.97 -0.16 2.92 -4.23 -1.26 -4.91 115.64 111.77 1d1d s THR 157 Ca 0.38 -0.86 -0.29 0.00 -1.18 0.00 0.00 61.69 59.74 1d1d s THR 157 Cb -0.15 -0.88 -0.00 0.00 1.34 0.00 0.00 72.50 72.81 1d1d s THR 157 CO 0.08 0.02 1.05 -1.58 -0.54 0.00 0.00 174.62 173.65 1d1d s GLN 158 N -0.95 4.33 0.31 3.99 -0.44 -1.24 -5.04 119.66 120.63 1d1d s GLN 158 Ca 0.01 1.41 0.08 0.00 -2.50 0.00 0.00 55.36 54.36 1d1d s GLN 158 Cb -0.07 -3.60 -0.04 0.00 -1.64 0.00 0.00 33.01 27.66 1d1d s GLN 158 CO 0.01 -0.49 0.11 0.20 0.50 0.00 0.00 175.29 175.61 1d1d s GLY 159 N 1.22 1.83 0.46 2.59 0.00 -1.26 -4.37 107.32 107.78 1d1d s GLY 159 Ca 0.47 -1.75 0.26 0.00 0.00 0.00 0.00 44.72 43.70 1d1d s GLY 159 CO 0.12 -1.72 1.76 -0.56 0.00 0.00 0.00 173.10 172.70 1d1d h PRO 160 N 1.63 0.00 0.01 2.90 0.13 -1.99 -2.98 132.00 131.69 1d1d h PRO 160 Ca -0.44 0.00 -0.22 0.00 -0.87 0.00 0.00 66.00 64.47 1d1d h PRO 160 Cb 1.25 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.35 1d1d h PRO 160 CO 0.62 0.11 -1.07 1.03 -0.23 0.00 0.00 178.00 178.46 1d1d h SER 161 N 0.00 0.02 -3.08 1.44 0.87 -2.01 -3.44 113.55 107.35 1d1d h SER 161 Ca -0.00 -0.02 -0.65 0.00 -1.23 0.00 0.00 61.79 59.89 1d1d h SER 161 Cb 0.83 -0.01 -0.12 0.00 -0.44 0.00 0.00 62.40 62.66 1d1d h SER 161 CO 0.01 1.02 -0.54 -0.70 -0.53 0.00 0.00 176.83 176.09 1d1d s GLU 162 N -2.70 3.60 0.23 2.24 2.56 -1.13 -5.06 118.70 118.45 1d1d s GLU 162 Ca 0.00 -0.27 -0.32 0.00 0.00 0.00 0.00 54.97 54.38 1d1d s GLU 162 Cb 0.10 -3.13 -0.13 0.00 2.00 0.00 0.00 34.13 32.97 1d1d s GLU 162 CO 0.82 0.54 1.56 0.45 -0.56 0.00 0.00 175.26 178.08 1d1d n SER 163 N 2.69 3.38 0.08 -1.70 2.88 -1.26 -4.30 113.62 115.40 1d1d n SER 163 Ca -0.18 1.11 -0.12 0.00 -1.33 0.00 0.00 58.87 58.36 1d1d n SER 163 Cb 0.53 -1.50 -0.05 0.00 -0.75 0.00 0.00 64.21 62.44 1d1d n SER 163 CO 0.00 0.00 0.00 0.15 -1.23 0.00 0.00 175.04 173.96 1d1d h PHE 164 N 5.26 -0.40 -0.19 0.66 3.57 -1.96 0.67 116.94 124.55 1d1d h PHE 164 Ca -0.45 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.06 1d1d h PHE 164 Cb 1.24 0.17 -0.01 0.00 2.79 0.00 0.00 35.95 40.14 1d1d h PHE 164 CO 0.60 -0.23 0.12 -0.24 -2.23 0.00 0.00 178.31 176.33 1d1d h VAL 165 N -0.28 1.03 -0.62 1.41 3.04 -1.96 0.51 116.25 119.37 1d1d h VAL 165 Ca 0.04 -0.08 0.06 0.00 -1.01 0.00 0.00 66.70 65.70 1d1d h VAL 165 Cb 0.32 0.77 -0.05 0.00 -2.01 0.00 0.00 31.29 30.32 1d1d h VAL 165 CO -0.11 0.04 0.33 -0.78 -1.01 0.00 0.00 177.57 176.04 1d1d h ASP 166 N 0.24 0.47 -0.54 3.17 1.82 -1.84 -1.27 116.42 118.47 1d1d h ASP 166 Ca 0.07 0.03 -0.09 0.00 -0.39 0.00 0.00 57.03 56.66 1d1d h ASP 166 Cb -0.01 -0.05 -0.02 0.00 0.68 0.00 0.00 39.33 39.92 1d1d h ASP 166 CO -0.03 0.31 0.00 0.15 -1.61 0.00 0.00 179.24 178.06 1d1d h PHE 167 N 0.61 1.07 -0.58 0.28 3.57 0.99 -2.28 116.94 120.60 1d1d h PHE 167 Ca 0.28 -0.17 0.09 0.00 3.53 0.00 0.00 57.97 61.69 1d1d h PHE 167 Cb 0.19 -0.28 -0.03 0.00 2.79 0.00 0.00 35.95 38.62 1d1d h PHE 167 CO -0.09 0.95 0.39 0.00 -2.23 0.00 0.00 178.31 177.32 1d1d h ALA 168 N 1.08 1.97 -0.02 2.41 0.00 0.11 0.39 119.26 125.21 1d1d h ALA 168 Ca 0.17 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 1d1d h ALA 168 Cb 0.53 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 1d1d h ALA 168 CO 0.03 -0.09 -0.01 -0.91 0.00 0.00 0.00 179.25 178.26 1d1d h ASN 169 N 0.43 0.05 -0.68 0.00 2.35 -0.77 0.48 115.58 117.44 1d1d h ASN 169 Ca 0.26 -0.46 -0.00 0.00 -0.55 0.00 0.00 56.30 55.55 1d1d h ASN 169 Cb 0.46 -0.01 -0.03 0.00 0.05 0.00 0.00 38.32 38.79 1d1d h ASN 169 CO -0.07 0.50 0.42 0.03 -1.65 0.00 0.00 177.43 176.66 1d1d h ARG 170 N -0.41 0.93 -0.02 0.81 2.47 -0.85 0.43 114.38 117.73 1d1d h ARG 170 Ca 0.00 -0.07 -0.02 0.00 -1.26 0.00 0.00 59.98 58.63 1d1d h ARG 170 Cb 0.48 -0.20 0.00 0.00 -1.65 0.00 0.00 29.97 28.61 1d1d h ARG 170 CO 0.00 0.64 -0.06 1.25 0.56 0.00 0.00 179.97 182.37 1d1d h LEU 171 N 0.95 0.09 -0.45 3.04 6.46 -0.18 -1.29 115.31 123.92 1d1d h LEU 171 Ca 0.25 -0.61 0.05 0.00 -0.12 0.00 0.00 57.88 57.45 1d1d h LEU 171 Cb -0.05 -0.03 -0.05 0.00 -0.73 0.00 0.00 40.66 39.81 1d1d h LEU 171 CO -0.05 0.69 0.18 0.40 -0.62 0.00 0.00 178.44 179.04 1d1d h ILE 172 N -0.50 0.89 -0.99 4.05 2.04 0.35 0.32 117.51 123.67 1d1d h ILE 172 Ca -0.00 -0.13 0.01 0.00 1.00 0.00 0.00 64.86 65.74 1d1d h ILE 172 Cb 0.68 0.49 -0.05 0.00 -0.74 0.00 0.00 36.82 37.20 1d1d h ILE 172 CO 0.01 0.07 0.65 0.11 0.00 0.00 0.00 178.15 178.99 1d1d h LYS 173 N 0.37 1.31 -0.41 2.37 1.57 -0.18 0.49 116.57 122.10 1d1d h LYS 173 Ca 0.21 -0.09 -0.02 0.00 -1.87 0.00 0.00 60.65 58.88 1d1d h LYS 173 Cb 0.17 -0.29 -0.02 0.00 0.08 0.00 0.00 32.23 32.17 1d1d h LYS 173 CO -0.19 0.88 0.16 0.00 -0.57 0.00 0.00 179.45 179.73 1d1d h ALA 174 N 1.36 0.53 -0.56 3.86 0.00 0.09 -2.41 119.26 122.13 1d1d h ALA 174 Ca 0.36 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 55.05 1d1d h ALA 174 Cb -0.14 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 1d1d h ALA 174 CO -0.08 0.14 0.03 0.28 0.00 0.00 0.00 179.25 179.62 1d1d h VAL 175 N 0.52 1.26 -0.91 0.00 2.07 0.36 -1.81 116.25 117.73 1d1d h VAL 175 Ca 0.14 -1.06 0.17 0.00 0.82 0.00 0.00 66.70 66.77 1d1d h VAL 175 Cb 0.19 0.79 -0.08 0.00 -1.52 0.00 0.00 31.29 30.68 1d1d h VAL 175 CO -0.01 0.38 0.59 -0.08 0.02 0.00 0.00 177.57 178.47 1d1d h GLU 176 N 0.88 0.58 -0.53 1.57 4.81 0.42 0.31 114.58 122.62 1d1d h GLU 176 Ca 0.17 -0.03 -0.16 0.00 -0.13 0.00 0.00 59.36 59.20 1d1d h GLU 176 Cb 0.48 -0.13 -0.10 0.00 0.63 0.00 0.00 28.75 29.63 1d1d h GLU 176 CO 0.02 0.38 0.14 0.41 -0.73 0.00 0.00 179.01 179.23 1d1d n GLY 177 N -1.45 4.09 3.81 1.92 0.00 -0.90 -4.97 105.19 107.69 1d1d n GLY 177 Ca 0.19 -1.07 -0.22 0.00 0.00 0.00 0.00 46.02 44.92 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 -1.64 4.97 -1.44 1.61 1.04 0.11 -5.01 113.70 113.35 1d1d s SER 178 Ca 0.49 -0.68 -0.13 0.00 0.48 0.00 0.00 55.95 56.11 1d1d s SER 178 Cb 0.41 -0.77 -0.02 0.00 0.10 0.00 0.00 66.02 65.74 1d1d s SER 178 CO 0.09 -0.41 2.43 -0.67 0.98 0.00 0.00 173.24 175.66 1d1d n ASP 179 N -1.32 5.32 -4.07 7.02 -0.08 -1.26 -4.85 116.55 117.31 1d1d n ASP 179 Ca -0.01 -2.72 -0.20 0.00 -1.51 0.00 0.00 54.79 50.35 1d1d n ASP 179 Cb 0.61 -1.56 -0.15 0.00 2.34 0.00 0.00 41.12 42.36 1d1d n ASP 179 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 1d1d s LEU 180 N 1.40 2.05 0.64 -2.67 1.43 -1.26 -5.10 118.68 115.17 1d1d s LEU 180 Ca 0.55 -0.24 -0.13 0.00 -1.03 0.00 0.00 54.13 53.27 1d1d s LEU 180 Cb 0.15 -0.57 -0.02 0.00 0.03 0.00 0.00 46.19 45.79 1d1d s LEU 180 CO -0.06 0.12 1.05 -2.16 0.23 0.00 0.00 176.35 175.53 1d1d s PRO 181 N -0.41 3.15 -1.19 1.29 0.04 -1.26 -4.92 135.00 131.71 1d1d s PRO 181 Ca 0.04 1.05 -0.21 0.00 0.04 0.00 0.00 61.00 61.92 1d1d s PRO 181 Cb -0.05 -2.02 -0.01 0.00 0.04 0.00 0.00 34.50 32.47 1d1d s PRO 181 CO -0.00 -0.93 1.81 -1.25 0.04 0.00 0.00 177.00 176.66 1d1d s PRO 182 N -4.61 3.22 0.00 0.56 0.04 -1.26 -2.36 135.00 130.59 1d1d s PRO 182 Ca 0.60 -1.42 0.00 0.00 0.04 0.00 0.00 61.00 60.22 1d1d s PRO 182 Cb -0.15 -5.36 0.00 0.00 0.04 0.00 0.00 34.50 29.04 1d1d s PRO 182 CO 0.46 -3.05 0.00 0.45 0.04 0.00 0.00 177.00 174.90 1d1d n SER 183 N 11.36 0.00 0.15 6.66 2.88 -1.26 -4.94 113.62 128.47 1d1d n SER 183 Ca 0.45 0.00 0.12 0.00 -1.33 0.00 0.00 58.87 58.11 1d1d n SER 183 Cb 0.47 0.00 0.13 0.00 -0.75 0.00 0.00 64.21 64.05 1d1d n SER 183 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1d1d h ALA 184 N 0.00 0.76 0.00 -1.46 0.00 -1.85 -3.21 119.26 113.50 1d1d h ALA 184 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1d1d h ALA 184 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1d1d h ALA 184 CO 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 179.25 179.13 1d1d h ARG 185 N 0.00 0.00 0.68 0.00 3.08 -1.90 0.51 114.38 116.76 1d1d h ARG 185 Ca 0.00 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.02 1d1d h ARG 185 Cb 0.95 0.00 0.01 0.00 0.08 0.00 0.00 29.97 31.00 1d1d h ARG 185 CO 0.00 0.12 -0.33 0.00 -1.07 0.00 0.00 179.97 178.69 1d1d h ALA 186 N 1.88 -0.92 -0.04 0.04 0.00 -1.87 0.01 119.26 118.36 1d1d h ALA 186 Ca -0.00 -0.22 -0.23 0.00 0.00 0.00 0.00 54.91 54.46 1d1d h ALA 186 Cb 0.86 0.36 0.01 0.00 0.00 0.00 0.00 17.79 19.01 1d1d h ALA 186 CO 0.02 -0.92 -0.90 -1.00 0.00 0.00 0.00 179.25 176.44 1d1d h PRO 187 N -1.12 0.56 -1.00 0.00 0.13 -1.71 -2.61 132.00 126.25 1d1d h PRO 187 Ca -0.09 -0.55 0.07 0.00 -0.87 0.00 0.00 66.00 64.56 1d1d h PRO 187 Cb 0.74 0.14 -0.07 0.00 0.13 0.00 0.00 31.00 31.94 1d1d h PRO 187 CO 0.15 1.17 0.65 0.28 -0.23 0.00 0.00 178.00 180.02 1d1d h VAL 188 N 0.34 1.08 -0.08 1.56 2.07 -0.94 1.66 116.25 121.94 1d1d h VAL 188 Ca -0.08 -0.40 -0.02 0.00 0.82 0.00 0.00 66.70 67.02 1d1d h VAL 188 Cb 1.53 -0.18 -0.00 0.00 -1.52 0.00 0.00 31.29 31.12 1d1d h VAL 188 CO 0.17 0.21 -0.03 0.40 0.02 0.00 0.00 177.57 178.34 1d1d h ILE 189 N 1.16 1.31 -0.63 4.57 2.04 -0.96 -0.48 117.51 124.52 1d1d h ILE 189 Ca 0.43 -1.01 -0.03 0.00 1.00 0.00 0.00 64.86 65.25 1d1d h ILE 189 Cb 0.19 1.82 -0.03 0.00 -0.74 0.00 0.00 36.82 38.06 1d1d h ILE 189 CO -0.18 0.28 0.27 0.40 0.00 0.00 0.00 178.15 178.92 1d1d h ILE 190 N -0.19 1.23 -0.96 -0.67 2.04 -0.94 -2.15 117.51 115.87 1d1d h ILE 190 Ca 0.02 -0.70 0.03 0.00 1.00 0.00 0.00 64.86 65.21 1d1d h ILE 190 Cb 0.47 0.51 -0.05 0.00 -0.74 0.00 0.00 36.82 37.00 1d1d h ILE 190 CO 0.01 0.28 0.63 0.44 0.00 0.00 0.00 178.15 179.51 1d1d h ASP 191 N 0.88 1.07 -0.60 1.72 3.32 0.25 -1.10 116.42 121.96 1d1d h ASP 191 Ca 0.21 -0.02 0.10 0.00 0.02 0.00 0.00 57.03 57.34 1d1d h ASP 191 Cb 0.18 -0.25 -0.07 0.00 0.22 0.00 0.00 39.33 39.41 1d1d h ASP 191 CO -0.02 0.75 0.21 0.00 -1.72 0.00 0.00 179.24 178.45 1d1d h PHE 193 N 0.38 0.08 -0.33 0.00 0.04 -0.90 -1.80 116.94 114.40 1d1d h PHE 193 Ca 0.30 -0.00 -0.17 0.00 2.80 0.00 0.00 57.97 60.90 1d1d h PHE 193 Cb 0.39 -0.02 -0.10 0.00 2.20 0.00 0.00 35.95 38.41 1d1d h PHE 193 CO -0.18 0.15 -0.11 2.89 -0.60 0.00 0.00 178.31 180.46 1d1d n ARG 194 N -4.41 1.81 -0.00 1.51 1.85 0.94 -4.06 116.66 114.30 1d1d n ARG 194 Ca -0.02 -3.21 -0.00 0.00 -1.00 0.00 0.00 57.85 53.62 1d1d n ARG 194 Cb 0.18 -1.81 -0.00 0.00 -1.05 0.00 0.00 32.46 29.78 1d1d n ARG 194 CO 0.00 0.00 0.00 1.04 -0.01 0.00 0.00 177.63 178.66 1d1d n GLN 195 N -1.13 0.01 -2.98 2.89 6.02 0.52 -4.90 117.38 117.80 1d1d n GLN 195 Ca 0.33 0.00 -0.15 0.00 -0.01 0.00 0.00 57.00 57.17 1d1d n GLN 195 Cb 1.02 -1.00 0.01 0.00 1.02 0.00 0.00 30.24 31.30 1d1d n GLN 195 CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 177.06 176.41 1d1d n LYS 196 N -2.52 0.92 -3.88 -1.09 2.85 -1.01 -5.05 118.16 108.39 1d1d n LYS 196 Ca -0.01 -2.65 -0.09 0.00 -1.05 0.00 0.00 58.31 54.51 1d1d n LYS 196 Cb 0.51 -1.37 -0.08 0.00 -0.65 0.00 0.00 35.03 33.43 1d1d n LYS 196 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 177.40 176.23 1d1d s SER 197 N -1.75 0.12 0.96 -5.58 0.01 -1.26 -3.59 113.70 102.63 1d1d s SER 197 Ca 0.32 -0.57 -0.17 0.00 1.31 0.00 0.00 55.95 56.84 1d1d s SER 197 Cb 0.28 0.30 -0.15 0.00 0.21 0.00 0.00 66.02 66.67 1d1d s SER 197 CO -0.10 -0.65 -0.80 0.00 0.41 0.00 0.00 173.24 172.10 1d1d n GLN 198 N 0.26 0.00 0.09 12.44 0.00 -1.26 -4.57 117.38 124.34 1d1d n GLN 198 Ca -0.17 0.00 -0.07 0.00 0.00 0.00 0.00 57.00 56.77 1d1d n GLN 198 Cb 0.61 -0.96 0.04 0.00 0.00 0.00 0.00 30.24 29.92 1d1d n GLN 198 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.06 176.06 1d1d h PRO 199 N -0.96 0.15 -0.67 2.61 0.13 -1.97 -1.48 132.00 129.81 1d1d h PRO 199 Ca -0.42 -0.15 0.04 0.00 -0.87 0.00 0.00 66.00 64.60 1d1d h PRO 199 Cb 1.26 0.04 -0.05 0.00 0.13 0.00 0.00 31.00 32.38 1d1d h PRO 199 CO 0.22 0.87 0.40 0.22 -0.23 0.00 0.00 178.00 179.48 1d1d h ASP 200 N 0.09 0.63 -0.03 1.44 1.82 -1.98 1.69 116.42 120.09 1d1d h ASP 200 Ca -0.03 0.01 -0.11 0.00 -0.39 0.00 0.00 57.03 56.51 1d1d h ASP 200 Cb 1.38 -0.12 0.01 0.00 0.68 0.00 0.00 39.33 41.28 1d1d h ASP 200 CO 0.12 0.43 -0.43 0.40 -1.61 0.00 0.00 179.24 178.15 1d1d h ILE 201 N 0.76 1.45 -0.86 2.25 1.08 -1.89 -2.60 117.51 117.70 1d1d h ILE 201 Ca 0.28 -1.92 0.01 0.00 -0.39 0.00 0.00 64.86 62.83 1d1d h ILE 201 Cb 0.08 2.53 -0.04 0.00 -3.07 0.00 0.00 36.82 36.32 1d1d h ILE 201 CO -0.13 0.55 0.56 -0.61 -0.69 0.00 0.00 178.15 177.83 1d1d h GLN 202 N -0.20 1.15 -0.29 2.37 4.15 -0.84 0.41 115.11 121.86 1d1d h GLN 202 Ca -0.05 -0.08 -0.07 0.00 0.77 0.00 0.00 58.65 59.23 1d1d h GLN 202 Cb 1.13 -0.25 -0.02 0.00 0.21 0.00 0.00 27.48 28.55 1d1d h GLN 202 CO 0.09 0.77 -0.12 0.37 -1.93 0.00 0.00 178.83 178.00 1d1d h GLN 203 N 1.18 0.50 -0.04 1.69 5.75 0.25 0.50 115.11 124.93 1d1d h GLN 203 Ca 0.32 -0.14 -0.02 0.00 -0.15 0.00 0.00 58.65 58.65 1d1d h GLN 203 Cb -0.12 -0.05 -0.00 0.00 1.07 0.00 0.00 27.48 28.38 1d1d h GLN 203 CO -0.07 0.62 -0.05 1.25 -2.65 0.00 0.00 178.83 177.93 1d1d h LEU 204 N 0.46 0.11 -0.77 -2.39 6.46 -0.83 -0.32 115.31 118.03 1d1d h LEU 204 Ca 0.09 -0.51 -0.06 0.00 -0.12 0.00 0.00 57.88 57.28 1d1d h LEU 204 Cb 0.49 -0.03 -0.03 0.00 -0.73 0.00 0.00 40.66 40.36 1d1d h LEU 204 CO 0.03 0.60 0.26 0.40 -0.62 0.00 0.00 178.44 179.11 1d1d h ILE 205 N -0.38 1.26 -0.32 4.05 2.04 -0.78 0.55 117.51 123.94 1d1d h ILE 205 Ca 0.00 -0.89 -0.05 0.00 1.00 0.00 0.00 64.86 64.92 1d1d h ILE 205 Cb 0.57 0.40 -0.02 0.00 -0.74 0.00 0.00 36.82 37.03 1d1d h ILE 205 CO 0.01 0.36 -0.02 -0.09 0.00 0.00 0.00 178.15 178.41 1d1d h ARG 206 N 1.14 0.51 -0.15 2.37 1.12 0.03 -0.24 114.38 119.15 1d1d h ARG 206 Ca 0.25 -0.11 0.00 0.00 -1.11 0.00 0.00 59.98 59.01 1d1d h ARG 206 Cb 0.29 -0.07 0.00 0.00 -0.01 0.00 0.00 29.97 30.17 1d1d h ARG 206 CO -0.01 0.55 0.00 0.00 -3.11 0.00 0.00 179.97 177.40 1d1d n ALA 207 N -2.48 2.53 -1.32 2.80 0.00 -0.13 -4.92 120.51 116.98 1d1d n ALA 207 Ca 0.01 -0.51 -0.34 0.00 0.00 0.00 0.00 53.44 52.60 1d1d n ALA 207 Cb 0.26 -1.10 0.10 0.00 0.00 0.00 0.00 19.45 18.71 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 -1.81 2.05 0.58 0.00 0.00 0.12 -4.98 121.76 117.73 1d1d s ALA 208 Ca 0.33 0.92 -0.16 0.00 0.00 0.00 0.00 51.96 53.05 1d1d s ALA 208 Cb 0.18 -3.49 -0.04 0.00 0.00 0.00 0.00 23.12 19.76 1d1d s ALA 208 CO 0.27 -1.99 1.05 -1.25 0.00 0.00 0.00 175.76 173.84 1d1d s PRO 209 N -3.91 3.40 -0.01 0.00 0.04 -1.26 -4.94 135.00 128.32 1d1d s PRO 209 Ca 0.75 1.17 0.08 0.00 0.04 0.00 0.00 61.00 63.04 1d1d s PRO 209 Cb -0.30 -2.05 0.25 0.00 0.04 0.00 0.00 34.50 32.44 1d1d s PRO 209 CO 0.46 -0.74 1.17 0.43 0.04 0.00 0.00 177.00 178.36 1d1d n SER 210 N -1.98 1.59 0.03 6.66 7.64 -1.26 -3.34 113.62 122.96 1d1d n SER 210 Ca 0.08 -2.04 0.11 0.00 1.01 0.00 0.00 58.87 58.04 1d1d n SER 210 Cb 0.53 -0.22 0.02 0.00 -1.01 0.00 0.00 64.21 63.52 1d1d n SER 210 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1d1d n THR 211 N 0.29 0.17 -4.14 0.44 -1.04 -1.26 -4.89 114.28 103.84 1d1d n THR 211 Ca 0.09 -0.24 -0.15 0.00 -2.04 0.00 0.00 64.05 61.71 1d1d n THR 211 Cb 0.27 0.22 -0.14 0.00 -1.82 0.00 0.00 70.33 68.86 1d1d n THR 211 CO 0.00 0.00 0.00 -1.48 -0.64 0.00 0.00 175.07 172.95 1d1d s LEU 212 N -3.92 2.07 -0.38 -4.42 0.05 -1.21 -5.04 118.68 105.82 1d1d s LEU 212 Ca 0.04 -0.21 0.10 0.00 0.05 0.00 0.00 54.13 54.11 1d1d s LEU 212 Cb 0.14 -0.25 0.39 0.00 -2.05 0.00 0.00 46.19 44.42 1d1d s LEU 212 CO 0.80 0.00 1.42 0.35 -0.55 0.00 0.00 176.35 178.37 1d1d n THR 213 N 2.58 0.00 -4.34 5.48 -2.24 -1.26 -4.73 114.28 109.78 1d1d n THR 213 Ca -0.15 -1.33 -0.19 0.00 -2.27 0.00 0.00 64.05 60.11 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 0.18 1.73 -0.59 4.28 -4.23 -1.26 -4.35 115.64 111.39 1d1d s THR 214 Ca 0.18 -2.16 -0.06 0.00 -1.18 0.00 0.00 61.69 58.47 1d1d s THR 214 Cb 0.41 -2.00 -0.14 0.00 1.34 0.00 0.00 72.50 72.12 1d1d s THR 214 CO -0.10 -0.56 2.67 -0.81 -0.54 0.00 0.00 174.62 175.28 1d1d n PRO 215 N -0.27 2.12 0.18 3.99 -0.04 -1.26 -2.74 135.00 136.99 1d1d n PRO 215 Ca -0.09 -1.25 0.00 0.00 -0.04 0.00 0.00 63.50 62.12 1d1d n PRO 215 Cb 0.60 -2.23 0.00 0.00 -0.04 0.00 0.00 33.50 31.83 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 3.14 -1.34 0.12 0.55 0.00 -1.26 -4.90 105.19 101.49 1d1d n GLY 216 Ca 0.45 0.25 -0.03 0.00 0.00 0.00 0.00 46.02 46.68 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 0.03 -0.36 1.61 4.39 -1.97 -0.18 114.58 118.10 1d1d h GLU 217 Ca 0.00 -0.03 -0.02 0.00 0.34 0.00 0.00 59.36 59.65 1d1d h GLU 217 Cb 0.00 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.64 1d1d h GLU 217 CO 0.00 0.75 0.15 0.82 -1.16 0.00 0.00 179.01 179.56 1d1d h ILE 218 N 0.02 1.19 -0.08 3.13 5.03 -1.87 0.52 117.51 125.45 1d1d h ILE 218 Ca -0.01 -0.57 -0.09 0.00 -0.12 0.00 0.00 64.86 64.07 1d1d h ILE 218 Cb 1.29 0.89 0.00 0.00 -3.03 0.00 0.00 36.82 35.98 1d1d h ILE 218 CO 0.10 0.20 -0.32 0.40 -0.68 0.00 0.00 178.15 177.85 1d1d h ILE 219 N 0.43 1.41 -0.74 -0.67 2.04 -1.79 -1.12 117.51 117.07 1d1d h ILE 219 Ca 0.12 -1.70 0.07 0.00 1.00 0.00 0.00 64.86 64.35 1d1d h ILE 219 Cb 0.18 2.28 -0.05 0.00 -0.74 0.00 0.00 36.82 38.49 1d1d h ILE 219 CO -0.01 0.49 0.49 0.11 0.00 0.00 0.00 178.15 179.23 1d1d h LYS 220 N -0.12 0.72 -0.12 2.37 1.79 -0.90 0.34 116.57 120.65 1d1d h LYS 220 Ca -0.02 -0.04 -0.08 0.00 -2.18 0.00 0.00 60.65 58.33 1d1d h LYS 220 Cb 0.96 -0.16 0.00 0.00 -1.58 0.00 0.00 32.23 31.45 1d1d h LYS 220 CO 0.07 0.48 -0.25 -0.92 -1.08 0.00 0.00 179.45 177.75 1d1d h TYR 221 N 0.75 0.48 -0.13 -1.35 3.20 0.13 -0.06 116.97 119.98 1d1d h TYR 221 Ca 0.32 -0.18 -0.00 0.00 3.14 0.00 0.00 58.73 62.02 1d1d h TYR 221 Cb 0.31 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.48 1d1d h TYR 221 CO -0.00 0.86 0.08 0.28 -1.64 0.00 0.00 178.16 177.74 1d1d h VAL 222 N -0.05 1.06 -0.70 1.81 2.07 -0.34 0.34 116.25 120.45 1d1d h VAL 222 Ca 0.00 -0.13 -0.02 0.00 0.82 0.00 0.00 66.70 67.37 1d1d h VAL 222 Cb 0.84 0.92 -0.03 0.00 -1.52 0.00 0.00 31.29 31.49 1d1d h VAL 222 CO 0.05 0.05 0.34 -0.07 0.02 0.00 0.00 177.57 177.97 1d1d h LEU 223 N 0.15 0.89 -1.16 2.57 3.38 -0.39 0.48 115.31 121.22 1d1d h LEU 223 Ca 0.05 -0.09 -0.08 0.00 0.09 0.00 0.00 57.88 57.84 1d1d h LEU 223 Cb 0.01 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 1d1d h LEU 223 CO -0.01 0.75 -0.30 0.44 0.09 0.00 0.00 178.44 179.41 1d1d h ASP 224 N 0.99 0.20 0.10 -0.43 3.32 -0.29 -2.64 116.42 117.66 1d1d h ASP 224 Ca 0.24 -0.07 -0.27 0.00 0.02 0.00 0.00 57.03 56.96 1d1d h ASP 224 Cb 0.09 -0.05 0.03 0.00 0.22 0.00 0.00 39.33 39.61 1d1d h ASP 224 CO -0.03 0.50 -1.11 -0.09 -1.72 0.00 0.00 179.24 176.79 1d1d h ARG 225 N 0.18 0.58 -0.60 3.56 1.12 0.11 -3.28 114.38 116.05 1d1d h ARG 225 Ca 0.03 -0.76 0.11 0.00 -1.11 0.00 0.00 59.98 58.25 1d1d h ARG 225 Cb 0.63 0.25 -0.09 0.00 -0.01 0.00 0.00 29.97 30.75 1d1d h ARG 225 CO 0.05 1.33 0.13 1.96 -3.11 0.00 0.00 179.97 180.33 1d1d h GLN 226 N 0.19 0.25 -4.65 0.20 4.20 0.13 -3.48 115.11 111.95 1d1d h GLN 226 Ca -0.17 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.53 1d1d h GLN 226 Cb 1.80 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 29.52 1d1d h GLN 226 CO 0.21 0.17 -0.97 1.63 -0.67 0.00 0.00 178.83 179.20 1d1d n LYS 227 N -5.13 -5.29 -4.37 1.46 4.76 -1.02 -5.03 118.16 103.54 1d1d n LYS 227 Ca 0.09 3.80 -0.27 0.00 -2.87 0.00 0.00 58.31 59.05 1d1d n LYS 227 Cb 0.32 -4.57 -0.11 0.00 -1.84 0.00 0.00 35.03 28.82 1d1d n LYS 227 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1d1d s ILE 228 N -0.57 2.61 0.00 -0.18 1.09 -1.26 -4.90 121.20 117.98 1d1d s ILE 228 Ca 0.00 -1.86 0.00 0.00 -1.10 0.00 0.00 60.65 57.69 1d1d s ILE 228 Cb 0.00 -2.25 0.00 0.00 -1.06 0.00 0.00 42.46 39.15 1d1d s ILE 228 CO 0.00 -0.08 0.00 0.00 -0.10 0.00 0.00 174.94 174.76 1d1d n ALA 229 N 0.31 0.00 1.50 9.38 0.00 -1.26 -5.23 120.51 125.21 1d1d n ALA 229 Ca -0.13 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.43 1d1d n ALA 229 Cb 0.55 0.00 0.71 0.00 0.00 0.00 0.00 19.45 20.71 1d1d n ALA 229 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15