#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 0.84 0.36 -0.99 -1.32 -1.26 -5.14 115.64 108.14 1d1d s THR 12 Ca 0.00 -0.49 -0.26 0.00 -1.21 0.00 0.00 61.69 59.74 1d1d s THR 12 Cb 0.00 -0.71 -0.09 0.00 -1.51 0.00 0.00 72.50 70.19 1d1d s THR 12 CO 0.00 0.21 1.06 -2.16 -2.21 0.00 0.00 174.62 171.53 1d1d s PRO 13 N -0.31 4.32 -0.53 7.08 0.04 -1.26 -4.92 135.00 139.41 1d1d s PRO 13 Ca 0.04 1.60 -0.26 0.00 0.04 0.00 0.00 61.00 62.42 1d1d s PRO 13 Cb -0.04 -2.76 -0.05 0.00 0.04 0.00 0.00 34.50 31.69 1d1d s PRO 13 CO -0.00 -0.02 2.16 -1.17 0.04 0.00 0.00 177.00 178.01 1d1d s LEU 14 N -2.25 3.36 -0.04 -3.56 0.20 -1.26 -4.94 118.68 110.20 1d1d s LEU 14 Ca 0.53 0.80 0.03 0.00 0.69 0.00 0.00 54.13 56.18 1d1d s LEU 14 Cb -0.25 -2.56 -0.03 0.00 -0.43 0.00 0.00 46.19 42.92 1d1d s LEU 14 CO 0.32 -2.63 -0.13 -1.61 -0.29 0.00 0.00 176.35 172.01 1d1d s GLU 15 N 7.66 2.51 0.16 1.98 8.01 -1.26 -5.02 118.70 132.73 1d1d s GLU 15 Ca 0.85 -0.69 -0.01 0.00 0.01 0.00 0.00 54.97 55.12 1d1d s GLU 15 Cb -0.16 -2.41 -0.01 0.00 -4.31 0.00 0.00 34.13 27.25 1d1d s GLU 15 CO 0.24 0.62 1.37 -1.00 0.01 0.00 0.00 175.26 176.51 1d1d h PRO 16 N 5.21 0.35 -0.07 0.39 0.13 -1.97 0.12 132.00 136.16 1d1d h PRO 16 Ca -0.47 -0.34 -0.04 0.00 -0.87 0.00 0.00 66.00 64.28 1d1d h PRO 16 Cb 1.16 0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1d1d h PRO 16 CO 0.51 1.01 -0.12 1.57 -0.23 0.00 0.00 178.00 180.74 1d1d h LYS 17 N 0.21 0.20 -0.42 0.86 2.10 -1.99 -0.96 116.57 116.57 1d1d h LYS 17 Ca -0.05 -0.12 -0.06 0.00 -2.00 0.00 0.00 60.65 58.41 1d1d h LYS 17 Cb 1.45 0.01 -0.02 0.00 -0.90 0.00 0.00 32.23 32.78 1d1d h LYS 17 CO 0.14 0.70 0.02 -0.07 -2.00 0.00 0.00 179.45 178.24 1d1d h LEU 18 N -0.28 0.72 -1.29 7.07 3.38 -1.96 -2.43 115.31 120.51 1d1d h LEU 18 Ca 0.00 -0.29 0.04 0.00 0.09 0.00 0.00 57.88 57.72 1d1d h LEU 18 Cb 0.68 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 41.20 1d1d h LEU 18 CO 0.03 0.83 0.50 0.40 0.09 0.00 0.00 178.44 180.29 1d1d h ILE 19 N 0.58 1.11 -0.87 1.22 2.04 -0.77 -0.69 117.51 120.12 1d1d h ILE 19 Ca 0.12 -0.31 -0.02 0.00 1.00 0.00 0.00 64.86 65.65 1d1d h ILE 19 Cb 0.45 0.12 -0.04 0.00 -0.74 0.00 0.00 36.82 36.61 1d1d h ILE 19 CO 0.02 0.17 0.46 0.74 0.00 0.00 0.00 178.15 179.53 1d1d h THR 20 N 0.91 1.26 -0.09 -0.27 2.02 -0.71 0.54 112.91 116.57 1d1d h THR 20 Ca 0.30 -0.66 -0.01 0.00 0.77 0.00 0.00 66.41 66.82 1d1d h THR 20 Cb 0.07 0.10 -0.00 0.00 -1.74 0.00 0.00 68.15 66.58 1d1d h THR 20 CO -0.09 0.29 0.02 0.03 0.37 0.00 0.00 175.52 176.15 1d1d h ARG 21 N 1.22 0.14 -0.54 6.66 3.08 -0.74 0.34 114.38 124.54 1d1d h ARG 21 Ca 0.30 -0.03 -0.07 0.00 0.07 0.00 0.00 59.98 60.25 1d1d h ARG 21 Cb 0.05 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.06 1d1d h ARG 21 CO -0.05 0.32 0.04 1.25 -1.07 0.00 0.00 179.97 180.46 1d1d h LEU 22 N -0.07 0.86 -1.00 3.04 6.46 -1.01 -2.07 115.31 121.53 1d1d h LEU 22 Ca 0.03 -0.20 -0.09 0.00 -0.12 0.00 0.00 57.88 57.50 1d1d h LEU 22 Cb 0.24 -0.23 -0.01 0.00 -0.73 0.00 0.00 40.66 39.93 1d1d h LEU 22 CO 0.00 0.90 -0.21 0.00 -0.62 0.00 0.00 178.44 178.51 1d1d h ALA 23 N 1.20 1.15 -0.27 1.25 0.00 0.32 -1.96 119.26 120.95 1d1d h ALA 23 Ca 0.16 -0.32 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 1d1d h ALA 23 Cb 0.44 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1d1d h ALA 23 CO 0.02 0.53 0.06 -0.44 0.00 0.00 0.00 179.25 179.42 1d1d h ASP 24 N 0.43 0.35 0.03 0.00 3.32 0.37 -0.94 116.42 119.98 1d1d h ASP 24 Ca 0.07 -0.04 -0.16 0.00 0.02 0.00 0.00 57.03 56.92 1d1d h ASP 24 Cb 0.61 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.06 1d1d h ASP 24 CO 0.04 0.37 -0.56 0.74 -1.72 0.00 0.00 179.24 178.11 1d1d h THR 25 N 0.38 1.32 0.11 0.35 2.02 -0.95 -2.19 112.91 113.95 1d1d h THR 25 Ca 0.09 -1.81 -0.01 0.00 0.77 0.00 0.00 66.41 65.46 1d1d h THR 25 Cb 0.17 1.78 0.00 0.00 -1.74 0.00 0.00 68.15 68.36 1d1d h THR 25 CO -0.00 0.56 -0.05 0.58 0.37 0.00 0.00 175.52 176.98 1d1d h VAL 26 N 0.42 1.02 -0.61 3.16 2.07 -0.86 1.79 116.25 123.24 1d1d h VAL 26 Ca 0.01 -0.54 0.09 0.00 0.82 0.00 0.00 66.70 67.07 1d1d h VAL 26 Cb 1.10 1.37 -0.04 0.00 -1.52 0.00 0.00 31.29 32.20 1d1d h VAL 26 CO 0.10 0.13 0.41 0.08 0.02 0.00 0.00 177.57 178.31 1d1d h ARG 27 N -0.40 0.47 0.00 1.57 0.11 -1.21 0.66 114.38 115.58 1d1d h ARG 27 Ca -0.02 -0.03 -0.07 0.00 0.10 0.00 0.00 59.98 59.96 1d1d h ARG 27 Cb 0.33 -0.11 -0.01 0.00 1.11 0.00 0.00 29.97 31.29 1d1d h ARG 27 CO 0.03 0.31 -0.94 1.79 0.10 0.00 0.00 179.97 181.26 1d1d h THR 28 N 0.48 0.30 -0.57 0.08 1.35 -1.06 -3.24 112.91 110.26 1d1d h THR 28 Ca 0.28 -1.53 0.00 0.00 -0.55 0.00 0.00 66.41 64.61 1d1d h THR 28 Cb 0.46 1.89 0.00 0.00 -1.73 0.00 0.00 68.15 68.77 1d1d h THR 28 CO -0.08 0.17 0.00 0.29 -0.25 0.00 0.00 175.52 175.65 1d1d n LYS 29 N -2.89 2.35 -1.33 4.72 4.76 0.61 -5.02 118.16 121.35 1d1d n LYS 29 Ca -0.02 -2.09 0.00 0.00 -2.87 0.00 0.00 58.31 53.33 1d1d n LYS 29 Cb 0.68 -1.46 0.00 0.00 -1.84 0.00 0.00 35.03 32.41 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 1.43 -4.58 0.24 0.72 0.00 0.21 -4.20 105.19 99.00 1d1d n GLY 30 Ca 0.19 -0.54 -0.04 0.00 0.00 0.00 0.00 46.02 45.63 1d1d n GLY 30 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1d1d h LEU 31 N 2.30 0.51 -1.13 0.99 4.07 -1.83 -1.85 115.31 118.37 1d1d h LEU 31 Ca 0.00 -0.18 0.00 0.00 0.08 0.00 0.00 57.88 57.78 1d1d h LEU 31 Cb 0.00 -0.14 0.00 0.00 1.08 0.00 0.00 40.66 41.60 1d1d h LEU 31 CO 0.00 0.77 0.00 -2.11 -1.08 0.00 0.00 178.44 176.02 1d1d n ARG 32 N -4.11 1.76 -3.08 1.13 1.85 -1.26 -4.66 116.66 108.29 1d1d n ARG 32 Ca -0.00 -1.12 -0.24 0.00 -1.00 0.00 0.00 57.85 55.48 1d1d n ARG 32 Cb 0.42 -1.44 -0.00 0.00 -1.05 0.00 0.00 32.46 30.39 1d1d n ARG 32 CO 0.00 0.00 0.00 -1.12 -0.01 0.00 0.00 177.63 176.50 1d1d s SER 33 N -1.77 6.12 -0.72 2.89 0.01 -0.70 -5.01 113.70 114.53 1d1d s SER 33 Ca 0.35 0.50 -0.26 0.00 1.31 0.00 0.00 55.95 57.85 1d1d s SER 33 Cb 0.19 -1.91 0.00 0.00 0.21 0.00 0.00 66.02 64.52 1d1d s SER 33 CO 0.30 -0.50 1.59 -2.16 0.41 0.00 0.00 173.24 172.87 1d1d s PRO 34 N -4.50 2.94 0.00 12.44 0.04 -1.26 -3.08 135.00 141.58 1d1d s PRO 34 Ca 0.44 0.03 0.00 0.00 0.04 0.00 0.00 61.00 61.52 1d1d s PRO 34 Cb -0.10 -4.43 0.00 0.00 0.04 0.00 0.00 34.50 30.01 1d1d s PRO 34 CO 0.39 -2.49 0.00 -0.89 0.04 0.00 0.00 177.00 174.04 1d1d n ILE 35 N 6.88 0.00 -0.06 0.56 2.08 -1.26 -4.99 119.36 122.56 1d1d n ILE 35 Ca 0.15 0.00 -0.09 0.00 0.56 0.00 0.00 62.75 63.37 1d1d n ILE 35 Cb 0.50 0.00 -0.02 0.00 -0.75 0.00 0.00 39.64 39.37 1d1d n ILE 35 CO 0.00 0.00 0.00 0.74 0.56 0.00 0.00 176.55 177.85 1d1d h THR 36 N 0.00 1.02 -0.58 1.39 2.02 -1.72 0.49 112.91 115.52 1d1d h THR 36 Ca 0.00 -0.10 -0.07 0.00 0.77 0.00 0.00 66.41 67.02 1d1d h THR 36 Cb 0.00 0.70 -0.03 0.00 -1.74 0.00 0.00 68.15 67.09 1d1d h THR 36 CO 0.00 0.05 0.10 0.24 0.37 0.00 0.00 175.52 176.28 1d1d h MET 37 N 0.29 0.93 0.18 6.66 2.86 -1.86 0.52 114.93 124.50 1d1d h MET 37 Ca 0.10 -0.22 -0.01 0.00 -2.06 0.00 0.00 59.70 57.51 1d1d h MET 37 Cb 0.01 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 31.55 1d1d h MET 37 CO -0.05 0.86 -0.09 0.00 1.06 0.00 0.00 176.91 178.69 1d1d h ALA 38 N 1.22 -0.24 -0.23 6.32 0.00 -1.82 0.41 119.26 124.92 1d1d h ALA 38 Ca 0.18 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1d1d h ALA 38 Cb 0.38 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1d1d h ALA 38 CO 0.01 -0.47 0.13 0.93 0.00 0.00 0.00 179.25 179.85 1d1d h GLU 39 N -0.57 0.32 -0.43 0.00 3.07 0.08 0.45 114.58 117.50 1d1d h GLU 39 Ca -0.02 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.81 1d1d h GLU 39 Cb 0.43 -0.07 -0.02 0.00 -0.84 0.00 0.00 28.75 28.25 1d1d h GLU 39 CO 0.04 0.28 0.28 0.28 -1.40 0.00 0.00 179.01 178.49 1d1d h VAL 40 N 0.28 1.11 0.00 3.13 2.07 0.05 -0.72 116.25 122.17 1d1d h VAL 40 Ca 0.08 -0.20 -0.03 0.00 0.82 0.00 0.00 66.70 67.37 1d1d h VAL 40 Cb 0.04 0.48 -0.00 0.00 -1.52 0.00 0.00 31.29 30.29 1d1d h VAL 40 CO -0.01 0.11 -0.14 -0.33 0.02 0.00 0.00 177.57 177.21 1d1d h GLU 41 N 0.58 0.00 0.53 1.57 5.08 0.18 0.66 114.58 123.18 1d1d h GLU 41 Ca 0.16 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.49 1d1d h GLU 41 Cb -0.07 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.19 1d1d h GLU 41 CO -0.04 0.14 -0.26 0.00 -1.00 0.00 0.00 179.01 177.86 1d1d h ALA 42 N 1.86 -0.72 -0.01 3.43 0.00 0.14 1.70 119.26 125.67 1d1d h ALA 42 Ca -0.00 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 1d1d h ALA 42 Cb 0.48 0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.55 1d1d h ALA 42 CO 0.02 -0.89 -0.02 1.37 0.00 0.00 0.00 179.25 179.73 1d1d h LEU 43 N -0.75 0.03 -0.15 0.00 -0.00 -1.32 -2.96 115.31 110.17 1d1d h LEU 43 Ca -0.07 -0.62 0.00 0.00 -0.00 0.00 0.00 57.88 57.18 1d1d h LEU 43 Cb 0.56 -0.01 0.00 0.00 -0.00 0.00 0.00 40.66 41.21 1d1d h LEU 43 CO 0.12 0.65 0.00 0.23 -0.00 0.00 0.00 178.44 179.44 1d1d n MET 44 N -4.76 0.03 -0.50 0.17 2.81 0.21 -3.26 117.12 111.81 1d1d n MET 44 Ca -0.09 0.38 0.40 0.00 -1.81 0.00 0.00 57.70 56.58 1d1d n MET 44 Cb 0.32 -1.56 0.64 0.00 -0.71 0.00 0.00 33.22 31.91 1d1d n MET 44 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1d1d n SER 45 N -1.61 0.09 -4.81 7.83 2.88 0.58 -4.23 113.62 114.35 1d1d n SER 45 Ca 0.02 1.01 -0.22 0.00 -1.33 0.00 0.00 58.87 58.35 1d1d n SER 45 Cb 0.11 -0.50 -0.05 0.00 -0.75 0.00 0.00 64.21 63.02 1d1d n SER 45 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1d1d s SER 46 N -4.10 5.24 0.48 -3.46 1.04 -1.20 -5.07 113.70 106.63 1d1d s SER 46 Ca -0.05 -0.45 -0.21 0.00 0.48 0.00 0.00 55.95 55.72 1d1d s SER 46 Cb 0.24 -1.09 -0.09 0.00 0.10 0.00 0.00 66.02 65.18 1d1d s SER 46 CO 0.73 -0.19 1.04 -2.16 0.98 0.00 0.00 173.24 173.63 1d1d s PRO 47 N -3.89 3.83 0.28 4.02 0.04 -1.26 -4.97 135.00 133.06 1d1d s PRO 47 Ca 0.37 1.37 -0.09 0.00 0.04 0.00 0.00 61.00 62.69 1d1d s PRO 47 Cb -0.06 -2.13 -0.00 0.00 0.04 0.00 0.00 34.50 32.35 1d1d s PRO 47 CO 0.25 -0.41 0.47 -0.48 0.04 0.00 0.00 177.00 176.87 1d1d s LEU 48 N -3.41 0.56 0.74 -3.56 0.05 -1.26 -5.00 118.68 106.79 1d1d s LEU 48 Ca 0.66 -1.14 -0.11 0.00 0.05 0.00 0.00 54.13 53.60 1d1d s LEU 48 Cb -0.17 1.65 0.03 0.00 -2.05 0.00 0.00 46.19 45.65 1d1d s LEU 48 CO 0.20 -1.20 1.07 -0.76 -0.55 0.00 0.00 176.35 175.12 1d1d s LEU 49 N -3.10 2.94 0.31 1.48 1.43 -1.26 -4.63 118.68 115.86 1d1d s LEU 49 Ca 0.26 1.53 0.16 0.00 -1.03 0.00 0.00 54.13 55.05 1d1d s LEU 49 Cb -0.00 -4.31 0.40 0.00 0.03 0.00 0.00 46.19 42.31 1d1d s LEU 49 CO 0.13 -1.67 1.60 1.55 0.23 0.00 0.00 176.35 178.19 1d1d h PRO 50 N -0.88 0.00 -0.10 1.29 0.13 -1.86 -2.56 132.00 128.02 1d1d h PRO 50 Ca -0.45 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.66 1d1d h PRO 50 Cb 1.23 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.36 1d1d h PRO 50 CO 0.57 0.49 -0.04 1.25 -0.23 0.00 0.00 178.00 180.05 1d1d h HIS 51 N 0.00 0.23 -0.08 1.56 2.76 -1.93 -2.82 115.15 114.88 1d1d h HIS 51 Ca -0.00 -0.05 -0.05 0.00 -2.20 0.00 0.00 60.37 58.06 1d1d h HIS 51 Cb 1.13 -0.05 -0.01 0.00 1.55 0.00 0.00 27.41 30.03 1d1d h HIS 51 CO 0.00 0.54 -0.19 -0.44 -1.30 0.00 0.00 177.93 176.54 1d1d h ASP 52 N -0.14 0.12 -0.45 3.26 5.19 -1.95 -2.37 116.42 120.08 1d1d h ASP 52 Ca 0.02 -0.03 0.07 0.00 -0.62 0.00 0.00 57.03 56.48 1d1d h ASP 52 Cb 0.47 -0.03 -0.06 0.00 0.18 0.00 0.00 39.33 39.89 1d1d h ASP 52 CO 0.01 0.32 0.09 0.58 -3.12 0.00 0.00 179.24 177.12 1d1d h VAL 53 N 0.12 0.76 -0.56 -1.35 2.07 -1.21 0.91 116.25 116.99 1d1d h VAL 53 Ca 0.02 -0.08 -0.11 0.00 0.82 0.00 0.00 66.70 67.35 1d1d h VAL 53 Cb 0.41 0.51 -0.02 0.00 -1.52 0.00 0.00 31.29 30.68 1d1d h VAL 53 CO 0.03 0.04 -0.09 0.71 0.02 0.00 0.00 177.57 178.28 1d1d h THR 54 N 0.22 1.27 -0.60 2.57 1.35 -1.27 0.56 112.91 117.01 1d1d h THR 54 Ca 0.22 -1.24 -0.02 0.00 -0.55 0.00 0.00 66.41 64.81 1d1d h THR 54 Cb 0.28 0.93 -0.03 0.00 -1.73 0.00 0.00 68.15 67.61 1d1d h THR 54 CO -0.29 0.44 0.28 -1.13 -0.25 0.00 0.00 175.52 174.57 1d1d h ASN 55 N 0.92 0.80 -0.17 5.36 -1.24 -0.74 0.60 115.58 121.10 1d1d h ASN 55 Ca 0.15 -0.14 -0.10 0.00 0.71 0.00 0.00 56.30 56.92 1d1d h ASN 55 Cb 0.66 -0.21 -0.00 0.00 0.73 0.00 0.00 38.32 39.50 1d1d h ASN 55 CO 0.05 0.71 -0.29 0.25 -1.29 0.00 0.00 177.43 176.86 1d1d h LEU 56 N 0.82 0.55 -1.74 0.34 5.85 0.10 -2.57 115.31 118.66 1d1d h LEU 56 Ca 0.21 -0.53 -0.03 0.00 0.84 0.00 0.00 57.88 58.36 1d1d h LEU 56 Cb 0.14 -0.16 -0.00 0.00 0.37 0.00 0.00 40.66 41.01 1d1d h LEU 56 CO -0.02 0.98 -0.16 0.24 -0.34 0.00 0.00 178.44 179.13 1d1d h MET 57 N 0.14 0.00 -0.18 1.25 2.86 0.39 0.80 114.93 120.19 1d1d h MET 57 Ca 0.01 0.00 -0.16 0.00 -2.06 0.00 0.00 59.70 57.49 1d1d h MET 57 Cb 0.87 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.52 1d1d h MET 57 CO 0.07 0.16 -0.56 -0.09 1.06 0.00 0.00 176.91 177.55 1d1d h ARG 58 N 0.00 0.56 -0.00 1.72 1.12 0.35 2.47 114.38 120.60 1d1d h ARG 58 Ca -0.00 -0.36 -0.05 0.00 -1.11 0.00 0.00 59.98 58.46 1d1d h ARG 58 Cb 0.31 0.04 0.00 0.00 -0.01 0.00 0.00 29.97 30.32 1d1d h ARG 58 CO 0.02 0.97 -0.19 0.28 -3.11 0.00 0.00 179.97 177.94 1d1d h VAL 59 N 0.43 1.55 -0.09 0.20 2.07 -0.96 -3.33 116.25 116.13 1d1d h VAL 59 Ca 0.01 -1.89 -0.13 0.00 0.82 0.00 0.00 66.70 65.51 1d1d h VAL 59 Cb 1.10 2.76 0.01 0.00 -1.52 0.00 0.00 31.29 33.63 1d1d h VAL 59 CO 0.10 0.51 -0.44 0.40 0.02 0.00 0.00 177.57 178.17 1d1d h ILE 60 N -0.55 1.39 -3.09 4.57 2.04 -0.89 -3.43 117.51 117.55 1d1d h ILE 60 Ca -0.02 -1.80 -0.62 0.00 1.00 0.00 0.00 64.86 63.41 1d1d h ILE 60 Cb 0.94 2.26 -0.11 0.00 -0.74 0.00 0.00 36.82 39.18 1d1d h ILE 60 CO 0.04 0.53 -0.48 -0.22 0.00 0.00 0.00 178.15 178.02 1d1d s LEU 61 N -8.61 4.26 1.27 1.44 1.98 0.83 -4.92 118.68 114.93 1d1d s LEU 61 Ca -0.13 0.31 -0.16 0.00 -2.89 0.00 0.00 54.13 51.25 1d1d s LEU 61 Cb 0.05 -2.09 0.32 0.00 0.66 0.00 0.00 46.19 45.13 1d1d s LEU 61 CO 0.81 0.25 0.92 0.61 -1.89 0.00 0.00 176.35 177.05 1d1d n GLY 62 N 3.07 -2.65 0.16 7.98 0.00 -1.26 -3.86 105.19 108.63 1d1d n GLY 62 Ca -0.17 -1.33 -0.18 0.00 0.00 0.00 0.00 46.02 44.35 1d1d n GLY 62 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1d1d h PRO 63 N -2.98 0.53 0.43 1.61 0.13 -1.94 -1.84 132.00 127.94 1d1d h PRO 63 Ca -0.57 -0.51 -0.02 0.00 -0.87 0.00 0.00 66.00 64.02 1d1d h PRO 63 Cb 1.34 0.13 0.00 0.00 0.13 0.00 0.00 31.00 32.60 1d1d h PRO 63 CO 0.43 1.15 -0.21 0.00 -0.23 0.00 0.00 178.00 179.14 1d1d h ALA 64 N 0.39 -0.58 0.00 -0.56 0.00 -1.99 -1.66 119.26 114.87 1d1d h ALA 64 Ca -0.07 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1d1d h ALA 64 Cb 1.35 0.22 0.00 0.00 0.00 0.00 0.00 17.79 19.37 1d1d h ALA 64 CO 0.14 -0.79 0.00 -0.35 0.00 0.00 0.00 179.25 178.24 1d1d n PRO 65 N -5.31 0.75 -0.02 0.00 -0.04 -1.25 -3.23 135.00 125.90 1d1d n PRO 65 Ca -0.11 0.00 -0.16 0.00 -0.04 0.00 0.00 63.50 63.19 1d1d n PRO 65 Cb 0.26 -1.16 -0.11 0.00 -0.04 0.00 0.00 33.50 32.45 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 0.46 -0.05 0.54 3.20 -0.40 -2.91 116.97 117.82 1d1d h TYR 66 Ca 0.00 -0.23 0.01 0.00 3.14 0.00 0.00 58.73 61.65 1d1d h TYR 66 Cb 0.00 -0.06 -0.00 0.00 1.54 0.00 0.00 36.73 38.21 1d1d h TYR 66 CO 0.00 1.02 0.04 0.00 -1.64 0.00 0.00 178.16 177.58 1d1d h ALA 67 N 0.34 2.02 -0.16 1.82 0.00 -1.61 0.93 119.26 122.59 1d1d h ALA 67 Ca -0.04 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1d1d h ALA 67 Cb 1.12 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 1d1d h ALA 67 CO 0.08 -0.06 -0.03 -0.07 0.00 0.00 0.00 179.25 179.17 1d1d h LEU 68 N 0.00 0.30 -0.22 0.00 4.07 -1.73 0.38 115.31 118.11 1d1d h LEU 68 Ca 0.02 -0.35 -0.11 0.00 0.08 0.00 0.00 57.88 57.52 1d1d h LEU 68 Cb 0.09 -0.08 -0.00 0.00 1.08 0.00 0.00 40.66 41.75 1d1d h LEU 68 CO -0.00 0.58 -0.31 -0.25 -1.08 0.00 0.00 178.44 177.38 1d1d h TRP 69 N 0.02 0.74 -0.73 1.13 7.01 -1.03 -0.98 115.95 122.11 1d1d h TRP 69 Ca 0.04 -0.24 0.02 0.00 2.11 0.00 0.00 58.89 60.82 1d1d h TRP 69 Cb 0.45 -0.15 -0.04 0.00 -2.10 0.00 0.00 29.16 27.32 1d1d h TRP 69 CO 0.05 0.97 0.48 0.52 -2.79 0.00 0.00 178.44 177.67 1d1d h MET 70 N 0.29 0.90 -0.12 2.65 2.86 0.92 1.41 114.93 123.83 1d1d h MET 70 Ca 0.02 -0.05 -0.07 0.00 -2.06 0.00 0.00 59.70 57.54 1d1d h MET 70 Cb 0.89 -0.20 -0.00 0.00 0.06 0.00 0.00 31.60 32.35 1d1d h MET 70 CO 0.07 0.59 -0.19 0.22 1.06 0.00 0.00 176.91 178.67 1d1d h ASP 71 N 0.93 0.38 0.50 1.22 3.58 -0.10 -1.28 116.42 121.64 1d1d h ASP 71 Ca 0.28 -0.53 -0.08 0.00 0.42 0.00 0.00 57.03 57.12 1d1d h ASP 71 Cb -0.01 -0.11 -0.01 0.00 1.72 0.00 0.00 39.33 40.92 1d1d h ASP 71 CO -0.07 0.84 -0.39 0.00 -2.88 0.00 0.00 179.24 176.73 1d1d h ALA 72 N 0.55 1.23 -0.31 -0.78 0.00 -0.58 -2.57 119.26 116.80 1d1d h ALA 72 Ca 0.01 -0.36 -0.06 0.00 0.00 0.00 0.00 54.91 54.50 1d1d h ALA 72 Cb 0.76 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 1d1d h ALA 72 CO 0.04 0.49 -0.04 2.35 0.00 0.00 0.00 179.25 182.10 1d1d h TRP 73 N 0.00 0.64 -0.91 0.00 7.01 0.20 0.30 115.95 123.19 1d1d h TRP 73 Ca -0.00 -0.12 0.05 0.00 2.11 0.00 0.00 58.89 60.93 1d1d h TRP 73 Cb 0.75 -0.16 -0.06 0.00 -2.10 0.00 0.00 29.16 27.59 1d1d h TRP 73 CO 0.00 0.73 0.58 0.78 -2.79 0.00 0.00 178.44 177.74 1d1d h GLY 74 N 0.36 1.36 0.74 2.65 0.00 -0.86 0.47 103.07 107.78 1d1d h GLY 74 Ca 0.08 -0.42 -0.04 0.00 0.00 0.00 0.00 47.33 46.95 1d1d h GLY 74 CO 0.02 0.31 -0.06 -2.08 0.00 0.00 0.00 176.54 174.73 1d1d h VAL 75 N 1.07 1.31 -0.46 4.60 2.07 -1.24 -0.43 116.25 123.17 1d1d h VAL 75 Ca 0.38 -1.08 0.02 0.00 0.82 0.00 0.00 66.70 66.84 1d1d h VAL 75 Cb 0.12 1.73 -0.03 0.00 -1.52 0.00 0.00 31.29 31.59 1d1d h VAL 75 CO -0.16 0.32 0.26 1.56 0.02 0.00 0.00 177.57 179.57 1d1d h GLN 76 N -0.03 0.51 -0.33 1.57 7.50 -0.32 0.11 115.11 124.12 1d1d h GLN 76 Ca 0.03 -0.03 -0.00 0.00 0.50 0.00 0.00 58.65 59.15 1d1d h GLN 76 Cb 0.52 -0.11 -0.02 0.00 0.05 0.00 0.00 27.48 27.92 1d1d h GLN 76 CO 0.02 0.34 0.20 -0.07 -1.50 0.00 0.00 178.83 177.82 1d1d h LEU 77 N 0.52 0.39 -1.34 1.46 3.38 -0.03 -1.87 115.31 117.82 1d1d h LEU 77 Ca 0.19 -0.04 0.03 0.00 0.09 0.00 0.00 57.88 58.14 1d1d h LEU 77 Cb 0.03 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.64 1d1d h LEU 77 CO -0.10 0.32 0.47 1.56 0.09 0.00 0.00 178.44 180.79 1d1d h GLN 78 N 0.43 0.84 -0.64 1.13 4.20 -0.49 -0.61 115.11 119.97 1d1d h GLN 78 Ca 0.12 -0.05 0.02 0.00 0.06 0.00 0.00 58.65 58.80 1d1d h GLN 78 Cb -0.00 -0.19 -0.03 0.00 0.30 0.00 0.00 27.48 27.55 1d1d h GLN 78 CO -0.02 0.55 0.42 1.15 -0.67 0.00 0.00 178.83 180.26 1d1d h THR 79 N 0.86 1.13 -0.15 -0.54 2.02 0.02 0.50 112.91 116.75 1d1d h THR 79 Ca 0.28 -0.28 -0.15 0.00 0.77 0.00 0.00 66.41 67.04 1d1d h THR 79 Cb 0.06 0.24 -0.01 0.00 -1.74 0.00 0.00 68.15 66.70 1d1d h THR 79 CO -0.08 0.15 -0.54 0.58 0.37 0.00 0.00 175.52 176.00 1d1d h VAL 80 N 0.81 1.34 -0.12 3.16 2.07 -0.72 0.42 116.25 123.21 1d1d h VAL 80 Ca 0.24 -1.80 -0.08 0.00 0.82 0.00 0.00 66.70 65.88 1d1d h VAL 80 Cb -0.02 1.81 0.00 0.00 -1.52 0.00 0.00 31.29 31.56 1d1d h VAL 80 CO -0.06 0.55 -0.26 0.40 0.02 0.00 0.00 177.57 178.22 1d1d h ILE 81 N 0.33 1.38 -0.35 4.57 1.08 -0.49 -1.27 117.51 122.76 1d1d h ILE 81 Ca 0.01 -1.54 -0.06 0.00 -0.39 0.00 0.00 64.86 62.88 1d1d h ILE 81 Cb 1.05 2.07 -0.01 0.00 -3.07 0.00 0.00 36.82 36.86 1d1d h ILE 81 CO 0.09 0.45 -0.03 0.00 -0.69 0.00 0.00 178.15 177.98 1d1d h ALA 82 N 0.53 0.48 -0.54 1.87 0.00 -0.01 0.30 119.26 121.88 1d1d h ALA 82 Ca 0.00 -0.27 0.06 0.00 0.00 0.00 0.00 54.91 54.70 1d1d h ALA 82 Cb 0.85 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.46 1d1d h ALA 82 CO 0.06 0.27 0.26 0.00 0.00 0.00 0.00 179.25 179.84 1d1d h ALA 83 N 0.85 0.69 -0.48 0.00 0.00 -0.16 0.45 119.26 120.61 1d1d h ALA 83 Ca 0.10 0.04 -0.13 0.00 0.00 0.00 0.00 54.91 54.92 1d1d h ALA 83 Cb 0.50 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1d1d h ALA 83 CO 0.02 -0.10 -0.20 0.00 0.00 0.00 0.00 179.25 178.97 1d1d h ALA 84 N 1.31 0.66 -0.83 0.00 0.00 -1.02 0.12 119.26 119.50 1d1d h ALA 84 Ca 0.25 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1d1d h ALA 84 Cb 0.19 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 1d1d h ALA 84 CO -0.19 0.64 0.54 1.15 0.00 0.00 0.00 179.25 181.38 1d1d h THR 85 N 0.82 1.22 -0.04 0.00 2.02 0.71 -2.59 112.91 115.06 1d1d h THR 85 Ca 0.11 -0.43 -0.18 0.00 0.77 0.00 0.00 66.41 66.69 1d1d h THR 85 Cb 0.77 0.01 0.01 0.00 -1.74 0.00 0.00 68.15 67.20 1d1d h THR 85 CO 0.06 0.22 -0.67 0.03 0.37 0.00 0.00 175.52 175.53 1d1d h ARG 86 N 1.14 0.52 -4.54 6.66 3.08 0.10 -3.41 114.38 117.93 1d1d h ARG 86 Ca 0.30 -0.51 -0.71 0.00 0.07 0.00 0.00 59.98 59.14 1d1d h ARG 86 Cb -0.10 0.13 -0.27 0.00 0.08 0.00 0.00 29.97 29.81 1d1d h ARG 86 CO -0.06 1.14 -0.51 -0.51 -1.07 0.00 0.00 179.97 178.96 1d1d s ASP 87 N -6.85 5.61 -0.48 7.04 1.11 0.39 -4.97 116.67 118.51 1d1d s ASP 87 Ca -0.12 -1.28 -0.06 0.00 0.18 0.00 0.00 52.55 51.27 1d1d s ASP 87 Cb 0.05 -1.98 -0.15 0.00 1.07 0.00 0.00 42.92 41.92 1d1d s ASP 87 CO 0.85 -0.45 2.69 -0.81 1.18 0.00 0.00 175.17 178.63 1d1d n PRO 88 N 4.92 2.00 -0.80 8.23 -0.04 -1.23 -2.91 135.00 145.18 1d1d n PRO 88 Ca -0.11 -1.15 -0.04 0.00 -0.04 0.00 0.00 63.50 62.15 1d1d n PRO 88 Cb 0.44 -2.16 -0.04 0.00 -0.04 0.00 0.00 33.50 31.70 1d1d n PRO 88 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1d1d n ARG 89 N 3.15 0.00 -2.70 0.54 1.74 -1.26 -5.10 116.66 113.03 1d1d n ARG 89 Ca 0.43 -0.61 -0.37 0.00 -0.77 0.00 0.00 57.85 56.53 1d1d n ARG 89 Cb 0.48 0.32 -0.06 0.00 -1.02 0.00 0.00 32.46 32.19 1d1d n ARG 89 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 1d1d s HIS 90 N 0.00 3.52 -0.09 -1.55 2.46 -1.15 -4.95 115.29 113.55 1d1d s HIS 90 Ca 0.00 1.72 0.25 0.00 0.47 0.00 0.00 55.06 57.50 1d1d s HIS 90 Cb 0.00 -3.00 0.73 0.00 -0.13 0.00 0.00 32.58 30.19 1d1d s HIS 90 CO 0.00 -0.11 1.75 -1.00 -2.47 0.00 0.00 174.74 172.91 1d1d h PRO 91 N 2.89 0.00 0.00 2.88 0.13 -1.98 -2.60 132.00 133.31 1d1d h PRO 91 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1d1d h PRO 91 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1d1d h PRO 91 CO 0.64 0.15 0.00 0.00 -0.23 0.00 0.00 178.00 178.55 1d1d n ALA 92 N -2.15 2.04 -2.11 -0.56 0.00 -1.26 -4.74 120.51 111.73 1d1d n ALA 92 Ca 0.02 -0.09 -0.31 0.00 0.00 0.00 0.00 53.44 53.05 1d1d n ALA 92 Cb 0.47 -1.34 -0.04 0.00 0.00 0.00 0.00 19.45 18.54 1d1d n ALA 92 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1d1d s ASN 93 N -2.71 6.64 0.00 0.00 0.01 -0.98 -4.22 114.94 113.67 1d1d s ASN 93 Ca 0.17 1.27 0.00 0.00 -0.71 0.00 0.00 52.86 53.58 1d1d s ASN 93 Cb 0.14 -2.37 0.00 0.00 0.41 0.00 0.00 41.25 39.42 1d1d s ASN 93 CO 0.34 -0.35 0.00 0.61 -1.51 0.00 0.00 177.10 176.18 1d1d n GLY 94 N -0.98 0.41 0.07 0.66 0.00 -1.26 -4.88 105.19 99.21 1d1d n GLY 94 Ca 0.04 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.00 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 0.40 0.00 1.61 -0.06 -1.26 -4.99 117.38 113.08 1d1d n GLN 95 Ca 0.00 0.29 0.00 0.00 -2.00 0.00 0.00 57.00 55.29 1d1d n GLN 95 Cb 0.00 -1.35 0.00 0.00 -4.06 0.00 0.00 30.24 24.83 1d1d n GLN 95 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1d1d n GLY 96 N 1.53 1.02 0.78 1.69 0.00 -1.26 -4.96 105.19 104.00 1d1d n GLY 96 Ca -0.09 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.05 1d1d n GLY 96 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1d1d n ARG 97 N 0.00 2.08 0.00 1.61 0.63 -1.26 -4.73 116.66 114.99 1d1d n ARG 97 Ca 0.00 -1.58 0.00 0.00 -0.92 0.00 0.00 57.85 55.35 1d1d n ARG 97 Cb 0.00 -1.47 0.00 0.00 0.45 0.00 0.00 32.46 31.44 1d1d n ARG 97 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1d1d n GLY 98 N 1.29 0.00 0.94 5.14 0.00 -1.26 -5.09 105.19 106.20 1d1d n GLY 98 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 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 -1.26 1.61 4.07 -1.26 -5.04 120.64 118.76 1d1d n GLU 99 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 1d1d n GLU 99 Cb 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.38 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 -2.13 -3.46 -2.40 5.31 0.63 -1.26 -4.86 116.66 108.49 1d1d n ARG 100 Ca 0.00 2.63 -0.40 0.00 -0.92 0.00 0.00 57.85 59.16 1d1d n ARG 100 Cb 0.00 -3.11 -0.04 0.00 0.45 0.00 0.00 32.46 29.76 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 -4.14 3.33 0.14 5.15 -1.32 -1.26 -4.51 115.64 113.04 1d1d s THR 101 Ca 0.00 1.30 0.07 0.00 -1.21 0.00 0.00 61.69 61.85 1d1d s THR 101 Cb 0.00 -3.80 -0.04 0.00 -1.51 0.00 0.00 72.50 67.15 1d1d s THR 101 CO 0.00 0.27 -0.16 0.20 -2.21 0.00 0.00 174.62 172.72 1d1d s ASN 102 N -0.89 2.33 0.27 8.08 -0.87 -1.26 -4.91 114.94 117.68 1d1d s ASN 102 Ca 0.48 -0.85 -0.03 0.00 -1.57 0.00 0.00 52.86 50.89 1d1d s ASN 102 Cb -0.32 -0.11 0.34 0.00 -0.02 0.00 0.00 41.25 41.14 1d1d s ASN 102 CO 0.42 -0.10 1.82 0.25 -2.57 0.00 0.00 177.10 176.92 1d1d h LEU 103 N 3.35 0.87 -0.62 0.60 5.85 -1.96 -1.51 115.31 121.88 1d1d h LEU 103 Ca -0.41 -0.14 -0.03 0.00 0.84 0.00 0.00 57.88 58.14 1d1d h LEU 103 Cb 1.20 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.98 1d1d h LEU 103 CO 0.51 0.81 0.28 -0.78 -0.34 0.00 0.00 178.44 178.93 1d1d h ASP 104 N 0.91 0.83 -0.36 1.25 1.82 -1.98 0.33 116.42 119.23 1d1d h ASP 104 Ca 0.21 -0.14 0.00 0.00 -0.39 0.00 0.00 57.03 56.71 1d1d h ASP 104 Cb 0.25 -0.21 -0.02 0.00 0.68 0.00 0.00 39.33 40.03 1d1d h ASP 104 CO -0.01 0.74 0.24 0.03 -1.61 0.00 0.00 179.24 178.63 1d1d h ARG 105 N 0.86 0.47 0.00 0.28 -0.00 -1.81 -0.84 114.38 113.34 1d1d h ARG 105 Ca 0.21 -0.03 -0.02 0.00 -0.50 0.00 0.00 59.98 59.64 1d1d h ARG 105 Cb 0.15 -0.11 -0.00 0.00 0.00 0.00 0.00 29.97 30.01 1d1d h ARG 105 CO -0.02 0.32 -0.09 -0.07 0.00 0.00 0.00 179.97 180.11 1d1d h LEU 106 N 0.48 0.00 0.15 3.04 3.38 -0.95 -3.01 115.31 118.40 1d1d h LEU 106 Ca 0.13 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 1d1d h LEU 106 Cb -0.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.70 1d1d h LEU 106 CO -0.03 0.09 -0.07 0.11 0.09 0.00 0.00 178.44 178.63 1d1d h LYS 107 N 0.00 -0.19 0.00 1.13 6.56 0.11 -3.45 116.57 120.74 1d1d h LYS 107 Ca -0.00 0.01 0.00 0.00 -1.06 0.00 0.00 60.65 59.60 1d1d h LYS 107 Cb 0.61 0.04 0.00 0.00 -0.57 0.00 0.00 32.23 32.31 1d1d h LYS 107 CO 0.01 -0.08 0.00 0.41 -2.06 0.00 0.00 179.45 177.73 1d1d n GLY 108 N -1.03 1.39 0.90 3.86 0.00 -0.98 -4.55 105.19 104.78 1d1d n GLY 108 Ca -0.09 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.02 1d1d n GLY 108 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1d1d n LEU 109 N 0.00 3.08 -4.70 0.99 7.94 -1.24 -4.18 117.00 118.88 1d1d n LEU 109 Ca 0.00 -1.60 -0.43 0.00 -1.11 0.00 0.00 56.01 52.87 1d1d n LEU 109 Cb 0.00 -0.22 -0.03 0.00 0.53 0.00 0.00 43.42 43.70 1d1d n LEU 109 CO 0.00 0.69 1.35 0.00 -1.11 0.00 0.00 177.39 178.33 1d1d n ALA 110 N 1.07 2.43 -1.55 1.96 0.00 -1.26 -4.64 120.51 118.53 1d1d n ALA 110 Ca 0.15 0.40 -0.50 0.00 0.00 0.00 0.00 53.44 53.49 1d1d n ALA 110 Cb 0.50 -2.50 -0.04 0.00 0.00 0.00 0.00 19.45 17.40 1d1d n ALA 110 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1d1d n ASP 111 N 4.13 0.85 0.00 0.00 -0.08 -1.26 -0.06 116.55 120.13 1d1d n ASP 111 Ca 0.17 1.14 0.00 0.00 -1.51 0.00 0.00 54.79 54.59 1d1d n ASP 111 Cb 0.34 -1.14 0.00 0.00 2.34 0.00 0.00 41.12 42.66 1d1d n ASP 111 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1d1d n GLY 112 N 1.93 3.01 0.10 0.27 0.00 -1.26 -4.80 105.19 104.44 1d1d n GLY 112 Ca 0.16 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.06 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 0.79 -2.22 1.61 2.81 0.91 -4.45 117.12 114.58 1d1d n MET 113 Ca 0.00 0.04 -0.42 0.00 -1.81 0.00 0.00 57.70 55.51 1d1d n MET 113 Cb 0.00 -1.49 -0.03 0.00 -0.71 0.00 0.00 33.22 30.99 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 -2.47 3.72 0.00 2.03 1.01 -1.18 -1.86 120.40 121.65 1d1d s VAL 114 Ca -0.17 1.08 0.00 0.00 0.00 0.00 0.00 61.98 62.89 1d1d s VAL 114 Cb 0.07 -3.70 0.00 0.00 0.00 0.00 0.00 36.38 32.75 1d1d s VAL 114 CO 0.71 -0.01 0.00 0.61 0.00 0.00 0.00 175.10 176.41 1d1d n GLY 115 N 3.68 0.72 2.75 4.51 0.00 -1.26 -5.01 105.19 110.57 1d1d n GLY 115 Ca 0.13 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.98 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 -2.69 1.73 0.00 1.61 -0.87 -0.77 -5.02 114.94 108.93 1d1d s ASN 116 Ca 0.00 -0.71 -0.20 0.00 -1.57 0.00 0.00 52.86 50.38 1d1d s ASN 116 Cb 0.00 0.45 -0.22 0.00 -0.02 0.00 0.00 41.25 41.47 1d1d s ASN 116 CO 0.00 -0.38 1.13 1.55 -2.57 0.00 0.00 177.10 176.82 1d1d h PRO 117 N 8.28 0.38 0.00 -0.60 0.13 -1.96 -0.57 132.00 137.66 1d1d h PRO 117 Ca -0.14 -0.37 -0.12 0.00 -0.87 0.00 0.00 66.00 64.50 1d1d h PRO 117 Cb 1.08 0.10 -0.02 0.00 0.13 0.00 0.00 31.00 32.29 1d1d h PRO 117 CO 0.34 1.03 -0.56 -0.56 -0.23 0.00 0.00 178.00 178.02 1d1d h GLN 118 N -0.14 0.00 0.00 0.86 3.07 -1.95 -2.50 115.11 114.46 1d1d h GLN 118 Ca -0.05 0.00 -0.20 0.00 0.09 0.00 0.00 58.65 58.49 1d1d h GLN 118 Cb 1.18 0.00 0.02 0.00 0.08 0.00 0.00 27.48 28.75 1d1d h GLN 118 CO 0.10 0.56 -0.79 0.78 0.09 0.00 0.00 178.83 179.57 1d1d h GLY 119 N 2.74 0.59 1.21 0.06 0.00 -1.92 -2.61 103.07 103.15 1d1d h GLY 119 Ca -0.01 -1.04 -0.10 0.00 0.00 0.00 0.00 47.33 46.19 1d1d h GLY 119 CO 0.07 0.92 -0.05 0.06 0.00 0.00 0.00 176.54 177.54 1d1d h GLN 120 N 0.10 0.94 -0.75 4.80 3.07 -1.12 0.25 115.11 122.39 1d1d h GLN 120 Ca -0.10 -0.30 -0.05 0.00 0.09 0.00 0.00 58.65 58.29 1d1d h GLN 120 Cb 1.48 -0.08 -0.03 0.00 0.08 0.00 0.00 27.48 28.92 1d1d h GLN 120 CO 0.15 0.96 0.28 0.00 0.09 0.00 0.00 178.83 180.31 1d1d h ALA 121 N 1.08 1.07 0.00 0.06 0.00 -1.50 0.58 119.26 120.55 1d1d h ALA 121 Ca 0.15 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 1d1d h ALA 121 Cb 0.57 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1d1d h ALA 121 CO 0.03 0.65 -0.18 0.00 0.00 0.00 0.00 179.25 179.76 1d1d h ALA 122 N 1.19 0.91 0.15 0.00 0.00 -1.09 -3.17 119.26 117.26 1d1d h ALA 122 Ca 0.25 -0.16 -0.25 0.00 0.00 0.00 0.00 54.91 54.75 1d1d h ALA 122 Cb 0.24 -0.03 0.03 0.00 0.00 0.00 0.00 17.79 18.03 1d1d h ALA 122 CO -0.02 0.22 -1.08 1.25 0.00 0.00 0.00 179.25 179.62 1d1d h LEU 123 N 0.00 0.68 0.00 0.00 6.46 0.66 -3.46 115.31 119.65 1d1d h LEU 123 Ca -0.00 -0.89 0.00 0.00 -0.12 0.00 0.00 57.88 56.86 1d1d h LEU 123 Cb 1.00 -0.22 0.00 0.00 -0.73 0.00 0.00 40.66 40.71 1d1d h LEU 123 CO 0.02 1.52 0.00 0.18 -0.62 0.00 0.00 178.44 179.54 1d1d n LEU 124 N -3.95 0.00 -4.49 2.25 4.77 0.19 -5.07 117.00 110.70 1d1d n LEU 124 Ca -0.14 0.00 -0.25 0.00 -0.03 0.00 0.00 56.01 55.58 1d1d n LEU 124 Cb 0.92 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.91 1d1d n LEU 124 CO 0.54 -0.82 -0.47 0.00 -1.33 0.00 0.00 177.39 175.31 1d1d s ARG 125 N -2.96 1.77 -0.46 3.23 3.03 -1.26 -4.95 118.95 117.35 1d1d s ARG 125 Ca 0.00 -1.57 -0.28 0.00 2.03 0.00 0.00 55.73 55.91 1d1d s ARG 125 Cb 0.00 -1.90 0.01 0.00 -1.03 0.00 0.00 34.95 32.02 1d1d s ARG 125 CO 0.00 0.37 1.44 -1.25 -1.13 0.00 0.00 175.30 174.73 1d1d s PRO 126 N -3.16 3.45 0.00 3.89 0.04 -1.26 -3.34 135.00 134.62 1d1d s PRO 126 Ca 0.26 0.80 0.00 0.00 0.04 0.00 0.00 61.00 62.10 1d1d s PRO 126 Cb -0.07 -4.07 0.00 0.00 0.04 0.00 0.00 34.50 30.40 1d1d s PRO 126 CO 0.14 -1.73 0.00 0.41 0.04 0.00 0.00 177.00 175.86 1d1d n GLY 127 N 5.17 3.50 0.36 0.56 0.00 -1.26 -4.96 105.19 108.56 1d1d n GLY 127 Ca 0.16 -0.51 0.06 0.00 0.00 0.00 0.00 46.02 45.72 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 0.89 -0.40 1.61 5.08 -1.86 -0.82 114.58 119.09 1d1d h GLU 128 Ca 0.00 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1d1d h GLU 128 Cb 0.00 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.03 1d1d h GLU 128 CO 0.00 0.59 0.25 -0.07 -1.00 0.00 0.00 179.01 178.78 1d1d h LEU 129 N 0.92 0.47 -1.03 1.33 3.38 -1.82 -1.26 115.31 117.30 1d1d h LEU 129 Ca 0.38 -0.04 0.03 0.00 0.09 0.00 0.00 57.88 58.34 1d1d h LEU 129 Cb 0.29 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 40.87 1d1d h LEU 129 CO -0.15 0.37 0.65 0.58 0.09 0.00 0.00 178.44 179.98 1d1d h VAL 130 N 0.53 1.21 -0.94 1.22 2.07 -1.49 0.15 116.25 119.00 1d1d h VAL 130 Ca 0.14 -0.44 0.02 0.00 0.82 0.00 0.00 66.70 67.25 1d1d h VAL 130 Cb -0.03 -0.20 -0.05 0.00 -1.52 0.00 0.00 31.29 29.50 1d1d h VAL 130 CO -0.03 0.24 0.62 0.00 0.02 0.00 0.00 177.57 178.41 1d1d h ALA 131 N 1.41 1.22 -0.38 1.67 0.00 -0.40 0.51 119.26 123.29 1d1d h ALA 131 Ca 0.38 -0.05 -0.15 0.00 0.00 0.00 0.00 54.91 55.09 1d1d h ALA 131 Cb -0.06 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.37 1d1d h ALA 131 CO -0.10 0.53 -0.34 0.82 0.00 0.00 0.00 179.25 180.15 1d1d h ILE 132 N 1.22 1.28 -0.08 0.00 2.04 -0.06 0.20 117.51 122.12 1d1d h ILE 132 Ca 0.36 -1.51 -0.01 0.00 1.00 0.00 0.00 64.86 64.71 1d1d h ILE 132 Cb -0.06 1.34 -0.00 0.00 -0.74 0.00 0.00 36.82 37.36 1d1d h ILE 132 CO -0.10 0.50 0.02 0.74 0.00 0.00 0.00 178.15 179.31 1d1d h THR 133 N 0.72 1.19 -0.14 -0.27 2.02 0.34 0.47 112.91 117.25 1d1d h THR 133 Ca 0.07 -0.59 -0.01 0.00 0.77 0.00 0.00 66.41 66.65 1d1d h THR 133 Cb 0.91 1.44 -0.01 0.00 -1.74 0.00 0.00 68.15 68.75 1d1d h THR 133 CO 0.08 0.17 0.04 0.00 0.37 0.00 0.00 175.52 176.18 1d1d h ALA 134 N 0.81 0.18 -0.46 6.16 0.00 0.03 0.82 119.26 126.79 1d1d h ALA 134 Ca 0.02 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 1d1d h ALA 134 Cb 0.25 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 1d1d h ALA 134 CO 0.00 -0.19 0.29 0.77 0.00 0.00 0.00 179.25 180.12 1d1d h SER 135 N 0.03 0.54 -0.31 0.00 0.02 -0.53 0.33 113.55 113.63 1d1d h SER 135 Ca 0.04 -0.02 -0.10 0.00 -0.84 0.00 0.00 61.79 60.87 1d1d h SER 135 Cb 0.24 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.64 1d1d h SER 135 CO -0.00 0.41 -0.19 0.00 -1.14 0.00 0.00 176.83 175.91 1d1d h ALA 136 N 1.68 0.44 -0.63 3.77 0.00 0.38 -1.02 119.26 123.89 1d1d h ALA 136 Ca 0.17 -0.36 -0.09 0.00 0.00 0.00 0.00 54.91 54.64 1d1d h ALA 136 Cb -0.04 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1d1d h ALA 136 CO -0.03 0.38 0.05 -0.07 0.00 0.00 0.00 179.25 179.58 1d1d h LEU 137 N 0.44 1.04 -1.12 0.00 3.38 0.08 -1.92 115.31 117.20 1d1d h LEU 137 Ca 0.06 -0.28 -0.03 0.00 0.09 0.00 0.00 57.88 57.72 1d1d h LEU 137 Cb 0.74 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.18 1d1d h LEU 137 CO 0.05 1.06 0.23 1.56 0.09 0.00 0.00 178.44 181.43 1d1d h GLN 138 N 0.98 0.85 0.00 1.13 4.20 -0.24 -0.88 115.11 121.14 1d1d h GLN 138 Ca 0.18 -0.13 -0.07 0.00 0.06 0.00 0.00 58.65 58.69 1d1d h GLN 138 Cb 0.50 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 28.12 1d1d h GLN 138 CO 0.02 0.70 -0.34 0.00 -0.67 0.00 0.00 178.83 178.54 1d1d h ALA 139 N 1.42 1.24 0.02 3.87 0.00 -0.75 -2.49 119.26 122.57 1d1d h ALA 139 Ca 0.20 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 1d1d h ALA 139 Cb 0.17 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1d1d h ALA 139 CO -0.02 0.42 -0.01 0.35 0.00 0.00 0.00 179.25 179.99 1d1d h PHE 140 N 0.00 -0.02 0.00 0.00 3.04 -0.40 -2.46 116.94 117.10 1d1d h PHE 140 Ca -0.00 -0.00 -0.01 0.00 3.98 0.00 0.00 57.97 61.94 1d1d h PHE 140 Cb 0.68 0.01 -0.00 0.00 2.56 0.00 0.00 35.95 39.19 1d1d h PHE 140 CO 0.00 0.40 -0.05 0.00 -2.02 0.00 0.00 178.31 176.64 1d1d h ARG 141 N -0.44 0.00 -0.12 1.11 3.08 -1.28 0.30 114.38 117.03 1d1d h ARG 141 Ca -0.00 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 59.87 1d1d h ARG 141 Cb 0.42 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.47 1d1d h ARG 141 CO 0.00 0.05 -0.66 1.49 -1.07 0.00 0.00 179.97 179.78 1d1d h GLU 142 N 0.00 0.46 0.16 0.04 4.81 -1.24 0.45 114.58 119.26 1d1d h GLU 142 Ca -0.00 -0.34 -0.23 0.00 -0.13 0.00 0.00 59.36 58.66 1d1d h GLU 142 Cb 0.13 0.06 0.02 0.00 0.63 0.00 0.00 28.75 29.59 1d1d h GLU 142 CO 0.01 0.96 -1.06 0.28 -0.73 0.00 0.00 179.01 178.46 1d1d h VAL 143 N 0.33 1.37 0.00 0.32 2.07 -0.70 0.30 116.25 119.94 1d1d h VAL 143 Ca -0.02 -2.54 -0.00 0.00 0.82 0.00 0.00 66.70 64.96 1d1d h VAL 143 Cb 1.21 3.08 0.00 0.00 -1.52 0.00 0.00 31.29 34.06 1d1d h VAL 143 CO 0.12 0.73 -0.00 0.00 0.02 0.00 0.00 177.57 178.44 1d1d h ALA 144 N 0.07 -0.01 -0.08 1.67 0.00 -0.51 -3.06 119.26 117.34 1d1d h ALA 144 Ca -0.20 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.59 1d1d h ALA 144 Cb 1.77 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.56 1d1d h ALA 144 CO 0.16 -0.49 -0.39 0.00 0.00 0.00 0.00 179.25 178.52 1d1d h ARG 145 N -0.02 0.41 0.00 0.00 3.08 -1.02 -3.45 114.38 113.37 1d1d h ARG 145 Ca -0.00 -0.33 0.00 0.00 0.07 0.00 0.00 59.98 59.72 1d1d h ARG 145 Cb 0.02 0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.14 1d1d h ARG 145 CO 0.00 0.97 0.00 -0.11 -1.07 0.00 0.00 179.97 179.76 1d1d n LEU 146 N -4.35 0.00 0.00 3.04 0.00 0.10 -4.59 117.00 111.20 1d1d n LEU 146 Ca -0.08 0.00 -0.10 0.00 0.00 0.00 0.00 56.01 55.82 1d1d n LEU 146 Cb 0.54 0.00 -0.04 0.00 0.00 0.00 0.00 43.42 43.92 1d1d n LEU 146 CO 0.43 0.00 -0.06 0.00 0.00 0.00 0.00 177.39 177.77 1d1d n ALA 147 N 0.35 0.34 -2.66 1.96 0.00 -1.26 -4.93 120.51 114.31 1d1d n ALA 147 Ca 0.00 -0.98 -0.42 0.00 0.00 0.00 0.00 53.44 52.04 1d1d n ALA 147 Cb 0.00 0.76 -0.03 0.00 0.00 0.00 0.00 19.45 20.18 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 -2.70 4.26 0.32 0.00 -1.05 -1.26 -5.02 118.70 113.25 1d1d s GLU 148 Ca 0.17 1.18 -0.28 0.00 -0.15 0.00 0.00 54.97 55.90 1d1d s GLU 148 Cb 0.01 -3.62 -0.09 0.00 -0.44 0.00 0.00 34.13 29.98 1d1d s GLU 148 CO 0.12 -0.52 1.07 -1.25 0.95 0.00 0.00 175.26 175.63 1d1d s PRO 149 N 2.82 4.49 0.10 -4.83 0.04 -1.26 -5.05 135.00 131.32 1d1d s PRO 149 Ca 0.41 1.69 0.02 0.00 0.04 0.00 0.00 61.00 63.16 1d1d s PRO 149 Cb -0.16 -2.98 -0.04 0.00 0.04 0.00 0.00 34.50 31.37 1d1d s PRO 149 CO 0.08 0.11 0.16 0.00 0.04 0.00 0.00 177.00 177.40 1d1d s ALA 150 N -1.33 3.76 -0.50 8.56 0.00 -1.26 -4.98 121.76 126.00 1d1d s ALA 150 Ca 0.49 -1.01 -0.37 0.00 0.00 0.00 0.00 51.96 51.07 1d1d s ALA 150 Cb -0.28 -1.59 -0.17 0.00 0.00 0.00 0.00 23.12 21.08 1d1d s ALA 150 CO 0.36 0.69 1.95 0.41 0.00 0.00 0.00 175.76 179.17 1d1d n GLY 151 N 0.10 -0.18 0.11 0.00 0.00 -1.26 -4.80 105.19 99.16 1d1d n GLY 151 Ca -0.07 0.98 -0.15 0.00 0.00 0.00 0.00 46.02 46.78 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 8.27 0.23 -0.60 1.61 0.13 -1.93 -3.07 132.00 136.63 1d1d h PRO 152 Ca -0.08 -0.22 0.17 0.00 -0.87 0.00 0.00 66.00 65.00 1d1d h PRO 152 Cb 1.23 0.06 -0.02 0.00 0.13 0.00 0.00 31.00 32.39 1d1d h PRO 152 CO 0.99 0.92 0.54 0.11 -0.23 0.00 0.00 178.00 180.33 1d1d h TRP 153 N -0.38 0.00 -0.22 1.56 0.09 -1.87 1.39 115.95 116.52 1d1d h TRP 153 Ca -0.03 0.00 -0.03 0.00 0.09 0.00 0.00 58.89 58.92 1d1d h TRP 153 Cb 1.01 0.00 -0.01 0.00 0.08 0.00 0.00 29.16 30.24 1d1d h TRP 153 CO 0.16 0.00 -0.01 0.00 0.09 0.00 0.00 178.44 178.68 1d1d h ALA 154 N 1.49 1.58 0.00 0.11 0.00 -1.90 -0.31 119.26 120.23 1d1d h ALA 154 Ca 0.28 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 1d1d h ALA 154 Cb 1.35 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.04 1d1d h ALA 154 CO -0.00 0.31 -0.24 -0.44 0.00 0.00 0.00 179.25 178.88 1d1d h ASP 155 N 0.32 0.00 -3.22 0.00 5.19 0.18 -3.43 116.42 115.46 1d1d h ASP 155 Ca 0.07 0.00 -0.59 0.00 -0.62 0.00 0.00 57.03 55.90 1d1d h ASP 155 Cb 0.24 0.00 -0.07 0.00 0.18 0.00 0.00 39.33 39.67 1d1d h ASP 155 CO 0.01 0.20 0.58 -0.63 -3.12 0.00 0.00 179.24 176.28 1d1d s ILE 156 N -3.11 4.79 -0.05 0.35 1.01 -0.13 -5.03 121.20 119.03 1d1d s ILE 156 Ca 0.05 1.75 0.02 0.00 0.00 0.00 0.00 60.65 62.48 1d1d s ILE 156 Cb 0.06 -4.19 0.01 0.00 0.01 0.00 0.00 42.46 38.35 1d1d s ILE 156 CO 0.70 -0.09 -0.10 -0.89 0.00 0.00 0.00 174.94 174.56 1d1d s THR 157 N 2.84 0.95 0.05 2.92 2.01 -1.26 -4.91 115.64 118.24 1d1d s THR 157 Ca 0.39 -0.40 -0.30 0.00 0.31 0.00 0.00 61.69 61.68 1d1d s THR 157 Cb -0.15 -0.87 -0.09 0.00 0.01 0.00 0.00 72.50 71.40 1d1d s THR 157 CO 0.08 0.31 1.84 -1.58 -0.69 0.00 0.00 174.62 174.58 1d1d s GLN 158 N 0.51 4.15 0.20 4.92 -0.44 -1.25 -4.99 119.66 122.77 1d1d s GLN 158 Ca -0.10 2.50 0.10 0.00 -2.50 0.00 0.00 55.36 55.36 1d1d s GLN 158 Cb -0.13 -3.93 -0.04 0.00 -1.64 0.00 0.00 33.01 27.27 1d1d s GLN 158 CO 0.02 -0.88 -0.20 0.20 0.50 0.00 0.00 175.29 174.93 1d1d s GLY 159 N 3.59 1.59 0.44 2.59 0.00 -1.26 -4.72 107.32 109.54 1d1d s GLY 159 Ca 0.82 -1.63 0.28 0.00 0.00 0.00 0.00 44.72 44.19 1d1d s GLY 159 CO 0.37 -1.69 1.79 -0.56 0.00 0.00 0.00 173.10 173.01 1d1d h PRO 160 N 2.95 0.00 0.00 2.90 0.13 -1.99 -2.80 132.00 133.19 1d1d h PRO 160 Ca -0.42 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.64 1d1d h PRO 160 Cb 1.22 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 1d1d h PRO 160 CO 0.53 0.00 -0.32 0.66 -0.23 0.00 0.00 178.00 178.64 1d1d h SER 161 N 0.00 0.00 -3.71 1.44 4.64 -2.00 -3.44 113.55 110.49 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 0.71 0.00 -0.25 0.00 -0.31 0.00 0.00 62.40 62.55 1d1d h SER 161 CO 0.00 0.32 -0.76 -0.70 -0.87 0.00 0.00 176.83 174.82 1d1d s GLU 162 N -3.11 2.90 0.24 4.77 2.56 -1.06 -5.08 118.70 119.92 1d1d s GLU 162 Ca 0.04 -0.68 -0.31 0.00 0.00 0.00 0.00 54.97 54.02 1d1d s GLU 162 Cb 0.07 -2.50 -0.13 0.00 2.00 0.00 0.00 34.13 33.58 1d1d s GLU 162 CO 0.71 0.45 1.55 0.43 -0.56 0.00 0.00 175.26 177.84 1d1d n SER 163 N 2.83 3.40 -0.36 -1.70 7.64 -1.26 -4.43 113.62 119.74 1d1d n SER 163 Ca -0.18 1.12 0.05 0.00 1.01 0.00 0.00 58.87 60.88 1d1d n SER 163 Cb 0.52 -1.51 0.22 0.00 -1.01 0.00 0.00 64.21 62.44 1d1d n SER 163 CO 0.00 0.00 0.00 0.15 -3.01 0.00 0.00 175.04 172.18 1d1d h PHE 164 N 5.07 1.14 0.10 1.43 3.57 -1.96 1.08 116.94 127.37 1d1d h PHE 164 Ca -0.45 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.07 1d1d h PHE 164 Cb 1.24 -0.37 0.00 0.00 2.79 0.00 0.00 35.95 39.61 1d1d h PHE 164 CO 0.59 0.52 -0.05 0.28 -2.23 0.00 0.00 178.31 177.42 1d1d h VAL 165 N 1.05 1.14 -0.27 1.41 2.07 -1.97 0.63 116.25 120.31 1d1d h VAL 165 Ca 0.46 -1.14 0.04 0.00 0.82 0.00 0.00 66.70 66.89 1d1d h VAL 165 Cb 0.35 1.83 -0.04 0.00 -1.52 0.00 0.00 31.29 31.91 1d1d h VAL 165 CO -0.22 0.26 0.02 -0.78 0.02 0.00 0.00 177.57 176.88 1d1d h ASP 166 N -0.68 -0.06 0.09 0.57 3.58 -1.80 0.19 116.42 118.31 1d1d h ASP 166 Ca -0.01 0.05 -0.10 0.00 0.42 0.00 0.00 57.03 57.39 1d1d h ASP 166 Cb 0.53 0.09 -0.01 0.00 1.72 0.00 0.00 39.33 41.66 1d1d h ASP 166 CO 0.02 0.00 -0.35 0.15 -2.88 0.00 0.00 179.24 176.19 1d1d h PHE 167 N 0.11 0.42 0.09 0.28 3.04 0.12 -2.78 116.94 118.22 1d1d h PHE 167 Ca 0.13 -0.10 -0.00 0.00 3.98 0.00 0.00 57.97 61.97 1d1d h PHE 167 Cb 0.16 -0.10 0.00 0.00 2.56 0.00 0.00 35.95 38.57 1d1d h PHE 167 CO -0.19 0.67 -0.05 0.00 -2.02 0.00 0.00 178.31 176.72 1d1d h ALA 168 N 1.33 -0.13 -0.84 2.41 0.00 0.14 -2.23 119.26 119.94 1d1d h ALA 168 Ca 0.04 -0.07 0.14 0.00 0.00 0.00 0.00 54.91 55.01 1d1d h ALA 168 Cb 0.76 0.05 -0.09 0.00 0.00 0.00 0.00 17.79 18.51 1d1d h ALA 168 CO 0.06 -0.52 0.44 -0.91 0.00 0.00 0.00 179.25 178.31 1d1d h ASN 169 N -0.22 0.54 -0.77 0.00 2.35 -0.56 0.33 115.58 117.24 1d1d h ASN 169 Ca -0.01 0.09 0.08 0.00 -0.55 0.00 0.00 56.30 55.90 1d1d h ASN 169 Cb 0.18 -0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.50 1d1d h ASN 169 CO 0.02 0.24 0.50 0.03 -1.65 0.00 0.00 177.43 176.57 1d1d h ARG 170 N 0.64 0.73 -0.10 0.81 -0.00 -1.16 0.19 114.38 115.48 1d1d h ARG 170 Ca 0.45 -0.04 -0.11 0.00 -0.50 0.00 0.00 59.98 59.78 1d1d h ARG 170 Cb 0.61 -0.16 -0.01 0.00 0.00 0.00 0.00 29.97 30.40 1d1d h ARG 170 CO -0.35 0.48 -0.42 1.25 0.00 0.00 0.00 179.97 180.94 1d1d h LEU 171 N 0.75 0.23 -0.30 3.04 6.46 0.19 -0.12 115.31 125.56 1d1d h LEU 171 Ca 0.34 -0.10 -0.09 0.00 -0.12 0.00 0.00 57.88 57.92 1d1d h LEU 171 Cb 0.36 -0.06 -0.01 0.00 -0.73 0.00 0.00 40.66 40.21 1d1d h LEU 171 CO -0.12 0.63 -0.15 0.40 -0.62 0.00 0.00 178.44 178.57 1d1d h ILE 172 N 0.18 1.29 -0.21 4.05 1.08 0.31 0.42 117.51 124.64 1d1d h ILE 172 Ca 0.02 -1.26 -0.09 0.00 -0.39 0.00 0.00 64.86 63.14 1d1d h ILE 172 Cb 0.82 1.47 -0.01 0.00 -3.07 0.00 0.00 36.82 36.03 1d1d h ILE 172 CO 0.06 0.40 -0.27 0.11 -0.69 0.00 0.00 178.15 177.77 1d1d h LYS 173 N 0.39 0.40 0.13 2.37 6.56 -0.83 0.54 116.57 126.13 1d1d h LYS 173 Ca 0.07 -0.15 -0.01 0.00 -1.06 0.00 0.00 60.65 59.50 1d1d h LYS 173 Cb 0.68 -0.02 0.00 0.00 -0.57 0.00 0.00 32.23 32.31 1d1d h LYS 173 CO 0.05 0.64 -0.06 0.00 -2.06 0.00 0.00 179.45 178.02 1d1d h ALA 174 N 1.36 -0.17 -0.08 3.86 0.00 -0.78 0.50 119.26 123.96 1d1d h ALA 174 Ca 0.05 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1d1d h ALA 174 Cb 0.66 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 1d1d h ALA 174 CO 0.05 -0.32 0.05 0.28 0.00 0.00 0.00 179.25 179.31 1d1d h VAL 175 N -0.73 1.04 -0.13 0.00 2.07 -0.08 0.19 116.25 118.61 1d1d h VAL 175 Ca -0.02 -0.09 -0.06 0.00 0.82 0.00 0.00 66.70 67.36 1d1d h VAL 175 Cb 0.53 0.95 -0.01 0.00 -1.52 0.00 0.00 31.29 31.24 1d1d h VAL 175 CO 0.03 0.03 -0.18 1.05 0.02 0.00 0.00 177.57 178.52 1d1d h GLU 176 N 0.09 0.21 -0.78 1.57 -0.00 0.03 -1.73 114.58 113.98 1d1d h GLU 176 Ca 0.03 -0.05 -0.17 0.00 -0.00 0.00 0.00 59.36 59.16 1d1d h GLU 176 Cb 0.01 -0.03 -0.10 0.00 -0.00 0.00 0.00 28.75 28.63 1d1d h GLU 176 CO -0.01 0.39 0.22 0.41 -0.00 0.00 0.00 179.01 180.02 1d1d n GLY 177 N -0.78 3.30 3.52 1.06 0.00 0.18 -4.92 105.19 107.55 1d1d n GLY 177 Ca -0.01 -0.85 -0.25 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 -0.78 3.36 -1.53 1.61 1.04 0.60 -4.90 113.70 113.09 1d1d s SER 178 Ca 0.48 -1.24 -0.12 0.00 0.48 0.00 0.00 55.95 55.54 1d1d s SER 178 Cb 0.38 -0.28 -0.02 0.00 0.10 0.00 0.00 66.02 66.20 1d1d s SER 178 CO 0.12 -0.33 2.56 -0.90 0.98 0.00 0.00 173.24 175.67 1d1d n ASP 179 N -0.76 6.18 -4.65 7.02 5.75 -1.26 -4.90 116.55 123.94 1d1d n ASP 179 Ca -0.05 -2.73 -0.26 0.00 -0.01 0.00 0.00 54.79 51.74 1d1d n ASP 179 Cb 0.64 -1.61 -0.08 0.00 -1.03 0.00 0.00 41.12 39.05 1d1d n ASP 179 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1d1d s LEU 180 N 1.17 3.26 0.69 -2.12 1.43 -1.26 -5.12 118.68 116.72 1d1d s LEU 180 Ca 0.57 -0.45 -0.11 0.00 -1.03 0.00 0.00 54.13 53.12 1d1d s LEU 180 Cb 0.16 -1.90 0.00 0.00 0.03 0.00 0.00 46.19 44.48 1d1d s LEU 180 CO -0.07 0.08 1.06 -2.16 0.23 0.00 0.00 176.35 175.49 1d1d s PRO 181 N -3.01 2.97 -0.91 1.29 0.04 -1.26 -4.90 135.00 129.22 1d1d s PRO 181 Ca 0.27 0.97 -0.07 0.00 0.04 0.00 0.00 61.00 62.21 1d1d s PRO 181 Cb -0.09 -1.99 -0.10 0.00 0.04 0.00 0.00 34.50 32.36 1d1d s PRO 181 CO 0.18 -1.08 2.57 -0.35 0.04 0.00 0.00 177.00 178.36 1d1d n PRO 182 N -3.07 2.45 0.00 0.56 -0.04 -1.26 -2.66 135.00 130.99 1d1d n PRO 182 Ca 0.08 -1.51 0.00 0.00 -0.04 0.00 0.00 63.50 62.02 1d1d n PRO 182 Cb 0.53 -2.42 0.00 0.00 -0.04 0.00 0.00 33.50 31.58 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 3.60 0.00 0.04 3.54 2.88 -1.26 -4.90 113.62 117.52 1d1d n SER 183 Ca 0.52 0.00 0.09 0.00 -1.33 0.00 0.00 58.87 58.15 1d1d n SER 183 Cb 0.30 0.06 0.38 0.00 -0.75 0.00 0.00 64.21 64.20 1d1d n SER 183 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1d1d n ALA 184 N -1.33 1.74 -1.59 -1.46 0.00 -1.09 -3.99 120.51 112.80 1d1d n ALA 184 Ca 0.00 -0.02 -0.41 0.00 0.00 0.00 0.00 53.44 53.02 1d1d n ALA 184 Cb 0.00 -1.30 -0.01 0.00 0.00 0.00 0.00 19.45 18.14 1d1d n ALA 184 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1d1d n ARG 185 N -1.72 3.34 0.00 0.00 0.63 -1.23 -2.20 116.66 115.48 1d1d n ARG 185 Ca 0.03 -2.50 0.00 0.00 -0.92 0.00 0.00 57.85 54.46 1d1d n ARG 185 Cb 0.21 -3.03 0.00 0.00 0.45 0.00 0.00 32.46 30.09 1d1d n ARG 185 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1d1d n ALA 186 N 4.70 0.00 0.13 5.13 0.00 -1.26 -4.89 120.51 124.32 1d1d n ALA 186 Ca 0.64 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 54.07 1d1d n ALA 186 Cb 0.31 0.00 0.12 0.00 0.00 0.00 0.00 19.45 19.88 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 -0.48 0.00 0.13 -1.71 -2.59 132.00 127.35 1d1d h PRO 187 Ca 0.00 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 65.01 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 0.64 -0.16 0.28 -0.23 0.00 0.00 178.00 178.53 1d1d h VAL 188 N 0.00 1.27 -0.07 1.56 2.07 -1.77 0.79 116.25 120.09 1d1d h VAL 188 Ca -0.01 -1.30 -0.02 0.00 0.82 0.00 0.00 66.70 66.20 1d1d h VAL 188 Cb 1.25 1.07 -0.00 0.00 -1.52 0.00 0.00 31.29 32.08 1d1d h VAL 188 CO 0.08 0.45 -0.02 0.40 0.02 0.00 0.00 177.57 178.50 1d1d h ILE 189 N 0.82 1.30 -0.37 4.57 2.04 -1.74 0.22 117.51 124.34 1d1d h ILE 189 Ca 0.12 -0.94 -0.08 0.00 1.00 0.00 0.00 64.86 64.96 1d1d h ILE 189 Cb 0.70 1.77 -0.02 0.00 -0.74 0.00 0.00 36.82 38.54 1d1d h ILE 189 CO 0.05 0.26 -0.11 0.40 0.00 0.00 0.00 178.15 178.75 1d1d h ILE 190 N -0.20 1.25 -0.60 -0.67 2.04 -1.35 -2.44 117.51 115.53 1d1d h ILE 190 Ca 0.02 -1.10 -0.10 0.00 1.00 0.00 0.00 64.86 64.68 1d1d h ILE 190 Cb 0.42 1.09 -0.02 0.00 -0.74 0.00 0.00 36.82 37.57 1d1d h ILE 190 CO 0.01 0.37 -0.01 0.44 0.00 0.00 0.00 178.15 178.95 1d1d h ASP 191 N 0.59 1.05 -0.74 1.72 3.32 0.78 -2.46 116.42 120.67 1d1d h ASP 191 Ca 0.10 -0.31 0.10 0.00 0.02 0.00 0.00 57.03 56.95 1d1d h ASP 191 Cb 0.54 -0.28 -0.08 0.00 0.22 0.00 0.00 39.33 39.73 1d1d h ASP 191 CO 0.03 1.11 0.38 0.00 -1.72 0.00 0.00 179.24 179.03 1d1d h PHE 193 N 0.62 -0.06 -0.21 0.00 0.04 -1.14 -1.28 116.94 114.90 1d1d h PHE 193 Ca 0.37 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.14 1d1d h PHE 193 Cb 0.42 0.03 0.00 0.00 2.20 0.00 0.00 35.95 38.59 1d1d h PHE 193 CO -0.10 -0.04 0.00 2.89 -0.60 0.00 0.00 178.31 180.46 1d1d n ARG 194 N -5.13 2.39 -0.07 1.51 -4.01 -0.57 -2.90 116.66 107.88 1d1d n ARG 194 Ca -0.07 -1.14 -0.08 0.00 -1.04 0.00 0.00 57.85 55.53 1d1d n ARG 194 Cb 0.06 -1.76 -0.10 0.00 -3.04 0.00 0.00 32.46 27.62 1d1d n ARG 194 CO 0.00 0.00 0.00 1.04 -3.04 0.00 0.00 177.63 175.63 1d1d n GLN 195 N 0.23 1.45 -2.72 2.89 6.02 0.19 -4.87 117.38 120.56 1d1d n GLN 195 Ca 0.10 0.02 -0.06 0.00 -0.01 0.00 0.00 57.00 57.05 1d1d n GLN 195 Cb 0.58 -1.35 0.05 0.00 1.02 0.00 0.00 30.24 30.54 1d1d n GLN 195 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.06 177.22 1d1d n LYS 196 N -2.63 0.51 -4.04 -1.09 0.00 -0.99 -5.06 118.16 104.86 1d1d n LYS 196 Ca -0.25 -1.46 -0.09 0.00 0.00 0.00 0.00 58.31 56.52 1d1d n LYS 196 Cb 0.92 -1.02 -0.09 0.00 0.00 0.00 0.00 35.03 34.85 1d1d n LYS 196 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 1d1d s SER 197 N -0.57 0.26 1.02 3.14 1.04 -1.14 -3.92 113.70 113.53 1d1d s SER 197 Ca 0.29 -0.99 -0.22 0.00 0.48 0.00 0.00 55.95 55.51 1d1d s SER 197 Cb 0.17 0.31 -0.10 0.00 0.10 0.00 0.00 66.02 66.50 1d1d s SER 197 CO -0.16 -0.73 -0.89 0.00 0.98 0.00 0.00 173.24 172.44 1d1d n GLN 198 N -0.06 -0.39 0.04 4.02 3.00 -1.26 -4.51 117.38 118.21 1d1d n GLN 198 Ca -0.10 -0.11 -0.15 0.00 -0.01 0.00 0.00 57.00 56.64 1d1d n GLN 198 Cb 0.63 -1.23 -0.05 0.00 0.00 0.00 0.00 30.24 29.59 1d1d n GLN 198 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.06 176.06 1d1d h PRO 199 N -1.29 0.55 -0.06 -1.09 0.13 -2.00 0.17 132.00 128.42 1d1d h PRO 199 Ca -0.44 -0.53 -0.01 0.00 -0.87 0.00 0.00 66.00 64.15 1d1d h PRO 199 Cb 1.36 0.14 -0.00 0.00 0.13 0.00 0.00 31.00 32.63 1d1d h PRO 199 CO 0.26 1.16 0.01 0.38 -0.23 0.00 0.00 178.00 179.58 1d1d h ASP 200 N 0.34 0.09 -0.08 1.44 2.03 -1.97 1.57 116.42 119.83 1d1d h ASP 200 Ca -0.08 -0.27 -0.13 0.00 -0.73 0.00 0.00 57.03 55.83 1d1d h ASP 200 Cb 1.52 -0.02 -0.01 0.00 -0.83 0.00 0.00 39.33 39.98 1d1d h ASP 200 CO 0.16 0.33 -0.36 0.40 -1.03 0.00 0.00 179.24 178.75 1d1d h ILE 201 N -0.15 1.29 -0.05 4.15 1.08 -1.91 -1.00 117.51 120.92 1d1d h ILE 201 Ca 0.02 -1.50 -0.03 0.00 -0.39 0.00 0.00 64.86 62.96 1d1d h ILE 201 Cb 0.28 1.48 -0.00 0.00 -3.07 0.00 0.00 36.82 35.51 1d1d h ILE 201 CO 0.00 0.48 -0.07 -0.61 -0.69 0.00 0.00 178.15 177.26 1d1d h GLN 202 N 0.49 0.14 0.00 2.37 5.75 -0.45 -2.55 115.11 120.86 1d1d h GLN 202 Ca 0.05 -0.08 -0.01 0.00 -0.15 0.00 0.00 58.65 58.46 1d1d h GLN 202 Cb 0.85 0.01 -0.00 0.00 1.07 0.00 0.00 27.48 29.41 1d1d h GLN 202 CO 0.07 0.62 -0.06 1.96 -2.65 0.00 0.00 178.83 178.77 1d1d h GLN 203 N -0.34 0.00 0.07 1.69 1.08 0.23 0.24 115.11 118.09 1d1d h GLN 203 Ca 0.01 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1d1d h GLN 203 Cb 0.60 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.03 1d1d h GLN 203 CO 0.02 0.06 -0.03 1.25 -0.95 0.00 0.00 178.83 179.17 1d1d h LEU 204 N 0.00 -0.08 -0.39 1.46 6.46 -1.04 0.42 115.31 122.14 1d1d h LEU 204 Ca -0.00 -0.32 -0.05 0.00 -0.12 0.00 0.00 57.88 57.39 1d1d h LEU 204 Cb 0.11 0.02 -0.01 0.00 -0.73 0.00 0.00 40.66 40.05 1d1d h LEU 204 CO 0.01 0.29 0.04 0.40 -0.62 0.00 0.00 178.44 178.56 1d1d h ILE 205 N -0.46 1.25 -0.27 4.05 5.03 -0.98 0.82 117.51 126.95 1d1d h ILE 205 Ca -0.01 -0.91 -0.03 0.00 -0.12 0.00 0.00 64.86 63.79 1d1d h ILE 205 Cb 0.40 1.08 -0.01 0.00 -3.03 0.00 0.00 36.82 35.25 1d1d h ILE 205 CO 0.02 0.31 0.02 0.03 -0.68 0.00 0.00 178.15 177.85 1d1d h ARG 206 N 0.50 0.40 -0.01 2.37 3.08 -0.51 -0.26 114.38 119.95 1d1d h ARG 206 Ca 0.12 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.10 1d1d h ARG 206 Cb 0.40 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.38 1d1d h ARG 206 CO 0.01 0.41 -0.32 0.00 -1.07 0.00 0.00 179.97 179.00 1d1d n ALA 207 N -2.49 3.22 -1.29 0.04 0.00 0.15 -4.93 120.51 115.21 1d1d n ALA 207 Ca 0.01 -0.43 -0.33 0.00 0.00 0.00 0.00 53.44 52.68 1d1d n ALA 207 Cb 0.20 -1.08 0.09 0.00 0.00 0.00 0.00 19.45 18.66 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 -2.56 2.12 0.42 0.00 0.00 0.28 -4.98 121.76 117.04 1d1d s ALA 208 Ca 0.22 0.71 -0.23 0.00 0.00 0.00 0.00 51.96 52.66 1d1d s ALA 208 Cb 0.19 -3.42 -0.09 0.00 0.00 0.00 0.00 23.12 19.80 1d1d s ALA 208 CO 0.55 -1.86 1.05 -1.25 0.00 0.00 0.00 175.76 174.25 1d1d s PRO 209 N -4.14 4.07 0.00 0.00 0.04 -1.26 -4.91 135.00 128.80 1d1d s PRO 209 Ca 0.70 1.49 0.09 0.00 0.04 0.00 0.00 61.00 63.32 1d1d s PRO 209 Cb -0.25 -2.44 0.38 0.00 0.04 0.00 0.00 34.50 32.24 1d1d s PRO 209 CO 0.47 -0.22 1.28 -1.13 0.04 0.00 0.00 177.00 177.44 1d1d n SER 210 N -0.29 0.00 0.06 6.66 3.41 -1.26 -1.37 113.62 120.83 1d1d n SER 210 Ca 0.06 0.48 0.11 0.00 -0.26 0.00 0.00 58.87 59.25 1d1d n SER 210 Cb 0.50 -0.49 0.43 0.00 -0.26 0.00 0.00 64.21 64.40 1d1d n SER 210 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 1d1d n THR 211 N -1.49 0.74 -4.64 6.66 5.66 -1.26 -4.64 114.28 115.32 1d1d n THR 211 Ca 0.02 0.14 -0.33 0.00 -3.05 0.00 0.00 64.05 60.82 1d1d n THR 211 Cb 0.10 -0.93 -0.12 0.00 -1.55 0.00 0.00 70.33 67.83 1d1d n THR 211 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 1d1d s LEU 212 N -3.73 3.03 -0.01 1.09 1.43 -0.47 -4.95 118.68 115.08 1d1d s LEU 212 Ca 0.07 -0.14 0.00 0.00 -1.03 0.00 0.00 54.13 53.04 1d1d s LEU 212 Cb 0.11 -1.68 0.01 0.00 0.03 0.00 0.00 46.19 44.66 1d1d s LEU 212 CO 0.39 0.27 0.67 0.35 0.23 0.00 0.00 176.35 178.26 1d1d n THR 213 N 2.85 0.00 -4.24 5.49 -2.24 -1.26 -4.89 114.28 109.98 1d1d n THR 213 Ca -0.18 -0.03 -0.18 0.00 -2.27 0.00 0.00 64.05 61.39 1d1d n THR 213 Cb 0.53 0.34 -0.11 0.00 -2.10 0.00 0.00 70.33 68.99 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 0.00 1.35 -0.61 4.28 -4.23 -1.26 -4.12 115.64 111.05 1d1d s THR 214 Ca 0.00 -1.72 -0.06 0.00 -1.18 0.00 0.00 61.69 58.73 1d1d s THR 214 Cb 0.01 -1.54 -0.13 0.00 1.34 0.00 0.00 72.50 72.18 1d1d s THR 214 CO -0.00 -0.41 2.66 -0.81 -0.54 0.00 0.00 174.62 175.52 1d1d n PRO 215 N 0.53 2.14 0.03 3.99 -0.04 -1.26 -2.85 135.00 137.55 1d1d n PRO 215 Ca -0.15 -1.26 0.00 0.00 -0.04 0.00 0.00 63.50 62.04 1d1d n PRO 215 Cb 0.57 -2.24 0.00 0.00 -0.04 0.00 0.00 33.50 31.79 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 3.16 -0.84 0.17 0.55 0.00 -1.26 -4.91 105.19 102.05 1d1d n GLY 216 Ca 0.46 0.12 -0.09 0.00 0.00 0.00 0.00 46.02 46.51 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 0.34 -0.42 1.61 3.07 -1.96 0.21 114.58 117.43 1d1d h GLU 217 Ca 0.00 -0.28 -0.02 0.00 -0.50 0.00 0.00 59.36 58.55 1d1d h GLU 217 Cb 0.00 0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 27.95 1d1d h GLU 217 CO 0.00 0.93 0.17 0.82 -1.40 0.00 0.00 179.01 179.54 1d1d h ILE 218 N 0.23 1.20 -0.06 3.13 5.03 -1.89 0.47 117.51 125.61 1d1d h ILE 218 Ca -0.03 -0.60 -0.11 0.00 -0.12 0.00 0.00 64.86 64.00 1d1d h ILE 218 Cb 1.31 0.81 0.01 0.00 -3.03 0.00 0.00 36.82 35.91 1d1d h ILE 218 CO 0.12 0.22 -0.39 0.40 -0.68 0.00 0.00 178.15 177.83 1d1d h ILE 219 N 0.54 1.42 -0.88 -0.67 2.04 -1.80 0.22 117.51 118.38 1d1d h ILE 219 Ca 0.14 -1.80 0.08 0.00 1.00 0.00 0.00 64.86 64.28 1d1d h ILE 219 Cb 0.18 2.35 -0.06 0.00 -0.74 0.00 0.00 36.82 38.55 1d1d h ILE 219 CO -0.01 0.52 0.57 0.50 0.00 0.00 0.00 178.15 179.73 1d1d h LYS 220 N -0.11 0.89 -0.05 2.37 3.64 -0.45 0.60 116.57 123.47 1d1d h LYS 220 Ca -0.03 -0.05 -0.11 0.00 -1.27 0.00 0.00 60.65 59.19 1d1d h LYS 220 Cb 1.05 -0.20 0.01 0.00 -0.41 0.00 0.00 32.23 32.67 1d1d h LYS 220 CO 0.08 0.59 -0.39 -0.92 -2.27 0.00 0.00 179.45 176.54 1d1d h TYR 221 N 0.92 0.49 -0.07 1.91 3.20 -0.02 -0.75 116.97 122.65 1d1d h TYR 221 Ca 0.39 -0.23 0.00 0.00 3.14 0.00 0.00 58.73 62.03 1d1d h TYR 221 Cb 0.31 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.51 1d1d h TYR 221 CO -0.00 1.00 0.03 0.28 -1.64 0.00 0.00 178.16 177.83 1d1d h VAL 222 N -0.16 1.00 -0.68 1.81 2.07 -0.21 0.26 116.25 120.33 1d1d h VAL 222 Ca -0.04 -0.02 -0.01 0.00 0.82 0.00 0.00 66.70 67.45 1d1d h VAL 222 Cb 1.07 0.92 -0.03 0.00 -1.52 0.00 0.00 31.29 31.73 1d1d h VAL 222 CO 0.08 0.01 0.38 -0.07 0.02 0.00 0.00 177.57 177.99 1d1d h LEU 223 N 0.07 0.85 -1.75 2.57 3.38 0.12 0.47 115.31 121.02 1d1d h LEU 223 Ca 0.03 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 1d1d h LEU 223 Cb 0.00 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 1d1d h LEU 223 CO -0.02 0.70 -0.02 0.44 0.09 0.00 0.00 178.44 179.63 1d1d h ASP 224 N 0.93 0.12 0.41 -0.43 5.19 -0.59 -1.81 116.42 120.25 1d1d h ASP 224 Ca 0.24 -0.01 -0.30 0.00 -0.62 0.00 0.00 57.03 56.34 1d1d h ASP 224 Cb 0.03 -0.03 0.02 0.00 0.18 0.00 0.00 39.33 39.54 1d1d h ASP 224 CO -0.04 0.16 -1.34 -0.09 -3.12 0.00 0.00 179.24 174.81 1d1d h ARG 225 N 0.13 0.43 -0.07 3.56 1.12 0.89 -3.33 114.38 117.11 1d1d h ARG 225 Ca 0.03 -0.71 0.04 0.00 -1.11 0.00 0.00 59.98 58.23 1d1d h ARG 225 Cb 0.13 0.26 -0.06 0.00 -0.01 0.00 0.00 29.97 30.29 1d1d h ARG 225 CO 0.00 1.33 -0.36 1.96 -3.11 0.00 0.00 179.97 179.80 1d1d h GLN 226 N 0.13 -0.46 -3.00 0.20 4.20 0.72 -3.48 115.11 113.42 1d1d h GLN 226 Ca -0.19 0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.55 1d1d h GLN 226 Cb 2.05 0.10 0.00 0.00 0.30 0.00 0.00 27.48 29.93 1d1d h GLN 226 CO 0.24 -0.30 -0.77 1.63 -0.67 0.00 0.00 178.83 178.96 1d1d n LYS 227 N -5.43 -3.43 -0.09 1.46 5.02 -0.99 -4.95 118.16 109.77 1d1d n LYS 227 Ca -0.04 2.63 -0.08 0.00 -2.02 0.00 0.00 58.31 58.79 1d1d n LYS 227 Cb 0.34 -3.18 -0.03 0.00 -0.02 0.00 0.00 35.03 32.14 1d1d n LYS 227 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 1d1d n ILE 228 N -1.96 1.47 -2.55 -0.18 -0.00 -1.26 -4.98 119.36 109.91 1d1d n ILE 228 Ca 0.00 0.15 -0.31 0.00 -0.00 0.00 0.00 62.75 62.58 1d1d n ILE 228 Cb 0.27 -2.34 -0.03 0.00 -0.00 0.00 0.00 39.64 37.54 1d1d n ILE 228 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1d1d s ALA 229 N -2.83 3.17 -2.00 -1.39 0.00 -1.26 -5.30 121.76 112.15 1d1d s ALA 229 Ca -0.25 0.03 0.24 0.00 0.00 0.00 0.00 51.96 51.98 1d1d s ALA 229 Cb 0.04 -2.96 1.43 0.00 0.00 0.00 0.00 23.12 21.63 1d1d s ALA 229 CO 0.37 -0.16 1.80 -0.35 0.00 0.00 0.00 175.76 177.41