#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1icp s VAL 11 N 0.00 1.41 0.29 1.69 1.01 -1.26 -5.12 120.40 118.42 1icp s VAL 11 Ca 0.00 -0.61 -0.29 0.00 0.00 0.00 0.00 61.98 61.08 1icp s VAL 11 Cb 0.00 -1.29 -0.10 0.00 0.00 0.00 0.00 36.38 35.00 1icp s VAL 11 CO 0.00 0.42 1.31 -1.81 0.00 0.00 0.00 175.10 175.02 1icp s ASP 12 N 0.87 6.83 0.60 3.32 1.01 -1.26 -4.98 116.67 123.06 1icp s ASP 12 Ca -0.10 2.59 -0.18 0.00 0.71 0.00 0.00 52.55 55.57 1icp s ASP 12 Cb -0.15 -2.64 -0.03 0.00 1.01 0.00 0.00 42.92 41.11 1icp s ASP 12 CO 0.01 -0.52 1.19 -0.54 0.21 0.00 0.00 175.17 175.52 1icp s LYS 13 N -1.22 2.96 0.09 8.23 1.02 -1.26 -5.04 119.74 124.52 1icp s LYS 13 Ca 0.52 1.77 0.04 0.00 0.02 0.00 0.00 55.97 58.31 1icp s LYS 13 Cb -0.39 -1.93 -0.03 0.00 -0.52 0.00 0.00 37.83 34.96 1icp s LYS 13 CO 0.47 -1.20 -0.11 0.96 -0.92 0.00 0.00 175.35 174.55 1icp s ILE 14 N -1.69 1.00 0.29 2.17 -4.36 -1.26 -5.06 121.20 112.30 1icp s ILE 14 Ca 0.76 -1.54 0.04 0.00 -0.26 0.00 0.00 60.65 59.65 1icp s ILE 14 Cb -0.29 -1.26 0.30 0.00 1.25 0.00 0.00 42.46 42.46 1icp s ILE 14 CO 0.33 -0.46 1.67 -0.65 0.24 0.00 0.00 174.94 176.08 1icp h PRO 15 N 3.78 0.28 0.00 0.37 0.11 -1.96 0.59 132.00 135.17 1icp h PRO 15 Ca -0.38 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.71 1icp h PRO 15 Cb 1.19 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 1icp h PRO 15 CO 0.49 0.19 -0.00 -0.07 -0.21 0.00 0.00 178.00 178.40 1icp h LEU 16 N 0.29 0.00 -1.46 2.35 3.38 -1.89 -1.04 115.31 116.94 1icp h LEU 16 Ca 0.57 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.54 1icp h LEU 16 Cb 1.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.89 1icp h LEU 16 CO -0.60 0.00 0.00 0.23 0.09 0.00 0.00 178.44 178.16 1icp n MET 17 N -3.64 1.99 -2.14 1.13 2.81 0.19 -0.88 117.12 116.58 1icp n MET 17 Ca -0.03 -1.45 -0.41 0.00 -1.81 0.00 0.00 57.70 54.00 1icp n MET 17 Cb 0.08 -1.46 -0.02 0.00 -0.71 0.00 0.00 33.22 31.10 1icp n MET 17 CO 0.00 0.00 0.00 -1.12 1.51 0.00 0.00 175.97 176.36 1icp s SER 18 N -1.86 6.80 0.69 7.83 0.01 -0.40 -4.44 113.70 122.34 1icp s SER 18 Ca 0.34 2.60 -0.16 0.00 1.31 0.00 0.00 55.95 60.04 1icp s SER 18 Cb 0.20 -2.63 0.02 0.00 0.21 0.00 0.00 66.02 63.82 1icp s SER 18 CO 0.31 -0.54 1.18 -2.84 0.41 0.00 0.00 173.24 171.76 1icp s PRO 19 N -1.13 2.42 -0.07 12.44 0.02 -1.25 -3.70 135.00 143.73 1icp s PRO 19 Ca 0.52 1.69 -0.06 0.00 0.02 0.00 0.00 61.00 63.17 1icp s PRO 19 Cb -0.39 -1.88 0.02 0.00 0.02 0.00 0.00 34.50 32.28 1icp s PRO 19 CO 0.47 -1.60 0.19 0.00 -0.33 0.00 0.00 177.00 175.73 1icp s LYS 21 N 0.34 3.25 -0.57 0.00 2.47 -1.26 0.39 119.74 124.36 1icp s LYS 21 Ca -0.02 -0.60 0.03 0.00 -1.56 0.00 0.00 55.97 53.82 1icp s LYS 21 Cb -0.03 -3.92 0.14 0.00 -1.46 0.00 0.00 37.83 32.56 1icp s LYS 21 CO -0.01 -0.78 0.33 1.41 0.16 0.00 0.00 175.35 176.45 1icp s MET 22 N 2.20 2.16 7.83 4.03 -2.45 0.54 -5.00 119.30 128.61 1icp s MET 22 Ca 0.14 -2.75 0.00 0.00 -1.25 0.00 0.00 55.69 51.83 1icp s MET 22 Cb -0.17 -3.40 0.00 0.00 1.25 0.00 0.00 34.83 32.51 1icp s MET 22 CO 0.14 -1.15 0.00 0.41 1.05 0.00 0.00 175.02 175.47 1icp n GLY 23 N 2.95 3.42 0.00 2.11 0.00 -1.26 -1.42 105.19 111.00 1icp n GLY 23 Ca 0.08 -0.10 0.14 0.00 0.00 0.00 0.00 46.02 46.13 1icp n GLY 23 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1icp n LYS 24 N 13.38 0.06 -3.84 1.61 2.85 -1.26 -4.85 118.16 126.11 1icp n LYS 24 Ca 0.00 -0.01 -0.37 0.00 -1.05 0.00 0.00 58.31 56.89 1icp n LYS 24 Cb 0.00 -1.50 -0.06 0.00 -0.65 0.00 0.00 35.03 32.82 1icp n LYS 24 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 177.40 177.29 1icp s PHE 25 N -2.95 3.61 -0.35 5.58 0.40 -0.51 -5.07 117.98 118.69 1icp s PHE 25 Ca 0.15 0.56 -0.10 0.00 -0.60 0.00 0.00 56.93 56.95 1icp s PHE 25 Cb 0.19 -1.97 0.02 0.00 0.51 0.00 0.00 43.02 41.77 1icp s PHE 25 CO 0.54 0.71 0.18 -1.21 0.70 0.00 0.00 175.22 176.14 1icp s GLU 26 N -1.16 2.89 0.07 0.44 0.41 -1.26 -0.34 118.70 119.75 1icp s GLU 26 Ca 0.18 -1.03 -0.07 0.00 -0.41 0.00 0.00 54.97 53.64 1icp s GLU 26 Cb -0.13 -3.64 -0.05 0.00 -1.78 0.00 0.00 34.13 28.53 1icp s GLU 26 CO 0.07 -0.64 0.34 -0.51 -0.49 0.00 0.00 175.26 174.03 1icp s LEU 27 N 1.54 4.33 0.06 1.80 1.43 0.16 -4.78 118.68 123.23 1icp s LEU 27 Ca 0.02 0.62 0.23 0.00 -1.03 0.00 0.00 54.13 53.97 1icp s LEU 27 Cb -0.19 -2.97 0.18 0.00 0.03 0.00 0.00 46.19 43.24 1icp s LEU 27 CO 0.06 0.16 1.15 0.00 0.23 0.00 0.00 176.35 177.95 1icp s HIS 29 N -3.16 -0.15 -2.25 0.00 0.00 -1.25 -3.82 115.29 104.65 1icp s HIS 29 Ca 0.05 -0.34 0.21 0.00 -3.00 0.00 0.00 55.06 51.99 1icp s HIS 29 Cb 0.14 0.73 0.37 0.00 -4.00 0.00 0.00 32.58 29.82 1icp s HIS 29 CO 0.77 -1.28 1.33 0.54 -1.00 0.00 0.00 174.74 175.10 1icp n ARG 30 N -0.47 2.35 -2.87 -0.38 5.12 -0.06 -4.75 116.66 115.60 1icp n ARG 30 Ca -0.05 -2.16 -0.42 0.00 -1.93 0.00 0.00 57.85 53.30 1icp n ARG 30 Cb 0.59 -1.46 -0.04 0.00 -1.16 0.00 0.00 32.46 30.39 1icp n ARG 30 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1icp s VAL 31 N -1.41 4.65 -0.03 1.55 1.01 -1.25 -1.68 120.40 123.24 1icp s VAL 31 Ca 0.34 1.05 0.01 0.00 0.00 0.00 0.00 61.98 63.38 1icp s VAL 31 Cb 0.20 -4.28 -0.03 0.00 0.00 0.00 0.00 36.38 32.27 1icp s VAL 31 CO 0.29 -0.50 -0.02 -0.69 0.00 0.00 0.00 175.10 174.18 1icp s VAL 32 N 3.31 4.02 -0.37 2.92 1.01 -0.43 -4.41 120.40 126.45 1icp s VAL 32 Ca 0.35 -0.53 -0.26 0.00 0.00 0.00 0.00 61.98 61.54 1icp s VAL 32 Cb -0.12 -2.73 0.02 0.00 0.00 0.00 0.00 36.38 33.54 1icp s VAL 32 CO 0.18 0.47 0.95 -0.22 0.00 0.00 0.00 175.10 176.48 1icp s LEU 33 N -1.24 3.97 0.80 3.92 2.96 -0.87 -0.62 118.68 127.60 1icp s LEU 33 Ca 0.16 0.62 -0.11 0.00 -0.22 0.00 0.00 54.13 54.58 1icp s LEU 33 Cb -0.11 -3.30 0.08 0.00 0.50 0.00 0.00 46.19 43.35 1icp s LEU 33 CO 0.06 -0.88 1.12 0.00 -1.32 0.00 0.00 176.35 175.33 1icp s ALA 34 N 3.54 2.03 0.02 5.97 0.00 -0.45 -1.65 121.76 131.21 1icp s ALA 34 Ca 0.39 0.44 -0.30 0.00 0.00 0.00 0.00 51.96 52.48 1icp s ALA 34 Cb -0.12 -3.35 -0.06 0.00 0.00 0.00 0.00 23.12 19.60 1icp s ALA 34 CO 0.19 -2.04 1.41 -2.14 0.00 0.00 0.00 175.76 173.18 1icp s PRO 35 N -4.68 4.29 -0.20 0.00 0.02 -1.24 -4.68 135.00 128.50 1icp s PRO 35 Ca 0.64 2.00 -0.03 0.00 0.02 0.00 0.00 61.00 63.63 1icp s PRO 35 Cb -0.20 -3.53 0.06 0.00 0.02 0.00 0.00 34.50 30.85 1icp s PRO 35 CO 0.55 -0.56 0.04 -0.51 -0.33 0.00 0.00 177.00 176.18 1icp s LEU 36 N 2.22 1.21 -0.05 -5.54 1.43 -1.26 -4.86 118.68 111.84 1icp s LEU 36 Ca 0.64 -0.86 -0.30 0.00 -1.03 0.00 0.00 54.13 52.59 1icp s LEU 36 Cb -0.33 -0.60 -0.05 0.00 0.03 0.00 0.00 46.19 45.25 1icp s LEU 36 CO 0.27 -0.31 1.42 -0.89 0.23 0.00 0.00 176.35 177.07 1icp s THR 37 N 1.85 3.82 -0.13 5.49 2.01 -1.26 -4.32 115.64 123.10 1icp s THR 37 Ca -0.00 1.12 0.01 0.00 0.31 0.00 0.00 61.69 63.13 1icp s THR 37 Cb -0.17 -3.72 0.02 0.00 0.01 0.00 0.00 72.50 68.63 1icp s THR 37 CO -0.09 -0.04 0.67 0.54 -0.69 0.00 0.00 174.62 175.01 1icp n ARG 38 N 5.97 0.21 -4.22 4.92 5.12 -1.26 -4.80 116.66 122.59 1icp n ARG 38 Ca 0.14 -0.84 -0.34 0.00 -1.93 0.00 0.00 57.85 54.89 1icp n ARG 38 Cb 0.44 -1.02 -0.06 0.00 -1.16 0.00 0.00 32.46 30.65 1icp n ARG 38 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 1icp n GLN 39 N -0.06 -1.08 -0.24 5.56 6.02 -1.26 -4.50 117.38 121.83 1icp n GLN 39 Ca 0.01 0.13 0.06 0.00 -0.01 0.00 0.00 57.00 57.19 1icp n GLN 39 Cb 0.09 -3.49 0.09 0.00 1.02 0.00 0.00 30.24 27.96 1icp n GLN 39 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1icp n ARG 40 N -4.66 0.84 -3.38 -1.09 1.74 -1.00 -4.51 116.66 104.61 1icp n ARG 40 Ca -0.28 -2.05 -0.42 0.00 -0.77 0.00 0.00 57.85 54.33 1icp n ARG 40 Cb 0.67 -1.15 -0.02 0.00 -1.02 0.00 0.00 32.46 30.94 1icp n ARG 40 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1icp n SER 41 N -0.93 5.26 -4.67 0.55 7.64 0.98 -4.67 113.62 117.78 1icp n SER 41 Ca 0.11 -3.11 -0.44 0.00 1.01 0.00 0.00 58.87 56.44 1icp n SER 41 Cb 0.67 -1.27 -0.02 0.00 -1.01 0.00 0.00 64.21 62.58 1icp n SER 41 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 1icp n TYR 42 N 2.40 2.07 -1.26 1.43 0.53 -1.24 -1.27 117.16 119.81 1icp n TYR 42 Ca 0.24 0.53 -0.09 0.00 -1.02 0.00 0.00 57.90 57.56 1icp n TYR 42 Cb 0.38 -2.41 -0.04 0.00 -1.03 0.00 0.00 39.34 36.24 1icp n TYR 42 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1icp n GLY 43 N 1.41 1.00 2.33 2.72 0.00 -1.26 -1.65 105.19 109.73 1icp n GLY 43 Ca 0.08 -0.22 -0.13 0.00 0.00 0.00 0.00 46.02 45.76 1icp n GLY 43 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1icp n TYR 44 N -2.48 -0.21 -5.00 1.61 4.01 -0.39 -5.00 117.16 109.68 1icp n TYR 44 Ca -0.09 0.00 -0.32 0.00 -0.16 0.00 0.00 57.90 57.33 1icp n TYR 44 Cb 0.42 -2.51 -0.15 0.00 -0.31 0.00 0.00 39.34 36.79 1icp n TYR 44 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1icp s ILE 45 N -2.54 2.58 0.34 -0.72 1.01 -0.66 -2.01 121.20 119.21 1icp s ILE 45 Ca 0.00 -0.84 -0.28 0.00 0.00 0.00 0.00 60.65 59.53 1icp s ILE 45 Cb 0.00 -2.03 -0.12 0.00 0.01 0.00 0.00 42.46 40.32 1icp s ILE 45 CO 0.00 0.55 1.24 -2.65 0.00 0.00 0.00 174.94 174.07 1icp n PRO 46 N 3.33 1.97 -4.19 2.79 -0.02 -1.26 -3.69 135.00 133.93 1icp n PRO 46 Ca -0.18 0.69 -0.23 0.00 -2.02 0.00 0.00 63.50 61.76 1icp n PRO 46 Cb 0.53 -2.25 -0.07 0.00 -0.02 0.00 0.00 33.50 31.69 1icp n PRO 46 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1icp s GLN 47 N -1.85 2.32 0.34 -0.52 -1.52 -1.26 -4.84 119.66 112.33 1icp s GLN 47 Ca 0.56 -1.54 0.05 0.00 -1.95 0.00 0.00 55.36 52.49 1icp s GLN 47 Cb -0.58 -2.14 0.70 0.00 -0.22 0.00 0.00 33.01 30.76 1icp s GLN 47 CO 0.61 0.19 1.93 -1.35 -0.25 0.00 0.00 175.29 176.42 1icp h PRO 48 N 1.67 0.79 0.00 2.91 0.11 -1.94 -1.72 132.00 133.83 1icp h PRO 48 Ca -0.44 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 1icp h PRO 48 Cb 1.25 -0.18 -0.00 0.00 0.11 0.00 0.00 31.00 32.18 1icp h PRO 48 CO 0.63 0.53 -0.03 1.12 -0.21 0.00 0.00 178.00 180.04 1icp h HIS 49 N 0.82 0.00 0.00 0.65 2.07 -1.95 -0.55 115.15 116.19 1icp h HIS 49 Ca 0.36 0.00 -0.06 0.00 -2.85 0.00 0.00 60.37 57.82 1icp h HIS 49 Cb 0.33 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.30 1icp h HIS 49 CO -0.00 0.03 -0.28 0.00 -3.07 0.00 0.00 177.93 174.60 1icp h ALA 50 N 1.97 1.27 -0.39 6.11 0.00 -1.67 -1.13 119.26 125.43 1icp h ALA 50 Ca -0.00 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 1icp h ALA 50 Cb 0.07 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1icp h ALA 50 CO 0.00 0.35 0.21 0.82 0.00 0.00 0.00 179.25 180.64 1icp h ILE 51 N 0.00 1.15 -0.29 0.00 2.04 -1.19 -1.22 117.51 118.00 1icp h ILE 51 Ca -0.00 -0.38 -0.11 0.00 1.00 0.00 0.00 64.86 65.37 1icp h ILE 51 Cb 0.60 0.69 -0.01 0.00 -0.74 0.00 0.00 36.82 37.36 1icp h ILE 51 CO 0.04 0.15 -0.25 0.25 0.00 0.00 0.00 178.15 178.34 1icp h LEU 52 N 0.50 0.72 0.18 1.44 5.85 -1.48 -1.77 115.31 120.74 1icp h LEU 52 Ca 0.14 -0.46 0.00 0.00 0.84 0.00 0.00 57.88 58.40 1icp h LEU 52 Cb 0.05 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 40.87 1icp h LEU 52 CO -0.02 1.03 -0.15 -0.74 -0.34 0.00 0.00 178.44 178.21 1icp h HIS 53 N 0.42 -0.40 -0.11 1.25 2.76 -1.02 0.28 115.15 118.33 1icp h HIS 53 Ca 0.05 0.00 -0.14 0.00 -2.20 0.00 0.00 60.37 58.08 1icp h HIS 53 Cb 0.81 0.15 -0.01 0.00 1.55 0.00 0.00 27.41 29.91 1icp h HIS 53 CO 0.07 -0.24 -0.54 1.88 -1.30 0.00 0.00 177.93 177.81 1icp h TYR 54 N -0.35 0.41 -0.43 5.26 0.05 -1.31 -3.01 116.97 117.59 1icp h TYR 54 Ca -0.00 -0.14 -0.02 0.00 0.05 0.00 0.00 58.73 58.61 1icp h TYR 54 Cb 0.32 -0.08 -0.02 0.00 1.01 0.00 0.00 36.73 37.96 1icp h TYR 54 CO -0.12 0.79 0.18 1.03 -1.05 0.00 0.00 178.16 178.99 1icp h SER 55 N 0.25 0.59 -0.39 3.88 0.87 -1.11 -2.10 113.55 115.54 1icp h SER 55 Ca 0.01 -0.16 0.06 0.00 -1.23 0.00 0.00 61.79 60.47 1icp h SER 55 Cb 1.03 -0.15 -0.02 0.00 -0.44 0.00 0.00 62.40 62.82 1icp h SER 55 CO 0.09 0.58 0.27 1.56 -0.53 0.00 0.00 176.83 178.80 1icp h GLN 56 N 0.55 0.27 -0.38 2.24 4.20 -0.82 -2.30 115.11 118.87 1icp h GLN 56 Ca 0.14 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.84 1icp h GLN 56 Cb 0.17 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 27.89 1icp h GLN 56 CO -0.01 0.18 0.00 0.54 -0.67 0.00 0.00 178.83 178.86 1icp n ARG 57 N -4.48 2.35 -3.07 1.46 1.74 -0.92 -4.45 116.66 109.29 1icp n ARG 57 Ca 0.05 -2.05 -0.38 0.00 -0.77 0.00 0.00 57.85 54.70 1icp n ARG 57 Cb 0.26 -1.49 -0.06 0.00 -1.02 0.00 0.00 32.46 30.15 1icp n ARG 57 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 1icp s SER 58 N -1.43 7.23 0.07 0.55 0.01 -0.84 -4.99 113.70 114.30 1icp s SER 58 Ca 0.38 1.50 0.01 0.00 1.31 0.00 0.00 55.95 59.15 1icp s SER 58 Cb 0.22 -2.45 -0.04 0.00 0.21 0.00 0.00 66.02 63.96 1icp s SER 58 CO 0.30 0.17 -0.05 0.42 0.41 0.00 0.00 173.24 174.49 1icp s THR 59 N -1.26 0.44 -0.06 1.44 -4.23 -1.26 -4.97 115.64 105.74 1icp s THR 59 Ca 0.37 -1.66 -0.30 0.00 -1.18 0.00 0.00 61.69 58.92 1icp s THR 59 Cb -0.20 -1.33 -0.05 0.00 1.34 0.00 0.00 72.50 72.26 1icp s THR 59 CO 0.23 -0.81 1.62 0.21 -0.54 0.00 0.00 174.62 175.33 1icp s ASN 60 N -2.63 6.69 -0.72 3.99 2.47 -0.96 -1.88 114.94 121.91 1icp s ASN 60 Ca 0.04 2.19 0.00 0.00 0.42 0.00 0.00 52.86 55.52 1icp s ASN 60 Cb 0.03 -2.53 0.00 0.00 -1.45 0.00 0.00 41.25 37.29 1icp s ASN 60 CO -0.05 -0.91 0.00 0.61 -3.72 0.00 0.00 177.10 173.03 1icp n GLY 61 N 4.08 0.84 3.88 1.21 0.00 0.80 -4.42 105.19 111.58 1icp n GLY 61 Ca 0.17 -0.73 -0.37 0.00 0.00 0.00 0.00 46.02 45.09 1icp n GLY 61 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1icp s GLY 62 N -2.91 2.16 -0.15 -0.02 0.00 -0.79 -0.08 107.32 105.54 1icp s GLY 62 Ca 0.00 -0.64 -0.18 0.00 0.00 0.00 0.00 44.72 43.90 1icp s GLY 62 CO 0.00 -0.39 0.48 -2.27 0.00 0.00 0.00 173.10 170.93 1icp s LEU 63 N -1.06 4.23 -0.07 0.66 2.96 -1.26 -0.80 118.68 123.33 1icp s LEU 63 Ca 0.15 0.75 0.05 0.00 -0.22 0.00 0.00 54.13 54.86 1icp s LEU 63 Cb -0.12 -2.69 -0.01 0.00 0.50 0.00 0.00 46.19 43.87 1icp s LEU 63 CO 0.04 -0.06 -0.23 -0.76 -1.32 0.00 0.00 176.35 174.02 1icp s LEU 64 N 1.00 2.19 -0.22 -0.68 1.02 0.84 -2.06 118.68 120.77 1icp s LEU 64 Ca 0.25 -0.47 -0.03 0.00 0.02 0.00 0.00 54.13 53.90 1icp s LEU 64 Cb -0.15 -1.42 0.00 0.00 0.02 0.00 0.00 46.19 44.65 1icp s LEU 64 CO 0.10 0.24 -0.06 -0.63 0.02 0.00 0.00 176.35 176.01 1icp s ILE 65 N -0.11 3.13 0.85 -0.59 1.01 -0.66 -0.83 121.20 124.01 1icp s ILE 65 Ca -0.05 -0.65 -0.11 0.00 0.00 0.00 0.00 60.65 59.84 1icp s ILE 65 Cb -0.14 -2.45 0.10 0.00 0.01 0.00 0.00 42.46 39.98 1icp s ILE 65 CO 0.04 0.39 1.09 -0.83 0.00 0.00 0.00 174.94 175.63 1icp s GLY 66 N 1.43 1.64 0.80 6.18 0.00 0.34 -3.65 107.32 114.06 1icp s GLY 66 Ca 0.05 0.05 -0.14 0.00 0.00 0.00 0.00 44.72 44.68 1icp s GLY 66 CO -0.05 0.49 1.03 -1.84 0.00 0.00 0.00 173.10 172.73 1icp n GLU 67 N -3.76 0.19 -1.66 2.90 0.28 -1.26 -3.89 120.64 113.44 1icp n GLU 67 Ca 0.08 0.13 -0.51 0.00 -0.16 0.00 0.00 57.16 56.70 1icp n GLU 67 Cb 0.54 -2.29 -0.06 0.00 1.43 0.00 0.00 31.44 31.07 1icp n GLU 67 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1icp n ALA 68 N -3.13 0.16 -4.01 -1.84 0.00 -1.26 -4.29 120.51 106.13 1icp n ALA 68 Ca 0.12 0.42 -0.33 0.00 0.00 0.00 0.00 53.44 53.65 1icp n ALA 68 Cb 0.50 -2.27 -0.16 0.00 0.00 0.00 0.00 19.45 17.53 1icp n ALA 68 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1icp s THR 69 N 2.11 2.29 0.16 0.00 2.01 0.68 -4.44 115.64 118.45 1icp s THR 69 Ca 0.88 -0.91 -0.32 0.00 0.31 0.00 0.00 61.69 61.65 1icp s THR 69 Cb -0.86 -2.00 -0.10 0.00 0.01 0.00 0.00 72.50 69.54 1icp s THR 69 CO 0.50 0.48 1.66 -0.69 -0.69 0.00 0.00 174.62 175.88 1icp s VAL 70 N 1.31 2.47 -0.54 3.82 1.01 -0.06 -0.59 120.40 127.82 1icp s VAL 70 Ca 0.04 0.27 0.24 0.00 0.00 0.00 0.00 61.98 62.53 1icp s VAL 70 Cb -0.14 -3.17 0.20 0.00 0.00 0.00 0.00 36.38 33.27 1icp s VAL 70 CO -0.11 0.02 1.50 0.16 0.00 0.00 0.00 175.10 176.67 1icp h ILE 71 N 4.13 0.00 -2.44 2.22 3.07 -1.56 -0.57 117.51 122.36 1icp h ILE 71 Ca -0.43 -0.73 0.16 0.00 1.55 0.00 0.00 64.86 65.41 1icp h ILE 71 Cb 1.20 1.55 -0.07 0.00 -0.27 0.00 0.00 36.82 39.23 1icp h ILE 71 CO 0.93 0.00 0.47 -0.94 -1.05 0.00 0.00 178.15 177.56 1icp s SER 72 N -5.11 -0.16 0.48 2.16 1.04 -1.26 -4.40 113.70 106.46 1icp s SER 72 Ca 0.07 -0.48 0.18 0.00 0.48 0.00 0.00 55.95 56.20 1icp s SER 72 Cb 0.10 0.52 1.19 0.00 0.10 0.00 0.00 66.02 67.94 1icp s SER 72 CO 0.68 -0.98 2.01 -0.33 0.98 0.00 0.00 173.24 175.60 1icp h GLU 73 N 2.00 0.20 -0.00 4.02 5.08 -1.99 -0.91 114.58 122.98 1icp h GLU 73 Ca -0.24 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.11 1icp h GLU 73 Cb 1.23 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.44 1icp h GLU 73 CO 0.27 0.13 -0.08 0.25 -1.00 0.00 0.00 179.01 178.58 1icp n THR 74 N -4.45 0.00 0.99 1.13 -2.24 -1.26 -3.78 114.28 104.67 1icp n THR 74 Ca 0.08 -0.06 0.09 0.00 -2.27 0.00 0.00 64.05 61.89 1icp n THR 74 Cb 0.41 -0.15 0.29 0.00 -2.10 0.00 0.00 70.33 68.78 1icp n THR 74 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1icp n GLY 75 N 1.24 0.58 3.71 3.38 0.00 -0.35 -4.66 105.19 109.09 1icp n GLY 75 Ca 0.16 -0.44 -0.40 0.00 0.00 0.00 0.00 46.02 45.34 1icp n GLY 75 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1icp s ILE 76 N -1.66 5.02 0.00 -0.61 1.01 -1.25 -2.92 121.20 120.80 1icp s ILE 76 Ca 0.30 1.49 0.00 0.00 0.00 0.00 0.00 60.65 62.44 1icp s ILE 76 Cb 0.16 -4.06 0.00 0.00 0.01 0.00 0.00 42.46 38.57 1icp s ILE 76 CO 0.23 0.23 0.24 0.61 0.00 0.00 0.00 174.94 176.25 1icp n GLY 77 N 3.14 -0.50 3.28 6.18 0.00 -1.26 -4.65 105.19 111.38 1icp n GLY 77 Ca -0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.88 1icp n GLY 77 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1icp s TYR 78 N -0.04 -0.22 0.42 1.61 2.02 -1.26 -4.77 117.35 115.11 1icp s TYR 78 Ca 0.00 0.29 -0.15 0.00 -0.37 0.00 0.00 57.07 56.84 1icp s TYR 78 Cb 0.00 0.14 -0.08 0.00 -0.40 0.00 0.00 41.96 41.62 1icp s TYR 78 CO 0.00 -0.45 0.86 -1.59 -1.57 0.00 0.00 175.55 172.79 1icp s LYS 79 N -1.68 3.95 -1.56 -0.62 -2.85 -1.26 -4.20 119.74 111.53 1icp s LYS 79 Ca -0.11 0.77 0.00 0.00 -1.00 0.00 0.00 55.97 55.63 1icp s LYS 79 Cb -0.03 -2.29 0.00 0.00 -2.06 0.00 0.00 37.83 33.45 1icp s LYS 79 CO 0.03 -0.07 0.00 -0.25 0.10 0.00 0.00 175.35 175.16 1icp n ASP 80 N -1.07 -5.00 -4.88 0.03 8.00 -1.26 -4.78 116.55 107.59 1icp n ASP 80 Ca 0.05 0.13 -0.36 0.00 0.71 0.00 0.00 54.79 55.31 1icp n ASP 80 Cb 0.54 -4.06 -0.06 0.00 -0.02 0.00 0.00 41.12 37.52 1icp n ASP 80 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1icp s VAL 81 N -2.77 5.46 0.55 2.53 -7.23 -1.25 -0.02 120.40 117.67 1icp s VAL 81 Ca 0.00 0.09 -0.19 0.00 -1.81 0.00 0.00 61.98 60.08 1icp s VAL 81 Cb 0.00 -3.43 -0.05 0.00 0.56 0.00 0.00 36.38 33.46 1icp s VAL 81 CO 0.00 0.54 1.11 -2.16 -0.31 0.00 0.00 175.10 174.27 1icp s PRO 82 N -1.28 3.36 0.40 4.82 0.04 -1.26 -4.13 135.00 136.94 1icp s PRO 82 Ca 0.18 1.52 0.05 0.00 0.04 0.00 0.00 61.00 62.80 1icp s PRO 82 Cb -0.12 -2.01 -0.06 0.00 0.04 0.00 0.00 34.50 32.34 1icp s PRO 82 CO 0.08 -0.83 0.03 0.20 0.04 0.00 0.00 177.00 176.53 1icp s GLY 83 N -1.96 2.48 -0.15 0.56 0.00 -0.85 -0.88 107.32 106.53 1icp s GLY 83 Ca 0.71 -1.85 0.18 0.00 0.00 0.00 0.00 44.72 43.75 1icp s GLY 83 CO 0.28 -2.02 1.19 4.51 0.00 0.00 0.00 173.10 177.06 1icp n ILE 84 N -0.94 0.41 0.65 0.90 3.06 -0.22 -4.75 119.36 118.47 1icp n ILE 84 Ca -0.07 -1.44 0.09 0.00 -2.50 0.00 0.00 62.75 58.84 1icp n ILE 84 Cb 0.67 1.01 -0.12 0.00 0.54 0.00 0.00 39.64 41.74 1icp n ILE 84 CO 0.00 0.00 0.00 -2.67 -2.50 0.00 0.00 176.55 171.38 1icp n TRP 85 N -0.34 0.00 -4.23 9.51 2.14 -1.26 -4.78 117.44 118.48 1icp n TRP 85 Ca -0.04 0.00 -0.25 0.00 2.07 0.00 0.00 57.50 59.28 1icp n TRP 85 Cb 0.90 -0.12 -0.07 0.00 -0.81 0.00 0.00 31.31 31.21 1icp n TRP 85 CO 0.00 0.00 0.00 0.95 2.07 0.00 0.00 177.69 180.71 1icp s THR 86 N -2.94 3.66 0.30 -1.67 -4.23 -1.26 -5.01 115.64 104.49 1icp s THR 86 Ca 0.03 -1.60 -0.01 0.00 -1.18 0.00 0.00 61.69 58.93 1icp s THR 86 Cb 0.14 -2.89 0.27 0.00 1.34 0.00 0.00 72.50 71.36 1icp s THR 86 CO 0.79 -0.22 1.94 0.50 -0.54 0.00 0.00 174.62 177.08 1icp h LYS 87 N 2.32 1.05 -0.52 3.99 1.63 -1.99 -1.50 116.57 121.54 1icp h LYS 87 Ca -0.46 -0.06 -0.00 0.00 -0.85 0.00 0.00 60.65 59.27 1icp h LYS 87 Cb 1.22 -0.24 -0.03 0.00 -0.60 0.00 0.00 32.23 32.59 1icp h LYS 87 CO 0.59 0.69 0.31 1.49 -3.45 0.00 0.00 179.45 179.08 1icp h GLU 88 N 1.08 0.71 -0.53 1.90 4.81 -1.99 -1.45 114.58 119.11 1icp h GLU 88 Ca 0.35 -0.07 -0.11 0.00 -0.13 0.00 0.00 59.36 59.40 1icp h GLU 88 Cb 0.03 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.25 1icp h GLU 88 CO -0.10 0.52 -0.10 1.96 -0.73 0.00 0.00 179.01 180.56 1icp h GLN 89 N 0.70 1.00 -0.40 1.92 4.20 -1.72 -2.17 115.11 118.64 1icp h GLN 89 Ca 0.19 -0.37 0.01 0.00 0.06 0.00 0.00 58.65 58.54 1icp h GLN 89 Cb -0.01 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 27.69 1icp h GLN 89 CO -0.03 1.05 0.25 0.28 -0.67 0.00 0.00 178.83 179.70 1icp h VAL 90 N 0.87 1.06 -0.32 -0.54 2.07 -0.98 -1.60 116.25 116.82 1icp h VAL 90 Ca 0.14 -0.17 -0.06 0.00 0.82 0.00 0.00 66.70 67.42 1icp h VAL 90 Cb 0.66 0.51 -0.02 0.00 -1.52 0.00 0.00 31.29 30.93 1icp h VAL 90 CO 0.05 0.09 -0.05 -0.33 0.02 0.00 0.00 177.57 177.34 1icp h GLU 91 N 0.51 0.51 0.00 1.57 4.39 -1.21 -2.51 114.58 117.83 1icp h GLU 91 Ca 0.16 -0.12 -0.09 0.00 0.34 0.00 0.00 59.36 59.64 1icp h GLU 91 Cb -0.02 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.55 1icp h GLU 91 CO -0.06 0.58 -0.43 0.00 -1.16 0.00 0.00 179.01 177.94 1icp h ALA 92 N 1.46 1.19 -0.03 3.43 0.00 -0.81 -3.02 119.26 121.49 1icp h ALA 92 Ca 0.10 -0.39 -0.15 0.00 0.00 0.00 0.00 54.91 54.47 1icp h ALA 92 Cb 0.40 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 1icp h ALA 92 CO 0.02 0.54 -0.67 -1.49 0.00 0.00 0.00 179.25 177.64 1icp h TRP 93 N 0.00 0.18 -0.40 0.00 4.06 -0.87 -3.36 115.95 115.55 1icp h TRP 93 Ca -0.00 -0.08 0.08 0.00 2.06 0.00 0.00 58.89 60.95 1icp h TRP 93 Cb 0.80 -0.03 -0.09 0.00 -1.00 0.00 0.00 29.16 28.85 1icp h TRP 93 CO 0.00 0.76 -0.30 0.87 -3.56 0.00 0.00 178.44 176.21 1icp h LYS 94 N 0.09 -0.22 -0.03 0.49 1.57 -1.38 -0.49 116.57 116.60 1icp h LYS 94 Ca -0.01 0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 1icp h LYS 94 Cb 1.20 0.05 -0.00 0.00 0.08 0.00 0.00 32.23 33.55 1icp h LYS 94 CO 0.10 -0.15 -0.07 -1.35 -0.57 0.00 0.00 179.45 177.41 1icp h PRO 95 N -0.23 0.04 -0.04 3.15 0.11 -1.74 0.86 132.00 134.15 1icp h PRO 95 Ca 0.18 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.26 1icp h PRO 95 Cb 0.52 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 31.63 1icp h PRO 95 CO -0.53 0.11 -0.06 0.82 -0.21 0.00 0.00 178.00 178.13 1icp h ILE 96 N 0.04 1.42 -0.25 4.15 2.04 -1.51 -2.39 117.51 121.00 1icp h ILE 96 Ca 0.01 -1.33 0.02 0.00 1.00 0.00 0.00 64.86 64.56 1icp h ILE 96 Cb 0.15 2.22 -0.02 0.00 -0.74 0.00 0.00 36.82 38.43 1icp h ILE 96 CO 0.01 0.36 0.10 0.58 0.00 0.00 0.00 178.15 179.20 1icp h VAL 97 N -0.40 0.96 -0.88 1.67 2.07 -0.70 -2.50 116.25 116.47 1icp h VAL 97 Ca 0.00 -0.08 0.08 0.00 0.82 0.00 0.00 66.70 67.53 1icp h VAL 97 Cb 0.62 0.71 -0.06 0.00 -1.52 0.00 0.00 31.29 31.04 1icp h VAL 97 CO 0.01 0.04 0.57 0.44 0.02 0.00 0.00 177.57 178.66 1icp h ASP 98 N 0.23 0.84 -0.45 0.57 3.32 -0.85 -1.04 116.42 119.03 1icp h ASP 98 Ca 0.11 0.01 -0.08 0.00 0.02 0.00 0.00 57.03 57.09 1icp h ASP 98 Cb 0.06 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.43 1icp h ASP 98 CO -0.10 0.52 -0.02 0.00 -1.72 0.00 0.00 179.24 177.92 1icp h ALA 99 N 1.54 1.00 -0.42 3.45 0.00 -1.00 0.14 119.26 123.97 1icp h ALA 99 Ca 0.39 -0.29 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 1icp h ALA 99 Cb 0.30 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1icp h ALA 99 CO -0.16 0.61 0.00 0.28 0.00 0.00 0.00 179.25 179.99 1icp h VAL 100 N 0.81 1.26 -0.09 0.00 2.07 -0.98 -2.88 116.25 116.44 1icp h VAL 100 Ca 0.15 -1.02 -0.07 0.00 0.82 0.00 0.00 66.70 66.58 1icp h VAL 100 Cb 0.51 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 31.37 1icp h VAL 100 CO 0.03 0.35 -0.28 0.45 0.02 0.00 0.00 177.57 178.13 1icp h HIS 101 N 0.57 0.18 0.00 1.57 -0.00 -0.84 -1.71 115.15 114.93 1icp h HIS 101 Ca 0.12 -0.03 -0.00 0.00 -0.00 0.00 0.00 60.37 60.45 1icp h HIS 101 Cb 0.48 -0.05 -0.00 0.00 -0.00 0.00 0.00 27.41 27.84 1icp h HIS 101 CO 0.04 0.44 -0.01 0.00 -0.00 0.00 0.00 177.93 178.40 1icp h ALA 102 N 1.56 1.51 -0.59 2.45 0.00 -0.51 0.78 119.26 124.46 1icp h ALA 102 Ca 0.02 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1icp h ALA 102 Cb 0.59 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1icp h ALA 102 CO 0.04 0.01 0.00 1.63 0.00 0.00 0.00 179.25 180.93 1icp n LYS 103 N -3.83 2.81 -1.21 0.00 5.02 -0.92 -4.96 118.16 115.07 1icp n LYS 103 Ca -0.03 -2.45 -0.02 0.00 -2.02 0.00 0.00 58.31 53.78 1icp n LYS 103 Cb 0.09 -1.47 -0.01 0.00 -0.02 0.00 0.00 35.03 33.62 1icp n LYS 103 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1icp n GLY 104 N 1.22 0.50 3.89 0.72 0.00 0.27 -2.26 105.19 109.54 1icp n GLY 104 Ca 0.20 -0.96 -0.29 0.00 0.00 0.00 0.00 46.02 44.97 1icp n GLY 104 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1icp s GLY 105 N -2.97 1.69 -0.22 -0.02 0.00 -0.69 -0.14 107.32 104.97 1icp s GLY 105 Ca 0.00 -0.30 -0.08 0.00 0.00 0.00 0.00 44.72 44.34 1icp s GLY 105 CO 0.00 -0.10 0.10 -0.42 0.00 0.00 0.00 173.10 172.68 1icp s ILE 106 N -2.71 4.86 -0.20 0.90 -1.09 0.02 -4.39 121.20 118.58 1icp s ILE 106 Ca 0.51 0.00 0.00 0.00 -2.23 0.00 0.00 60.65 58.93 1icp s ILE 106 Cb -0.10 -3.24 0.02 0.00 -1.58 0.00 0.00 42.46 37.55 1icp s ILE 106 CO 0.42 0.38 -0.15 0.12 -1.23 0.00 0.00 174.94 174.48 1icp s PHE 107 N 0.98 2.88 -0.12 3.97 5.99 -1.26 -0.11 117.98 130.31 1icp s PHE 107 Ca 0.05 -1.57 -0.02 0.00 0.00 0.00 0.00 56.93 55.40 1icp s PHE 107 Cb -0.14 -1.97 -0.03 0.00 0.00 0.00 0.00 43.02 40.88 1icp s PHE 107 CO 0.03 -0.76 -0.03 -0.06 -0.00 0.00 0.00 175.22 174.40 1icp s PHE 108 N 1.31 3.04 -0.19 10.12 2.99 -0.01 -0.73 117.98 134.52 1icp s PHE 108 Ca 0.04 -0.09 -0.20 0.00 0.00 0.00 0.00 56.93 56.68 1icp s PHE 108 Cb -0.14 -1.86 -0.03 0.00 0.00 0.00 0.00 43.02 40.99 1icp s PHE 108 CO -0.10 0.18 0.57 0.00 -0.00 0.00 0.00 175.22 175.88 1icp s GLN 110 N 1.71 4.14 -0.18 0.00 0.74 -1.25 -0.23 119.66 124.59 1icp s GLN 110 Ca 0.27 0.84 -0.11 0.00 0.05 0.00 0.00 55.36 56.41 1icp s GLN 110 Cb -0.16 -3.66 -0.05 0.00 1.10 0.00 0.00 33.01 30.25 1icp s GLN 110 CO 0.10 -0.53 0.18 0.96 -0.55 0.00 0.00 175.29 175.45 1icp s ILE 111 N 2.82 5.39 0.04 -2.34 -4.36 0.15 -0.23 121.20 122.66 1icp s ILE 111 Ca 0.33 0.30 0.01 0.00 -0.26 0.00 0.00 60.65 61.04 1icp s ILE 111 Cb -0.15 -3.51 -0.02 0.00 1.25 0.00 0.00 42.46 40.03 1icp s ILE 111 CO 0.08 0.45 -0.06 0.86 0.24 0.00 0.00 174.94 176.51 1icp s TRP 112 N 0.18 0.53 -0.08 1.37 -0.00 0.24 -1.22 118.94 119.96 1icp s TRP 112 Ca 0.11 -0.54 -0.03 0.00 -0.00 0.00 0.00 56.10 55.64 1icp s TRP 112 Cb -0.12 -0.33 0.05 0.00 -0.00 0.00 0.00 33.47 33.07 1icp s TRP 112 CO 0.01 -0.13 0.16 -1.58 -0.00 0.00 0.00 176.95 175.41 1icp s HIS 113 N -1.54 -0.19 -0.24 5.86 5.65 -1.26 -1.36 115.29 122.21 1icp s HIS 113 Ca -0.11 0.60 0.28 0.00 0.25 0.00 0.00 55.06 56.08 1icp s HIS 113 Cb -0.09 -0.20 1.06 0.00 -1.18 0.00 0.00 32.58 32.17 1icp s HIS 113 CO -0.00 -0.25 1.83 -0.39 -0.65 0.00 0.00 174.74 175.28 1icp h VAL 114 N 6.28 0.00 0.00 0.89 -1.51 -1.83 -1.13 116.25 118.95 1icp h VAL 114 Ca -0.21 -0.47 0.00 0.00 -1.23 0.00 0.00 66.70 64.79 1icp h VAL 114 Cb 1.12 1.38 0.00 0.00 -2.13 0.00 0.00 31.29 31.67 1icp h VAL 114 CO 0.22 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 177.17 1icp n GLY 115 N 0.28 3.74 0.00 5.19 0.00 -1.26 -1.95 105.19 111.20 1icp n GLY 115 Ca 0.02 -0.05 0.09 0.00 0.00 0.00 0.00 46.02 46.08 1icp n GLY 115 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1icp n ARG 116 N 13.92 0.11 -1.89 1.61 1.85 -0.95 -4.06 116.66 127.24 1icp n ARG 116 Ca 0.00 0.16 -0.42 0.00 -1.00 0.00 0.00 57.85 56.60 1icp n ARG 116 Cb 0.00 -1.50 -0.00 0.00 -1.05 0.00 0.00 32.46 29.91 1icp n ARG 116 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 177.63 177.90 1icp n VAL 117 N -1.41 4.07 -3.52 8.89 0.31 -0.82 -4.75 118.33 121.10 1icp n VAL 117 Ca 0.06 -3.54 -0.05 0.00 -0.01 0.00 0.00 64.34 60.80 1icp n VAL 117 Cb 0.18 -2.47 0.00 0.00 -0.91 0.00 0.00 33.84 30.64 1icp n VAL 117 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1icp n SER 118 N 4.52 -0.96 -3.99 4.52 2.88 -1.26 -4.37 113.62 114.96 1icp n SER 118 Ca 0.53 -1.81 -0.10 0.00 -1.33 0.00 0.00 58.87 56.15 1icp n SER 118 Cb 0.34 1.64 -0.11 0.00 -0.75 0.00 0.00 64.21 65.33 1icp n SER 118 CO 0.00 0.00 0.00 0.21 -1.23 0.00 0.00 175.04 174.02 1icp s ASN 119 N -2.01 0.37 0.57 -3.46 3.84 -1.26 -2.19 114.94 110.79 1icp s ASN 119 Ca 0.10 -0.48 0.27 0.00 0.21 0.00 0.00 52.86 52.96 1icp s ASN 119 Cb -0.02 0.08 1.56 0.00 -0.55 0.00 0.00 41.25 42.32 1icp s ASN 119 CO 0.07 -0.26 2.06 0.07 -2.79 0.00 0.00 177.10 176.25 1icp h LYS 120 N 4.72 0.00 0.00 0.43 2.10 -1.88 0.11 116.57 122.04 1icp h LYS 120 Ca -0.32 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.33 1icp h LYS 120 Cb 1.21 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.54 1icp h LYS 120 CO 0.42 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 177.62 1icp n ASP 121 N -3.95 0.68 0.02 7.07 8.00 -1.26 -1.37 116.55 125.74 1icp n ASP 121 Ca 0.04 0.69 0.11 0.00 0.71 0.00 0.00 54.79 56.33 1icp n ASP 121 Cb 0.41 -0.82 -0.04 0.00 -0.02 0.00 0.00 41.12 40.64 1icp n ASP 121 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1icp n PHE 122 N -2.27 0.20 -3.10 1.24 3.72 0.36 -4.97 117.46 112.64 1icp n PHE 122 Ca 0.02 0.06 -0.30 0.00 -0.05 0.00 0.00 57.45 57.18 1icp n PHE 122 Cb 0.20 -0.41 -0.03 0.00 -0.94 0.00 0.00 39.48 38.30 1icp n PHE 122 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 1icp s GLN 123 N -3.24 3.73 0.23 -1.08 -1.52 -0.47 -4.80 119.66 112.51 1icp s GLN 123 Ca 0.02 0.27 -0.31 0.00 -1.95 0.00 0.00 55.36 53.39 1icp s GLN 123 Cb 0.14 -2.52 -0.10 0.00 -0.22 0.00 0.00 33.01 30.31 1icp s GLN 123 CO 0.84 0.10 1.52 -2.14 -0.25 0.00 0.00 175.29 175.36 1icp s PRO 124 N -3.62 4.22 -1.81 2.91 0.02 -1.26 -2.10 135.00 133.35 1icp s PRO 124 Ca 0.48 2.39 0.00 0.00 0.02 0.00 0.00 61.00 63.89 1icp s PRO 124 Cb -0.11 -3.11 0.00 0.00 0.02 0.00 0.00 34.50 31.31 1icp s PRO 124 CO 0.29 -0.54 0.00 0.09 -0.33 0.00 0.00 177.00 176.52 1icp n ASN 125 N 2.94 -4.72 -1.46 2.53 3.02 -1.26 -1.47 115.26 114.83 1icp n ASN 125 Ca 0.10 0.37 -0.15 0.00 -0.03 0.00 0.00 54.58 54.87 1icp n ASN 125 Cb 0.39 -4.19 -0.04 0.00 -0.61 0.00 0.00 39.78 35.33 1icp n ASN 125 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1icp n GLY 126 N -0.43 0.64 3.68 7.41 0.00 -0.89 -4.99 105.19 110.60 1icp n GLY 126 Ca -0.18 -0.27 -0.29 0.00 0.00 0.00 0.00 46.02 45.27 1icp n GLY 126 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1icp s GLU 127 N -4.04 0.79 0.40 1.61 2.02 -0.54 -4.82 118.70 114.12 1icp s GLU 127 Ca 0.00 0.79 -0.20 0.00 0.02 0.00 0.00 54.97 55.58 1icp s GLU 127 Cb 0.00 -1.76 -0.11 0.00 0.10 0.00 0.00 34.13 32.37 1icp s GLU 127 CO 0.00 -2.55 0.91 -0.51 0.02 0.00 0.00 175.26 173.13 1icp s ASP 128 N -3.28 6.95 0.82 -0.19 1.01 -1.26 -4.33 116.67 116.38 1icp s ASP 128 Ca 0.65 1.63 -0.12 0.00 0.71 0.00 0.00 52.55 55.42 1icp s ASP 128 Cb -0.19 -2.51 0.09 0.00 1.01 0.00 0.00 42.92 41.31 1icp s ASP 128 CO 0.58 -0.30 1.15 -2.84 0.21 0.00 0.00 175.17 173.97 1icp s PRO 129 N -3.03 1.71 0.10 8.23 0.02 -1.26 -4.69 135.00 136.08 1icp s PRO 129 Ca 0.59 1.53 0.04 0.00 0.02 0.00 0.00 61.00 63.18 1icp s PRO 129 Cb -0.10 -1.81 -0.04 0.00 0.02 0.00 0.00 34.50 32.57 1icp s PRO 129 CO 0.15 -2.11 0.06 0.96 -0.33 0.00 0.00 177.00 175.72 1icp s ILE 130 N -2.49 4.32 0.30 2.83 -4.36 -1.26 -0.18 121.20 120.36 1icp s ILE 130 Ca 0.68 -0.92 -0.17 0.00 -0.26 0.00 0.00 60.65 59.98 1icp s ILE 130 Cb -0.23 -3.10 0.06 0.00 1.25 0.00 0.00 42.46 40.44 1icp s ILE 130 CO 0.53 0.08 0.87 -0.24 0.24 0.00 0.00 174.94 176.42 1icp n SER 131 N 0.34 -2.01 0.14 4.36 2.88 -0.54 -2.23 113.62 116.55 1icp n SER 131 Ca -0.09 -2.27 0.13 0.00 -1.33 0.00 0.00 58.87 55.31 1icp n SER 131 Cb 0.52 3.32 0.30 0.00 -0.75 0.00 0.00 64.21 67.60 1icp n SER 131 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1icp s THR 133 N -3.15 1.01 -1.74 0.00 -1.32 -1.26 -4.58 115.64 104.60 1icp s THR 133 Ca 0.09 -2.00 0.16 0.00 -1.21 0.00 0.00 61.69 58.73 1icp s THR 133 Cb 0.10 -2.75 0.28 0.00 -1.51 0.00 0.00 72.50 68.63 1icp s THR 133 CO 0.64 0.00 1.19 -0.90 -2.21 0.00 0.00 174.62 173.34 1icp n ASP 134 N -0.63 2.85 -4.72 8.08 5.68 -1.26 -3.75 116.55 122.79 1icp n ASP 134 Ca -0.02 -1.84 -0.41 0.00 -0.50 0.00 0.00 54.79 52.03 1icp n ASP 134 Cb 0.66 -0.16 -0.04 0.00 -1.14 0.00 0.00 41.12 40.44 1icp n ASP 134 CO 0.00 0.00 0.00 -0.13 -1.33 0.00 0.00 177.20 175.74 1icp s ARG 135 N -1.20 4.60 0.52 0.11 0.52 -1.26 -4.04 118.95 118.19 1icp s ARG 135 Ca 0.26 1.32 0.05 0.00 -0.52 0.00 0.00 55.73 56.85 1icp s ARG 135 Cb 0.16 -3.41 0.04 0.00 0.52 0.00 0.00 34.95 32.26 1icp s ARG 135 CO 0.22 0.13 0.71 0.20 0.02 0.00 0.00 175.30 176.58 1icp s GLY 136 N 0.36 1.86 0.34 -3.53 0.00 -1.26 -4.44 107.32 100.65 1icp s GLY 136 Ca 0.46 -1.65 -0.08 0.00 0.00 0.00 0.00 44.72 43.44 1icp s GLY 136 CO 0.27 -1.36 0.67 1.08 0.00 0.00 0.00 173.10 173.76 1icp s LEU 137 N -4.61 3.96 0.60 0.66 1.43 -1.26 -5.02 118.68 114.44 1icp s LEU 137 Ca 0.58 0.96 -0.08 0.00 -1.03 0.00 0.00 54.13 54.56 1icp s LEU 137 Cb -0.09 -3.80 -0.01 0.00 0.03 0.00 0.00 46.19 42.32 1icp s LEU 137 CO 0.37 -0.28 0.96 0.42 0.23 0.00 0.00 176.35 178.04 1icp s THR 138 N -2.20 4.14 0.64 5.49 -4.23 -1.26 -4.51 115.64 113.71 1icp s THR 138 Ca 0.48 0.38 -0.18 0.00 -1.18 0.00 0.00 61.69 61.20 1icp s THR 138 Cb -0.11 -3.65 -0.03 0.00 1.34 0.00 0.00 72.50 70.05 1icp s THR 138 CO 0.29 -0.76 0.97 -2.65 -0.54 0.00 0.00 174.62 171.93 1icp n PRO 139 N -2.66 0.79 -4.10 3.99 -0.02 -1.26 -4.82 135.00 126.92 1icp n PRO 139 Ca 0.05 0.32 -0.14 0.00 -2.02 0.00 0.00 63.50 61.70 1icp n PRO 139 Cb 0.56 -2.19 -0.11 0.00 -0.02 0.00 0.00 33.50 31.74 1icp n PRO 139 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1icp s GLN 140 N -2.94 0.64 -0.02 -0.52 -0.21 -0.83 -4.98 119.66 110.81 1icp s GLN 140 Ca 0.76 -0.88 -0.30 0.00 0.02 0.00 0.00 55.36 54.96 1icp s GLN 140 Cb -0.39 -0.40 -0.03 0.00 1.00 0.00 0.00 33.01 33.19 1icp s GLN 140 CO 0.47 0.07 0.97 0.42 -2.12 0.00 0.00 175.29 175.10 1icp s ILE 141 N -1.66 4.86 1.07 1.08 1.01 -1.26 0.70 121.20 127.00 1icp s ILE 141 Ca -0.05 2.03 -0.13 0.00 0.00 0.00 0.00 60.65 62.50 1icp s ILE 141 Cb -0.08 -4.31 0.23 0.00 0.01 0.00 0.00 42.46 38.31 1icp s ILE 141 CO 0.00 0.14 1.07 -0.04 0.00 0.00 0.00 174.94 176.11 1icp s MET 142 N 1.18 -0.12 0.36 2.79 -1.94 0.27 -4.85 119.30 116.99 1icp s MET 142 Ca 0.51 0.66 0.07 0.00 -1.71 0.00 0.00 55.69 55.23 1icp s MET 142 Cb -0.20 -1.66 0.78 0.00 2.01 0.00 0.00 34.83 35.76 1icp s MET 142 CO 0.26 -3.14 1.91 0.66 -0.01 0.00 0.00 175.02 174.70 1icp h SER 143 N -2.19 0.66 0.19 3.03 4.64 -1.96 -0.43 113.55 117.49 1icp h SER 143 Ca -0.57 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 60.77 1icp h SER 143 Cb 1.33 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1icp h SER 143 CO 0.54 0.38 0.00 -0.46 -0.87 0.00 0.00 176.83 176.43 1icp n ASN 144 N -4.51 0.00 0.00 4.97 2.04 -1.26 -4.84 115.26 111.66 1icp n ASN 144 Ca 0.14 0.07 0.00 0.00 -0.44 0.00 0.00 54.58 54.35 1icp n ASN 144 Cb 0.35 -0.25 0.00 0.00 -2.53 0.00 0.00 39.78 37.35 1icp n ASN 144 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1icp n GLY 145 N -0.30 0.14 0.06 4.83 0.00 -0.17 -4.74 105.19 105.00 1icp n GLY 145 Ca 0.06 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.01 1icp n GLY 145 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1icp n ILE 146 N -2.08 0.71 -3.99 -0.61 5.41 -1.26 -4.95 119.36 112.59 1icp n ILE 146 Ca 0.00 -0.34 -0.26 0.00 1.00 0.00 0.00 62.75 63.15 1icp n ILE 146 Cb 0.18 -0.86 -0.04 0.00 -0.71 0.00 0.00 39.64 38.21 1icp n ILE 146 CO 0.00 0.00 0.00 -1.81 0.00 0.00 0.00 176.55 174.74 1icp s ASP 147 N -4.82 6.06 -0.18 4.38 1.01 -1.26 -5.00 116.67 116.86 1icp s ASP 147 Ca -0.12 0.06 -0.07 0.00 0.71 0.00 0.00 52.55 53.13 1icp s ASP 147 Cb 0.04 -1.75 -0.04 0.00 1.01 0.00 0.00 42.92 42.18 1icp s ASP 147 CO 0.34 0.05 0.06 -0.63 0.21 0.00 0.00 175.17 175.21 1icp s ILE 148 N -1.76 4.80 -0.10 0.77 1.01 -1.26 -0.57 121.20 124.10 1icp s ILE 148 Ca 0.33 -0.03 -0.15 0.00 0.00 0.00 0.00 60.65 60.80 1icp s ILE 148 Cb -0.11 -3.16 -0.05 0.00 0.01 0.00 0.00 42.46 39.16 1icp s ILE 148 CO 0.27 0.47 0.37 0.00 0.00 0.00 0.00 174.94 176.05 1icp s ALA 149 N 0.27 3.61 0.06 9.38 0.00 0.22 -4.87 121.76 130.43 1icp s ALA 149 Ca 0.04 -0.32 0.05 0.00 0.00 0.00 0.00 51.96 51.72 1icp s ALA 149 Cb -0.12 -2.43 -0.04 0.00 0.00 0.00 0.00 23.12 20.53 1icp s ALA 149 CO 0.00 0.23 -0.05 -1.01 0.00 0.00 0.00 175.76 174.93 1icp s HIS 150 N -0.09 2.88 -0.02 0.00 3.76 -1.26 -1.96 115.29 118.60 1icp s HIS 150 Ca 0.21 -0.07 0.07 0.00 -0.15 0.00 0.00 55.06 55.13 1icp s HIS 150 Cb -0.15 -1.54 -0.02 0.00 1.11 0.00 0.00 32.58 31.99 1icp s HIS 150 CO 0.09 0.42 -0.24 -0.06 -0.85 0.00 0.00 174.74 174.10 1icp s PHE 151 N -1.16 2.40 0.17 1.40 0.40 -1.26 -4.70 117.98 115.23 1icp s PHE 151 Ca 0.21 -0.38 -0.28 0.00 -0.60 0.00 0.00 56.93 55.88 1icp s PHE 151 Cb -0.11 -1.52 -0.08 0.00 0.51 0.00 0.00 43.02 41.82 1icp s PHE 151 CO 0.13 0.02 0.87 0.99 0.70 0.00 0.00 175.22 177.92 1icp s THR 152 N -0.65 4.32 0.34 0.64 2.01 -0.93 -4.73 115.64 116.64 1icp s THR 152 Ca 0.10 1.90 -0.29 0.00 0.31 0.00 0.00 61.69 63.72 1icp s THR 152 Cb -0.10 -4.24 -0.11 0.00 0.01 0.00 0.00 72.50 68.06 1icp s THR 152 CO -0.00 0.46 1.47 -0.13 -0.69 0.00 0.00 174.62 175.73 1icp s ARG 153 N -0.83 4.17 0.80 4.92 0.52 -1.26 -4.74 118.95 122.52 1icp s ARG 153 Ca 0.40 2.49 -0.10 0.00 -0.52 0.00 0.00 55.73 58.00 1icp s ARG 153 Cb -0.24 -3.01 0.10 0.00 0.52 0.00 0.00 34.95 32.32 1icp s ARG 153 CO 0.29 -0.48 1.14 -1.25 0.02 0.00 0.00 175.30 175.01 1icp s PRO 154 N -1.63 1.77 -0.15 3.54 0.04 -1.26 -4.41 135.00 132.90 1icp s PRO 154 Ca 0.54 -0.19 -0.12 0.00 0.04 0.00 0.00 61.00 61.27 1icp s PRO 154 Cb -0.45 -2.03 -0.05 0.00 0.04 0.00 0.00 34.50 32.01 1icp s PRO 154 CO 0.57 -1.62 0.25 0.50 0.04 0.00 0.00 177.00 176.74 1icp s ARG 155 N -5.50 4.09 -0.32 4.56 3.52 0.74 -4.40 118.95 121.65 1icp s ARG 155 Ca 0.64 0.04 -0.28 0.00 -0.13 0.00 0.00 55.73 55.99 1icp s ARG 155 Cb -0.09 -3.37 0.02 0.00 -1.56 0.00 0.00 34.95 29.94 1icp s ARG 155 CO 0.48 0.37 1.04 0.50 -0.81 0.00 0.00 175.30 176.88 1icp s ARG 156 N 0.07 4.04 0.48 5.12 3.52 -1.25 -1.47 118.95 129.46 1icp s ARG 156 Ca 0.15 0.99 -0.24 0.00 -0.13 0.00 0.00 55.73 56.50 1icp s ARG 156 Cb -0.13 -3.74 -0.08 0.00 -1.56 0.00 0.00 34.95 29.44 1icp s ARG 156 CO 0.04 -0.89 1.32 1.28 -0.81 0.00 0.00 175.30 176.25 1icp n LEU 157 N 6.80 4.76 -4.88 -0.88 4.77 -0.26 -4.96 117.00 122.36 1icp n LEU 157 Ca 0.11 1.05 -0.30 0.00 -0.03 0.00 0.00 56.01 56.84 1icp n LEU 157 Cb 0.47 -1.55 -0.02 0.00 -2.33 0.00 0.00 43.42 40.00 1icp n LEU 157 CO 0.58 -0.57 0.51 0.42 -1.33 0.00 0.00 177.39 177.01 1icp s THR 158 N -1.24 4.78 0.20 -5.08 -4.23 -1.26 -4.96 115.64 103.84 1icp s THR 158 Ca 0.65 0.61 -0.11 0.00 -1.18 0.00 0.00 61.69 61.66 1icp s THR 158 Cb -0.46 -3.79 0.12 0.00 1.34 0.00 0.00 72.50 69.72 1icp s THR 158 CO 0.55 -0.73 1.73 0.74 -0.54 0.00 0.00 174.62 176.37 1icp h THR 159 N 0.61 0.74 -0.24 3.99 2.02 -2.03 -1.72 112.91 116.30 1icp h THR 159 Ca -0.47 -0.11 0.02 0.00 0.77 0.00 0.00 66.41 66.63 1icp h THR 159 Cb 1.19 0.40 -0.01 0.00 -1.74 0.00 0.00 68.15 67.99 1icp h THR 159 CO 0.63 0.06 0.16 -0.78 0.37 0.00 0.00 175.52 175.95 1icp h ASP 160 N 0.31 0.20 -0.07 4.18 3.58 -2.03 -3.11 116.42 119.48 1icp h ASP 160 Ca 0.27 -0.00 -0.21 0.00 0.42 0.00 0.00 57.03 57.52 1icp h ASP 160 Cb 0.35 -0.05 0.01 0.00 1.72 0.00 0.00 39.33 41.37 1icp h ASP 160 CO -0.32 0.14 -0.76 -0.33 -2.88 0.00 0.00 179.24 175.10 1icp h GLU 161 N 0.24 0.64 -0.97 0.28 5.08 -1.69 -3.38 114.58 114.77 1icp h GLU 161 Ca 0.10 -0.59 0.27 0.00 -1.00 0.00 0.00 59.36 58.13 1icp h GLU 161 Cb 0.10 0.15 -0.18 0.00 0.50 0.00 0.00 28.75 29.31 1icp h GLU 161 CO -0.02 1.20 0.03 -0.89 -1.00 0.00 0.00 179.01 178.34 1icp n ILE 162 N -4.03 -0.41 0.17 3.13 5.41 -1.12 0.01 119.36 122.52 1icp n ILE 162 Ca -0.09 2.13 0.15 0.00 1.00 0.00 0.00 62.75 65.94 1icp n ILE 162 Cb 0.74 -3.12 0.75 0.00 -0.71 0.00 0.00 39.64 37.30 1icp n ILE 162 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 176.55 175.90 1icp h PRO 163 N 0.00 0.00 -0.24 0.38 0.11 -1.78 -0.23 132.00 130.24 1icp h PRO 163 Ca 0.59 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 66.62 1icp h PRO 163 Cb 1.24 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 1icp h PRO 163 CO -0.91 0.00 -0.21 1.96 -0.21 0.00 0.00 178.00 178.63 1icp h GLN 164 N 0.00 0.43 0.09 1.05 4.20 -0.69 -0.80 115.11 119.39 1icp h GLN 164 Ca 0.10 -0.15 -0.27 0.00 0.06 0.00 0.00 58.65 58.39 1icp h GLN 164 Cb 0.46 -0.04 0.01 0.00 0.30 0.00 0.00 27.48 28.21 1icp h GLN 164 CO -0.00 0.62 -1.16 0.82 -0.67 0.00 0.00 178.83 178.45 1icp h ILE 165 N 0.39 1.38 -1.00 2.54 1.08 -1.13 -2.77 117.51 118.01 1icp h ILE 165 Ca 0.06 -2.64 0.07 0.00 -0.39 0.00 0.00 64.86 61.97 1icp h ILE 165 Cb 0.59 2.69 -0.07 0.00 -3.07 0.00 0.00 36.82 36.96 1icp h ILE 165 CO 0.04 0.79 0.64 0.58 -0.69 0.00 0.00 178.15 179.51 1icp h VAL 166 N 0.20 1.06 -0.30 1.67 2.07 -0.91 -0.35 116.25 119.69 1icp h VAL 166 Ca -0.14 -0.39 -0.04 0.00 0.82 0.00 0.00 66.70 66.95 1icp h VAL 166 Cb 1.83 -0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 31.41 1icp h VAL 166 CO 0.21 0.21 0.02 -1.13 0.02 0.00 0.00 177.57 176.89 1icp h ASN 167 N 1.14 0.41 -0.81 0.57 -0.73 -1.03 -2.24 115.58 112.89 1icp h ASN 167 Ca 0.44 -0.07 0.02 0.00 1.87 0.00 0.00 56.30 58.56 1icp h ASN 167 Cb 0.21 -0.11 -0.04 0.00 0.27 0.00 0.00 38.32 38.65 1icp h ASN 167 CO -0.19 0.47 0.54 -0.33 -0.37 0.00 0.00 177.43 177.55 1icp h GLU 168 N 0.44 1.04 -0.41 6.67 5.08 -0.77 0.17 114.58 126.79 1icp h GLU 168 Ca 0.10 -0.06 -0.14 0.00 -1.00 0.00 0.00 59.36 58.25 1icp h GLU 168 Cb 0.27 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 1icp h GLU 168 CO 0.01 0.69 -0.30 0.74 -1.00 0.00 0.00 179.01 179.14 1icp h PHE 169 N 1.07 1.09 -0.05 4.33 -1.00 -1.27 -1.12 116.94 119.99 1icp h PHE 169 Ca 0.31 -0.30 0.01 0.00 2.81 0.00 0.00 57.97 60.79 1icp h PHE 169 Cb -0.08 -0.24 -0.01 0.00 3.61 0.00 0.00 35.95 39.24 1icp h PHE 169 CO -0.00 1.12 0.01 -0.09 -1.61 0.00 0.00 178.31 177.74 1icp h ARG 170 N 0.75 0.04 -0.74 1.51 2.43 -0.89 -0.60 114.38 116.88 1icp h ARG 170 Ca 0.08 -0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.22 1icp h ARG 170 Cb 0.88 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.39 1icp h ARG 170 CO 0.08 0.02 0.36 0.28 -1.51 0.00 0.00 179.97 179.20 1icp h VAL 171 N 0.04 1.24 -0.82 0.20 2.07 -0.65 -1.94 116.25 116.39 1icp h VAL 171 Ca 0.02 -0.67 -0.01 0.00 0.82 0.00 0.00 66.70 66.87 1icp h VAL 171 Cb 0.01 0.32 -0.04 0.00 -1.52 0.00 0.00 31.29 30.06 1icp h VAL 171 CO -0.03 0.28 0.48 0.00 0.02 0.00 0.00 177.57 178.32 1icp h ALA 172 N 1.18 1.05 -0.65 1.67 0.00 -0.95 -0.55 119.26 121.01 1icp h ALA 172 Ca 0.25 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 1icp h ALA 172 Cb 0.12 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 1icp h ALA 172 CO -0.03 0.53 0.30 0.00 0.00 0.00 0.00 179.25 180.05 1icp h ALA 173 N 1.25 0.84 -0.70 0.00 0.00 -0.69 -0.61 119.26 119.36 1icp h ALA 173 Ca 0.29 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.98 1icp h ALA 173 Cb -0.01 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.49 1icp h ALA 173 CO -0.05 0.42 0.16 -0.09 0.00 0.00 0.00 179.25 179.69 1icp h ARG 174 N 0.91 1.12 -0.46 0.00 9.65 -0.91 -2.43 114.38 122.26 1icp h ARG 174 Ca 0.22 -0.27 -0.05 0.00 -1.10 0.00 0.00 59.98 58.78 1icp h ARG 174 Cb 0.14 -0.15 -0.02 0.00 -1.39 0.00 0.00 29.97 28.56 1icp h ARG 174 CO -0.03 1.00 0.09 -0.91 2.80 0.00 0.00 179.97 182.92 1icp h ASN 175 N 1.06 0.65 -0.73 -3.80 2.35 -0.57 -1.25 115.58 113.29 1icp h ASN 175 Ca 0.22 -0.11 -0.03 0.00 -0.55 0.00 0.00 56.30 55.82 1icp h ASN 175 Cb 0.38 -0.17 -0.03 0.00 0.05 0.00 0.00 38.32 38.55 1icp h ASN 175 CO 0.00 0.66 0.32 0.00 -1.65 0.00 0.00 177.43 176.76 1icp h ALA 176 N 1.43 0.94 -0.57 -0.83 0.00 -0.74 -0.22 119.26 119.28 1icp h ALA 176 Ca 0.15 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 1icp h ALA 176 Cb 0.28 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1icp h ALA 176 CO 0.00 0.54 0.06 0.82 0.00 0.00 0.00 179.25 180.67 1icp h ILE 177 N 1.03 1.25 -0.66 0.00 1.08 -0.96 -1.72 117.51 117.53 1icp h ILE 177 Ca 0.25 -1.00 -0.03 0.00 -0.39 0.00 0.00 64.86 63.69 1icp h ILE 177 Cb 0.17 0.74 -0.03 0.00 -3.07 0.00 0.00 36.82 34.63 1icp h ILE 177 CO -0.03 0.36 0.31 -0.08 -0.69 0.00 0.00 178.15 178.03 1icp h GLU 178 N 0.87 0.95 0.00 2.37 4.81 -0.48 -0.44 114.58 122.66 1icp h GLU 178 Ca 0.17 -0.13 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 1icp h GLU 178 Cb 0.43 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.63 1icp h GLU 178 CO 0.01 0.74 0.00 0.00 -0.73 0.00 0.00 179.01 179.03 1icp n ALA 179 N -2.44 1.71 0.00 2.92 0.00 -0.17 -4.88 120.51 117.66 1icp n ALA 179 Ca 0.06 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.46 1icp n ALA 179 Cb 0.14 -1.27 0.00 0.00 0.00 0.00 0.00 19.45 18.32 1icp n ALA 179 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1icp n GLY 180 N 0.11 0.44 3.68 0.00 0.00 -0.17 -4.18 105.19 105.07 1icp n GLY 180 Ca 0.04 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 1icp n GLY 180 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1icp n PHE 181 N -1.53 1.76 0.23 1.61 3.01 -0.71 -4.90 117.46 116.92 1icp n PHE 181 Ca 0.00 0.47 0.12 0.00 1.01 0.00 0.00 57.45 59.05 1icp n PHE 181 Cb 0.00 -2.30 0.37 0.00 -0.01 0.00 0.00 39.48 37.54 1icp n PHE 181 CO 0.00 0.00 0.00 -0.44 1.01 0.00 0.00 176.76 177.33 1icp h ASP 182 N 1.45 0.00 -1.51 4.37 3.32 -1.26 -3.41 116.42 119.37 1icp h ASP 182 Ca -0.48 0.00 0.24 0.00 0.02 0.00 0.00 57.03 56.80 1icp h ASP 182 Cb 1.32 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.82 1icp h ASP 182 CO 0.57 0.11 0.62 0.61 -1.72 0.00 0.00 179.24 179.43 1icp n GLY 183 N 0.60 0.35 3.17 2.75 0.00 -1.18 -4.77 105.19 106.11 1icp n GLY 183 Ca 0.02 -0.98 -0.16 0.00 0.00 0.00 0.00 46.02 44.90 1icp n GLY 183 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1icp s VAL 184 N -2.06 0.98 -0.19 1.61 -7.23 -0.29 -0.84 120.40 112.38 1icp s VAL 184 Ca 0.21 -1.50 -0.00 0.00 -1.81 0.00 0.00 61.98 58.87 1icp s VAL 184 Cb -0.01 -1.22 0.01 0.00 0.56 0.00 0.00 36.38 35.72 1icp s VAL 184 CO -0.00 -0.44 -0.15 -0.70 -0.31 0.00 0.00 175.10 173.49 1icp s GLU 185 N -2.38 3.11 -0.11 4.82 2.12 0.67 -0.93 118.70 126.01 1icp s GLU 185 Ca 0.02 -0.77 -0.30 0.00 0.36 0.00 0.00 54.97 54.29 1icp s GLU 185 Cb -0.06 -2.70 -0.02 0.00 0.26 0.00 0.00 34.13 31.61 1icp s GLU 185 CO 0.01 -0.20 1.21 0.42 -0.54 0.00 0.00 175.26 176.17 1icp s ILE 186 N 1.32 4.29 -1.00 -3.70 1.01 -0.22 -0.68 121.20 122.23 1icp s ILE 186 Ca 0.05 1.59 -0.23 0.00 0.00 0.00 0.00 60.65 62.06 1icp s ILE 186 Cb -0.13 -4.03 0.04 0.00 0.01 0.00 0.00 42.46 38.35 1icp s ILE 186 CO -0.10 -0.06 1.49 -2.28 0.00 0.00 0.00 174.94 173.99 1icp s HIS 187 N 2.75 2.46 -0.38 3.97 2.46 -0.36 -1.29 115.29 124.90 1icp s HIS 187 Ca 0.55 -0.68 0.06 0.00 0.47 0.00 0.00 55.06 55.46 1icp s HIS 187 Cb -0.23 -4.64 0.54 0.00 -0.13 0.00 0.00 32.58 28.12 1icp s HIS 187 CO 0.18 -1.93 1.64 0.41 -2.47 0.00 0.00 174.74 172.57 1icp n GLY 188 N 6.83 5.02 3.62 1.59 0.00 0.12 -4.53 105.19 117.83 1icp n GLY 188 Ca 0.32 -1.42 -0.31 0.00 0.00 0.00 0.00 46.02 44.61 1icp n GLY 188 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1icp n ALA 189 N -1.08 0.49 -3.73 4.61 0.00 -1.13 -4.19 120.51 115.48 1icp n ALA 189 Ca 0.45 -2.26 -0.29 0.00 0.00 0.00 0.00 53.44 51.35 1icp n ALA 189 Cb 1.17 1.33 -0.01 0.00 0.00 0.00 0.00 19.45 21.95 1icp n ALA 189 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1icp n HIS 190 N -1.17 -1.86 -1.10 0.00 8.25 -1.26 -2.44 115.22 115.63 1icp n HIS 190 Ca -0.16 0.64 -0.04 0.00 -0.26 0.00 0.00 57.72 57.91 1icp n HIS 190 Cb 0.65 -3.09 -0.02 0.00 1.12 0.00 0.00 29.99 28.65 1icp n HIS 190 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1icp n GLY 191 N -1.32 0.59 0.70 -1.41 0.00 -1.24 -4.47 105.19 98.05 1icp n GLY 191 Ca 0.03 -0.25 -0.05 0.00 0.00 0.00 0.00 46.02 45.75 1icp n GLY 191 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1icp n TYR 192 N -2.64 -3.81 -0.24 1.61 4.01 -1.02 -4.49 117.16 110.58 1icp n TYR 192 Ca -0.04 -0.24 -0.01 0.00 -0.16 0.00 0.00 57.90 57.46 1icp n TYR 192 Cb 0.25 -0.17 0.06 0.00 -0.31 0.00 0.00 39.34 39.17 1icp n TYR 192 CO 0.00 0.00 0.00 1.25 -0.46 0.00 0.00 176.86 177.65 1icp h LEU 193 N 0.00 -0.79 -0.42 7.72 5.85 -1.21 0.94 115.31 127.40 1icp h LEU 193 Ca -0.07 0.22 -0.06 0.00 0.84 0.00 0.00 57.88 58.80 1icp h LEU 193 Cb 0.22 0.48 -0.02 0.00 0.37 0.00 0.00 40.66 41.71 1icp h LEU 193 CO 0.06 -0.25 0.02 0.40 -0.34 0.00 0.00 178.44 178.32 1icp h ILE 194 N -0.04 1.26 -0.13 4.05 2.04 -1.80 -2.78 117.51 120.11 1icp h ILE 194 Ca 0.32 -0.98 -0.07 0.00 1.00 0.00 0.00 64.86 65.13 1icp h ILE 194 Cb 0.53 1.07 -0.01 0.00 -0.74 0.00 0.00 36.82 37.67 1icp h ILE 194 CO -0.73 0.34 -0.21 -0.78 0.00 0.00 0.00 178.15 176.77 1icp h ASP 195 N 0.57 0.21 -0.84 1.72 3.58 -1.56 -2.30 116.42 117.79 1icp h ASP 195 Ca 0.12 -0.06 0.04 0.00 0.42 0.00 0.00 57.03 57.56 1icp h ASP 195 Cb 0.45 -0.06 -0.05 0.00 1.72 0.00 0.00 39.33 41.39 1icp h ASP 195 CO 0.02 0.44 0.54 1.56 -2.88 0.00 0.00 179.24 178.92 1icp h GLN 196 N 0.20 0.99 -0.25 0.28 4.20 -0.56 -0.02 115.11 119.97 1icp h GLN 196 Ca 0.04 -0.06 -0.20 0.00 0.06 0.00 0.00 58.65 58.49 1icp h GLN 196 Cb 0.50 -0.22 0.00 0.00 0.30 0.00 0.00 27.48 28.06 1icp h GLN 196 CO 0.03 0.66 -0.63 0.74 -0.67 0.00 0.00 178.83 178.96 1icp h PHE 197 N 1.02 1.11 -0.45 2.96 -1.00 -1.31 -3.23 116.94 116.03 1icp h PHE 197 Ca 0.35 -0.43 -0.09 0.00 2.81 0.00 0.00 57.97 60.61 1icp h PHE 197 Cb 0.05 -0.20 -0.01 0.00 3.61 0.00 0.00 35.95 39.40 1icp h PHE 197 CO -0.03 1.26 -0.07 0.52 -1.61 0.00 0.00 178.31 178.39 1icp h MET 198 N 0.63 0.85 -6.22 1.51 2.86 -0.90 -3.43 114.93 110.24 1icp h MET 198 Ca -0.01 -0.30 -0.56 0.00 -2.06 0.00 0.00 59.70 56.77 1icp h MET 198 Cb 1.25 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 32.82 1icp h MET 198 CO 0.14 0.93 1.00 0.15 1.06 0.00 0.00 176.91 180.19 1icp s LYS 199 N -4.87 4.15 0.06 1.72 -0.14 -0.07 -4.81 119.74 115.78 1icp s LYS 199 Ca -0.12 1.85 0.13 0.00 -1.36 0.00 0.00 55.97 56.47 1icp s LYS 199 Cb 0.11 -3.89 0.57 0.00 -1.68 0.00 0.00 37.83 32.95 1icp s LYS 199 CO 0.83 -0.84 1.41 -0.40 -0.76 0.00 0.00 175.35 175.58 1icp n ASP 200 N 7.06 0.14 -0.47 2.83 5.68 -1.26 -1.13 116.55 129.40 1icp n ASP 200 Ca 0.16 0.54 0.14 0.00 -0.50 0.00 0.00 54.79 55.13 1icp n ASP 200 Cb 0.44 -0.57 0.49 0.00 -1.14 0.00 0.00 41.12 40.34 1icp n ASP 200 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1icp n GLN 201 N -1.67 1.59 -0.02 0.11 6.02 -1.08 -4.23 117.38 118.10 1icp n GLN 201 Ca 0.02 -0.94 -0.04 0.00 -0.01 0.00 0.00 57.00 56.03 1icp n GLN 201 Cb 0.13 -1.48 -0.01 0.00 1.02 0.00 0.00 30.24 29.90 1icp n GLN 201 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 1icp n VAL 202 N 0.12 0.22 -2.10 5.09 0.31 -0.59 -4.92 118.33 116.45 1icp n VAL 202 Ca 0.18 -0.06 -0.43 0.00 -0.01 0.00 0.00 64.34 64.02 1icp n VAL 202 Cb 0.36 -1.40 -0.03 0.00 -0.91 0.00 0.00 33.84 31.87 1icp n VAL 202 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 1icp s ASN 203 N -5.19 6.45 -0.14 4.52 3.84 -0.28 -4.64 114.94 119.49 1icp s ASN 203 Ca -0.06 1.74 0.15 0.00 0.21 0.00 0.00 52.86 54.91 1icp s ASN 203 Cb 0.02 -2.53 0.41 0.00 -0.55 0.00 0.00 41.25 38.60 1icp s ASN 203 CO 0.07 -1.18 1.20 -0.90 -2.79 0.00 0.00 177.10 173.50 1icp n ASP 204 N 8.16 1.51 -4.81 -4.21 3.85 -1.26 -4.80 116.55 114.98 1icp n ASP 204 Ca 0.18 -3.31 -0.33 0.00 -0.71 0.00 0.00 54.79 50.63 1icp n ASP 204 Cb 0.45 -0.46 -0.01 0.00 -1.35 0.00 0.00 41.12 39.75 1icp n ASP 204 CO 0.00 0.00 0.00 -0.13 -1.01 0.00 0.00 177.20 176.06 1icp s ARG 205 N -2.26 3.63 0.00 0.11 0.52 -1.26 -4.97 118.95 114.71 1icp s ARG 205 Ca 0.36 1.15 0.11 0.00 -0.52 0.00 0.00 55.73 56.83 1icp s ARG 205 Cb 0.36 -2.08 0.07 0.00 0.52 0.00 0.00 34.95 33.83 1icp s ARG 205 CO -0.09 -0.55 0.82 -1.13 0.02 0.00 0.00 175.30 174.37 1icp n SER 206 N -1.66 1.82 -1.40 0.23 3.41 -1.26 -3.72 113.62 111.05 1icp n SER 206 Ca 0.08 -1.41 0.00 0.00 -0.26 0.00 0.00 58.87 57.28 1icp n SER 206 Cb 0.53 0.07 0.00 0.00 -0.26 0.00 0.00 64.21 64.55 1icp n SER 206 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1icp n ASP 207 N 0.49 0.00 0.00 4.04 5.75 -1.26 -4.94 116.55 120.63 1icp n ASP 207 Ca 0.06 -0.64 0.05 0.00 -0.01 0.00 0.00 54.79 54.25 1icp n ASP 207 Cb 0.27 0.00 0.28 0.00 -1.03 0.00 0.00 41.12 40.64 1icp n ASP 207 CO 0.00 0.00 0.00 2.29 -0.11 0.00 0.00 177.20 179.38 1icp n LYS 208 N -0.64 0.15 -0.43 0.11 2.85 -1.26 -1.92 118.16 117.02 1icp n LYS 208 Ca 0.00 0.19 0.10 0.00 -1.05 0.00 0.00 58.31 57.55 1icp n LYS 208 Cb 0.00 -1.50 0.31 0.00 -0.65 0.00 0.00 35.03 33.19 1icp n LYS 208 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1icp n TYR 209 N -1.30 1.07 -4.09 5.58 4.01 -1.26 -4.46 117.16 116.72 1icp n TYR 209 Ca 0.05 -0.55 -0.10 0.00 -0.16 0.00 0.00 57.90 57.14 1icp n TYR 209 Cb 0.09 -0.09 -0.08 0.00 -0.31 0.00 0.00 39.34 38.94 1icp n TYR 209 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1icp s GLY 210 N -1.00 0.92 0.00 2.72 0.00 -0.81 -3.98 107.32 105.17 1icp s GLY 210 Ca 0.46 -1.29 0.00 0.00 0.00 0.00 0.00 44.72 43.89 1icp s GLY 210 CO 0.27 -1.12 0.00 0.61 0.00 0.00 0.00 173.10 172.86 1icp n GLY 211 N -0.22 0.91 3.53 0.20 0.00 -1.24 -4.67 105.19 103.70 1icp n GLY 211 Ca -0.03 -0.86 -0.28 0.00 0.00 0.00 0.00 46.02 44.84 1icp n GLY 211 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1icp s SER 212 N -4.00 1.25 0.17 1.61 1.04 -1.26 -4.76 113.70 107.74 1icp s SER 212 Ca 0.00 1.32 -0.11 0.00 0.48 0.00 0.00 55.95 57.65 1icp s SER 212 Cb 0.00 -2.06 0.05 0.00 0.10 0.00 0.00 66.02 64.11 1icp s SER 212 CO 0.00 -4.01 1.63 -0.07 0.98 0.00 0.00 173.24 171.77 1icp h LEU 213 N -2.49 0.96 -0.47 2.42 3.38 -1.97 -1.33 115.31 115.82 1icp h LEU 213 Ca -0.59 -0.30 0.03 0.00 0.09 0.00 0.00 57.88 57.11 1icp h LEU 213 Cb 1.34 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 41.79 1icp h LEU 213 CO 0.52 1.03 0.26 -0.08 0.09 0.00 0.00 178.44 180.25 1icp h GLU 214 N 0.87 0.50 -0.44 1.13 4.81 -1.97 -1.86 114.58 117.62 1icp h GLU 214 Ca 0.16 -0.03 -0.09 0.00 -0.13 0.00 0.00 59.36 59.28 1icp h GLU 214 Cb 0.52 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.77 1icp h GLU 214 CO 0.03 0.33 -0.06 -0.91 -0.73 0.00 0.00 179.01 177.67 1icp h ASN 215 N 0.52 0.82 0.34 1.04 4.21 -1.72 -2.51 115.58 118.29 1icp h ASN 215 Ca 0.20 -0.34 -0.05 0.00 1.21 0.00 0.00 56.30 57.32 1icp h ASN 215 Cb 0.06 -0.22 -0.01 0.00 -1.12 0.00 0.00 38.32 37.03 1icp h ASN 215 CO -0.11 0.97 -0.22 0.03 -1.29 0.00 0.00 177.43 176.80 1icp h ARG 216 N 0.66 0.00 -0.01 0.81 3.08 -1.02 -2.36 114.38 115.54 1icp h ARG 216 Ca 0.12 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.17 1icp h ARG 216 Cb 0.58 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.63 1icp h ARG 216 CO 0.03 0.22 -0.39 0.00 -1.07 0.00 0.00 179.97 178.77 1icp h ARG 218 N 1.21 0.08 -0.10 0.00 2.43 -0.96 0.03 114.38 117.07 1icp h ARG 218 Ca 0.00 -0.00 0.03 0.00 -0.81 0.00 0.00 59.98 59.20 1icp h ARG 218 Cb 0.56 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 30.06 1icp h ARG 218 CO 0.00 0.05 -0.09 0.35 -1.51 0.00 0.00 179.97 178.77 1icp h PHE 219 N 0.08 -0.23 -0.50 2.20 3.57 -1.77 0.29 116.94 120.59 1icp h PHE 219 Ca 0.16 0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.71 1icp h PHE 219 Cb 0.21 0.12 -0.04 0.00 2.79 0.00 0.00 35.95 39.03 1icp h PHE 219 CO -0.24 -0.14 0.25 0.00 -2.23 0.00 0.00 178.31 175.95 1icp h ALA 220 N 0.96 0.63 -0.06 2.41 0.00 -1.72 -1.11 119.26 120.38 1icp h ALA 220 Ca 0.07 0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.88 1icp h ALA 220 Cb 0.21 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1icp h ALA 220 CO -0.17 -0.10 -0.52 -0.07 0.00 0.00 0.00 179.25 178.39 1icp h LEU 221 N 0.49 0.19 -0.94 0.00 3.38 -0.55 -1.60 115.31 116.28 1icp h LEU 221 Ca 0.22 -0.09 -0.10 0.00 0.09 0.00 0.00 57.88 57.99 1icp h LEU 221 Cb 0.13 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 1icp h LEU 221 CO -0.15 0.68 -0.36 -0.33 0.09 0.00 0.00 178.44 178.36 1icp h GLU 222 N 0.13 0.32 -0.15 1.13 5.08 0.06 -1.82 114.58 119.34 1icp h GLU 222 Ca 0.00 -0.14 -0.03 0.00 -1.00 0.00 0.00 59.36 58.19 1icp h GLU 222 Cb 0.97 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.21 1icp h GLU 222 CO 0.08 0.64 -0.02 0.82 -1.00 0.00 0.00 179.01 179.53 1icp h ILE 223 N 0.27 1.27 -0.59 3.13 2.04 -0.77 -1.47 117.51 121.39 1icp h ILE 223 Ca 0.03 -0.91 0.07 0.00 1.00 0.00 0.00 64.86 65.05 1icp h ILE 223 Cb 0.77 1.58 -0.06 0.00 -0.74 0.00 0.00 36.82 38.37 1icp h ILE 223 CO 0.06 0.27 0.27 0.58 0.00 0.00 0.00 178.15 179.33 1icp h VAL 224 N -0.01 0.87 -0.28 1.67 2.07 -1.09 0.62 116.25 120.10 1icp h VAL 224 Ca 0.04 -0.17 -0.02 0.00 0.82 0.00 0.00 66.70 67.36 1icp h VAL 224 Cb 0.41 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 30.50 1icp h VAL 224 CO 0.01 0.09 0.08 -0.33 0.02 0.00 0.00 177.57 177.45 1icp h GLU 225 N 0.50 0.44 -0.28 1.57 5.08 -1.24 0.20 114.58 120.84 1icp h GLU 225 Ca 0.28 -0.10 -0.00 0.00 -1.00 0.00 0.00 59.36 58.54 1icp h GLU 225 Cb 0.26 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 1icp h GLU 225 CO -0.23 0.50 0.16 0.00 -1.00 0.00 0.00 179.01 178.45 1icp h ALA 226 N 0.92 0.36 -0.11 3.43 0.00 -0.90 0.13 119.26 123.09 1icp h ALA 226 Ca 0.09 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 1icp h ALA 226 Cb 0.25 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 1icp h ALA 226 CO -0.00 -0.12 0.00 0.28 0.00 0.00 0.00 179.25 179.41 1icp h VAL 227 N 0.35 1.24 -0.76 0.00 2.07 -0.77 -0.57 116.25 117.82 1icp h VAL 227 Ca 0.10 -0.78 0.02 0.00 0.82 0.00 0.00 66.70 66.86 1icp h VAL 227 Cb 0.04 1.54 -0.04 0.00 -1.52 0.00 0.00 31.29 31.31 1icp h VAL 227 CO -0.02 0.23 0.50 0.00 0.02 0.00 0.00 177.57 178.29 1icp h ALA 228 N 0.76 0.99 -0.75 1.67 0.00 -0.55 -0.99 119.26 120.38 1icp h ALA 228 Ca 0.03 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 1icp h ALA 228 Cb 0.34 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1icp h ALA 228 CO 0.01 0.33 0.29 -0.97 0.00 0.00 0.00 179.25 178.91 1icp h ASN 229 N 0.99 1.04 -0.25 0.00 -0.73 -0.62 0.56 115.58 116.57 1icp h ASN 229 Ca 0.29 -0.16 -0.10 0.00 1.87 0.00 0.00 56.30 58.20 1icp h ASN 229 Cb -0.05 -0.27 -0.00 0.00 0.27 0.00 0.00 38.32 38.27 1icp h ASN 229 CO -0.09 0.93 -0.26 -0.08 -0.37 0.00 0.00 177.43 177.57 1icp h GLU 230 N 1.10 0.61 -0.00 6.67 4.57 -0.30 -3.38 114.58 123.85 1icp h GLU 230 Ca 0.25 -0.33 0.00 0.00 -1.18 0.00 0.00 59.36 58.11 1icp h GLU 230 Cb 0.22 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 28.83 1icp h GLU 230 CO -0.02 0.92 -0.00 0.44 -1.18 0.00 0.00 179.01 179.17 1icp n ILE 231 N -4.34 0.00 0.00 2.32 -5.35 -0.45 -4.99 119.36 106.55 1icp n ILE 231 Ca -0.05 -0.50 0.00 0.00 -0.27 0.00 0.00 62.75 61.93 1icp n ILE 231 Cb 0.45 1.00 0.00 0.00 -1.74 0.00 0.00 39.64 39.35 1icp n ILE 231 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1icp n GLY 232 N 0.11 1.74 0.26 3.28 0.00 0.19 -4.68 105.19 106.09 1icp n GLY 232 Ca 0.00 -1.36 0.09 0.00 0.00 0.00 0.00 46.02 44.75 1icp n GLY 232 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1icp h SER 233 N 0.00 0.00 0.16 1.61 4.64 -1.84 -1.98 113.55 116.15 1icp h SER 233 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1icp h SER 233 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1icp h SER 233 CO 0.00 0.04 0.00 -0.90 -0.87 0.00 0.00 176.83 175.10 1icp n ASP 234 N -4.30 0.00 -0.50 4.97 3.85 -1.26 -2.07 116.55 117.25 1icp n ASP 234 Ca -0.03 -0.44 0.07 0.00 -0.71 0.00 0.00 54.79 53.68 1icp n ASP 234 Cb 0.12 -0.11 0.17 0.00 -1.35 0.00 0.00 41.12 39.95 1icp n ASP 234 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 1icp n ARG 235 N -1.11 2.51 -4.96 0.11 1.74 -0.74 -4.43 116.66 109.76 1icp n ARG 235 Ca 0.14 -2.41 -0.28 0.00 -0.77 0.00 0.00 57.85 54.54 1icp n ARG 235 Cb 0.12 -1.51 -0.16 0.00 -1.02 0.00 0.00 32.46 29.88 1icp n ARG 235 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1icp s VAL 236 N -2.19 1.61 0.22 1.55 1.01 -0.88 -1.14 120.40 120.58 1icp s VAL 236 Ca 0.29 -0.82 0.02 0.00 0.00 0.00 0.00 61.98 61.48 1icp s VAL 236 Cb 0.23 -1.37 -0.05 0.00 0.00 0.00 0.00 36.38 35.19 1icp s VAL 236 CO 0.07 0.46 0.03 -0.83 0.00 0.00 0.00 175.10 174.83 1icp s GLY 237 N -0.05 1.51 -0.06 4.51 0.00 -0.11 0.05 107.32 113.18 1icp s GLY 237 Ca -0.03 -1.75 -0.07 0.00 0.00 0.00 0.00 44.72 42.88 1icp s GLY 237 CO 0.02 -1.60 0.18 -1.50 0.00 0.00 0.00 173.10 170.20 1icp s ILE 238 N -3.59 0.01 -0.09 0.90 2.07 -1.10 -1.05 121.20 118.35 1icp s ILE 238 Ca 0.30 -0.10 0.03 0.00 -1.41 0.00 0.00 60.65 59.47 1icp s ILE 238 Cb 0.07 -0.29 -0.02 0.00 0.13 0.00 0.00 42.46 42.35 1icp s ILE 238 CO 0.09 -0.05 -0.16 -0.60 -1.91 0.00 0.00 174.94 172.30 1icp s ARG 239 N -0.12 2.89 0.09 3.50 3.52 -0.41 -0.13 118.95 128.30 1icp s ARG 239 Ca -0.02 -0.74 0.02 0.00 -0.13 0.00 0.00 55.73 54.86 1icp s ARG 239 Cb -0.02 -2.43 -0.04 0.00 -1.56 0.00 0.00 34.95 30.90 1icp s ARG 239 CO 0.00 0.39 -0.07 0.96 -0.81 0.00 0.00 175.30 175.77 1icp s ILE 240 N -0.14 0.73 -0.40 4.11 -4.36 -0.04 -0.71 121.20 120.40 1icp s ILE 240 Ca -0.02 -1.81 0.07 0.00 -0.26 0.00 0.00 60.65 58.64 1icp s ILE 240 Cb -0.14 -1.52 0.24 0.00 1.25 0.00 0.00 42.46 42.28 1icp s ILE 240 CO 0.04 -0.77 0.53 -1.54 0.24 0.00 0.00 174.94 173.43 1icp n SER 241 N 0.20 -0.26 -0.26 4.36 3.41 -1.26 -1.98 113.62 117.83 1icp n SER 241 Ca -0.14 -2.70 0.13 0.00 -0.26 0.00 0.00 58.87 55.91 1icp n SER 241 Cb 0.60 -0.37 0.41 0.00 -0.26 0.00 0.00 64.21 64.58 1icp n SER 241 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 1icp h PRO 242 N 4.27 0.60 -0.01 4.33 0.11 -1.89 -2.09 132.00 137.33 1icp h PRO 242 Ca 0.08 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.16 1icp h PRO 242 Cb 0.90 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 31.88 1icp h PRO 242 CO 0.43 0.40 -0.17 1.19 -0.21 0.00 0.00 178.00 179.63 1icp n PHE 243 N -4.55 0.00 -2.90 0.65 3.01 -1.26 -4.63 117.46 107.77 1icp n PHE 243 Ca 0.18 0.00 -0.34 0.00 1.01 0.00 0.00 57.45 58.29 1icp n PHE 243 Cb 0.51 -0.10 -0.07 0.00 -0.01 0.00 0.00 39.48 39.82 1icp n PHE 243 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1icp s ALA 244 N -2.37 3.17 -1.02 4.37 0.00 -0.79 -4.78 121.76 120.35 1icp s ALA 244 Ca 0.28 0.34 0.09 0.00 0.00 0.00 0.00 51.96 52.67 1icp s ALA 244 Cb 0.20 -3.05 0.09 0.00 0.00 0.00 0.00 23.12 20.36 1icp s ALA 244 CO 0.47 0.20 0.83 0.72 0.00 0.00 0.00 175.76 177.98 1icp n HIS 245 N -0.15 0.05 -1.46 0.00 8.25 -1.26 -4.33 115.22 116.31 1icp n HIS 245 Ca 0.04 -0.07 -0.51 0.00 -0.26 0.00 0.00 57.72 56.92 1icp n HIS 245 Cb 0.53 -0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.58 1icp n HIS 245 CO 0.00 0.00 0.00 0.98 0.64 0.00 0.00 176.34 177.96 1icp n TYR 246 N 0.45 0.16 -3.61 4.41 9.36 -1.26 -1.59 117.16 125.09 1icp n TYR 246 Ca 0.06 0.95 -0.23 0.00 3.32 0.00 0.00 57.90 62.00 1icp n TYR 246 Cb 0.24 -2.05 0.07 0.00 -0.63 0.00 0.00 39.34 36.97 1icp n TYR 246 CO 0.00 0.00 0.00 0.09 0.22 0.00 0.00 176.86 177.17 1icp n ASN 247 N 1.81 -4.48 -4.17 2.98 3.02 -1.26 -2.96 115.26 110.20 1icp n ASN 247 Ca 0.18 -0.62 -0.33 0.00 -0.03 0.00 0.00 54.58 53.78 1icp n ASN 247 Cb 0.20 -4.81 -0.03 0.00 -0.61 0.00 0.00 39.78 34.52 1icp n ASN 247 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1icp n GLU 248 N -4.66 -2.99 -3.43 3.52 1.02 -0.62 -4.85 120.64 108.63 1icp n GLU 248 Ca -0.10 0.36 -0.26 0.00 -0.02 0.00 0.00 57.16 57.13 1icp n GLU 248 Cb 0.60 -4.83 -0.08 0.00 -0.02 0.00 0.00 31.44 27.10 1icp n GLU 248 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1icp n ALA 249 N -4.40 3.59 -2.09 0.62 0.00 -0.78 -4.80 120.51 112.66 1icp n ALA 249 Ca -0.06 -4.38 -0.18 0.00 0.00 0.00 0.00 53.44 48.82 1icp n ALA 249 Cb 0.56 -0.89 -0.01 0.00 0.00 0.00 0.00 19.45 19.11 1icp n ALA 249 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1icp s GLY 250 N -1.98 2.02 0.03 0.00 0.00 -1.26 -4.39 107.32 101.75 1icp s GLY 250 Ca 0.37 -1.75 0.05 0.00 0.00 0.00 0.00 44.72 43.38 1icp s GLY 250 CO -0.06 -1.57 -0.14 -0.35 0.00 0.00 0.00 173.10 170.98 1icp s ASP 251 N -4.27 1.65 0.36 1.64 -1.08 -1.26 -2.62 116.67 111.09 1icp s ASP 251 Ca 0.52 -0.43 0.27 0.00 -0.52 0.00 0.00 52.55 52.40 1icp s ASP 251 Cb -0.07 -0.12 1.02 0.00 -1.46 0.00 0.00 42.92 42.29 1icp s ASP 251 CO 0.31 0.05 1.80 0.71 0.52 0.00 0.00 175.17 178.56 1icp h THR 252 N 4.55 0.00 -1.92 1.71 1.35 -1.97 -3.35 112.91 113.28 1icp h THR 252 Ca -0.37 -0.43 -0.53 0.00 -0.55 0.00 0.00 66.41 64.52 1icp h THR 252 Cb 1.18 1.32 -0.38 0.00 -1.73 0.00 0.00 68.15 68.53 1icp h THR 252 CO 0.45 0.00 -1.10 -3.20 -0.25 0.00 0.00 175.52 171.41 1icp n ASN 253 N -2.60 0.17 -0.30 5.36 2.85 -1.26 -4.99 115.26 114.49 1icp n ASN 253 Ca 0.02 -2.77 0.08 0.00 -0.11 0.00 0.00 54.58 51.80 1icp n ASN 253 Cb 0.31 -0.54 0.24 0.00 1.24 0.00 0.00 39.78 41.03 1icp n ASN 253 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1icp h PRO 254 N 3.82 0.58 -0.38 1.20 0.11 -1.83 -0.92 132.00 134.58 1icp h PRO 254 Ca 0.07 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.13 1icp h PRO 254 Cb 0.90 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 31.86 1icp h PRO 254 CO 0.46 0.39 0.18 1.15 -0.21 0.00 0.00 178.00 179.97 1icp h THR 255 N 0.60 1.17 -0.53 -1.15 2.02 -1.94 0.11 112.91 113.20 1icp h THR 255 Ca 0.48 -0.49 -0.11 0.00 0.77 0.00 0.00 66.41 67.05 1icp h THR 255 Cb 0.71 0.79 -0.02 0.00 -1.74 0.00 0.00 68.15 67.89 1icp h THR 255 CO -0.38 0.18 -0.12 0.00 0.37 0.00 0.00 175.52 175.57 1icp h ALA 256 N 1.03 0.79 -0.10 6.16 0.00 -1.85 -0.86 119.26 124.43 1icp h ALA 256 Ca 0.13 -0.35 -0.00 0.00 0.00 0.00 0.00 54.91 54.68 1icp h ALA 256 Cb 0.12 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 1icp h ALA 256 CO -0.02 0.67 0.05 1.25 0.00 0.00 0.00 179.25 181.20 1icp h LEU 257 N 0.89 0.13 -0.63 0.00 5.85 -0.89 0.26 115.31 120.92 1icp h LEU 257 Ca 0.14 -0.11 -0.02 0.00 0.84 0.00 0.00 57.88 58.72 1icp h LEU 257 Cb 0.68 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.65 1icp h LEU 257 CO 0.05 0.20 0.30 1.23 -0.34 0.00 0.00 178.44 179.89 1icp h GLY 258 N 0.04 0.97 0.92 3.75 0.00 -0.69 -1.74 103.07 106.32 1icp h GLY 258 Ca 0.03 -0.48 -0.01 0.00 0.00 0.00 0.00 47.33 46.87 1icp h GLY 258 CO -0.00 0.46 0.12 -2.00 0.00 0.00 0.00 176.54 175.11 1icp h LEU 259 N 0.87 0.38 -0.84 3.11 5.85 -0.99 -1.71 115.31 121.98 1icp h LEU 259 Ca 0.22 -0.16 0.03 0.00 0.84 0.00 0.00 57.88 58.81 1icp h LEU 259 Cb 0.12 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 41.00 1icp h LEU 259 CO -0.03 0.43 0.55 0.22 -0.34 0.00 0.00 178.44 179.27 1icp h TYR 260 N 0.30 1.02 -0.02 1.25 3.20 -0.76 -1.35 116.97 120.63 1icp h TYR 260 Ca 0.09 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.99 1icp h TYR 260 Cb 0.17 -0.34 -0.00 0.00 1.54 0.00 0.00 36.73 38.10 1icp h TYR 260 CO -0.01 0.60 0.01 0.52 -1.64 0.00 0.00 178.16 177.63 1icp h MET 261 N 1.07 0.02 -0.48 1.82 2.86 -1.03 -1.01 114.93 118.19 1icp h MET 261 Ca 0.33 -0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.89 1icp h MET 261 Cb -0.01 -0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.62 1icp h MET 261 CO -0.11 0.18 -0.01 -0.39 1.06 0.00 0.00 176.91 177.64 1icp h VAL 262 N -0.14 1.24 -0.57 -2.22 -1.51 -1.07 0.59 116.25 112.57 1icp h VAL 262 Ca 0.01 -1.02 -0.05 0.00 -1.23 0.00 0.00 66.70 64.40 1icp h VAL 262 Cb 0.17 0.89 -0.02 0.00 -2.13 0.00 0.00 31.29 30.19 1icp h VAL 262 CO -0.00 0.36 0.17 -0.33 -1.23 0.00 0.00 177.57 176.54 1icp h GLU 263 N 0.75 0.89 -0.25 5.19 5.08 -1.20 -2.46 114.58 122.56 1icp h GLU 263 Ca 0.14 -0.20 -0.08 0.00 -1.00 0.00 0.00 59.36 58.23 1icp h GLU 263 Cb 0.47 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 1icp h GLU 263 CO 0.02 0.81 -0.17 0.77 -1.00 0.00 0.00 179.01 179.44 1icp h SER 264 N 0.80 0.43 0.86 1.42 0.02 -0.72 -2.82 113.55 113.53 1icp h SER 264 Ca 0.18 -0.12 -0.03 0.00 -0.84 0.00 0.00 61.79 60.98 1icp h SER 264 Cb 0.30 -0.12 -0.00 0.00 0.14 0.00 0.00 62.40 62.72 1icp h SER 264 CO -0.00 0.63 -0.16 -0.07 -1.14 0.00 0.00 176.83 176.09 1icp h LEU 265 N 0.41 0.00 -2.32 5.07 3.38 -0.47 -3.16 115.31 118.21 1icp h LEU 265 Ca 0.07 0.00 0.02 0.00 0.09 0.00 0.00 57.88 58.06 1icp h LEU 265 Cb 0.54 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.28 1icp h LEU 265 CO 0.03 0.16 0.07 0.78 0.09 0.00 0.00 178.44 179.57 1icp h ASN 266 N 0.00 0.00 0.73 -0.43 2.35 -1.18 -1.70 115.58 115.34 1icp h ASN 266 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1icp h ASN 266 Cb 0.63 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.00 1icp h ASN 266 CO 0.02 0.00 0.00 2.29 -1.65 0.00 0.00 177.43 178.09 1icp n LYS 267 N -3.95 0.05 0.01 0.81 2.85 -1.19 -3.74 118.16 113.00 1icp n LYS 267 Ca -0.01 0.22 0.11 0.00 -1.05 0.00 0.00 58.31 57.57 1icp n LYS 267 Cb 0.17 -1.58 -0.09 0.00 -0.65 0.00 0.00 35.03 32.87 1icp n LYS 267 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1icp n TYR 268 N -1.68 0.18 -3.26 5.58 4.02 -0.64 -5.01 117.16 116.35 1icp n TYR 268 Ca 0.04 0.05 -0.16 0.00 -0.01 0.00 0.00 57.90 57.82 1icp n TYR 268 Cb 0.24 -0.45 0.07 0.00 -0.02 0.00 0.00 39.34 39.18 1icp n TYR 268 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 176.86 172.38 1icp n ASP 269 N -2.10 -3.50 -4.71 7.72 -0.08 -1.25 -4.81 116.55 107.82 1icp n ASP 269 Ca -0.01 -0.48 -0.29 0.00 -1.51 0.00 0.00 54.79 52.51 1icp n ASP 269 Cb 0.49 -4.24 0.16 0.00 2.34 0.00 0.00 41.12 39.88 1icp n ASP 269 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 1icp s LEU 270 N -5.79 1.78 0.18 -2.67 1.43 -1.26 -3.99 118.68 108.36 1icp s LEU 270 Ca 0.20 1.18 -0.06 0.00 -1.03 0.00 0.00 54.13 54.42 1icp s LEU 270 Cb -0.09 -3.43 0.08 0.00 0.03 0.00 0.00 46.19 42.79 1icp s LEU 270 CO 0.59 -2.94 1.52 0.00 0.23 0.00 0.00 176.35 175.76 1icp h ALA 271 N -1.76 0.69 -1.55 4.21 0.00 -0.06 -3.45 119.26 117.35 1icp h ALA 271 Ca -0.53 -0.47 0.29 0.00 0.00 0.00 0.00 54.91 54.20 1icp h ALA 271 Cb 1.32 -0.10 -0.14 0.00 0.00 0.00 0.00 17.79 18.87 1icp h ALA 271 CO 0.58 0.67 0.79 1.52 0.00 0.00 0.00 179.25 182.81 1icp s TYR 272 N -4.22 -0.08 -0.11 0.00 -0.85 -1.21 -4.33 117.35 106.55 1icp s TYR 272 Ca -0.09 -0.02 0.02 0.00 -0.52 0.00 0.00 57.07 56.47 1icp s TYR 272 Cb 0.12 0.54 0.01 0.00 0.38 0.00 0.00 41.96 43.01 1icp s TYR 272 CO 0.85 -0.30 -0.17 0.00 -1.52 0.00 0.00 175.55 174.41 1icp s HIS 274 N 0.82 2.99 -0.05 0.00 2.46 0.82 -1.33 115.29 121.00 1icp s HIS 274 Ca -0.10 -0.80 0.05 0.00 0.47 0.00 0.00 55.06 54.68 1icp s HIS 274 Cb -0.16 -2.14 -0.01 0.00 -0.13 0.00 0.00 32.58 30.15 1icp s HIS 274 CO 0.01 -0.50 -0.20 0.08 -2.47 0.00 0.00 174.74 171.66 1icp s VAL 275 N 1.50 1.69 0.01 0.89 1.01 -0.26 -0.86 120.40 124.39 1icp s VAL 275 Ca 0.06 -0.86 -0.20 0.00 0.00 0.00 0.00 61.98 60.97 1icp s VAL 275 Cb -0.14 -1.44 -0.06 0.00 0.00 0.00 0.00 36.38 34.74 1icp s VAL 275 CO -0.01 0.48 0.59 -0.69 0.00 0.00 0.00 175.10 175.47 1icp s VAL 276 N -0.05 4.87 0.57 2.92 1.01 -0.84 -2.74 120.40 126.14 1icp s VAL 276 Ca -0.04 1.25 -0.19 0.00 0.00 0.00 0.00 61.98 63.00 1icp s VAL 276 Cb -0.12 -3.93 -0.05 0.00 0.00 0.00 0.00 36.38 32.28 1icp s VAL 276 CO 0.03 0.44 1.17 -1.61 0.00 0.00 0.00 175.10 175.13 1icp s GLU 277 N -0.35 3.14 0.77 2.72 0.41 0.24 -4.75 118.70 120.89 1icp s GLU 277 Ca 0.31 1.72 -0.14 0.00 -0.41 0.00 0.00 54.97 56.44 1icp s GLU 277 Cb -0.18 -1.96 0.06 0.00 -1.78 0.00 0.00 34.13 30.26 1icp s GLU 277 CO 0.18 -1.04 1.17 -2.30 -0.49 0.00 0.00 175.26 172.78 1icp n PRO 278 N -1.48 0.39 0.16 0.39 -0.02 -1.26 -4.92 135.00 128.26 1icp n PRO 278 Ca 0.13 0.20 -0.14 0.00 -2.02 0.00 0.00 63.50 61.67 1icp n PRO 278 Cb 0.50 -2.42 -0.08 0.00 -0.02 0.00 0.00 33.50 31.48 1icp n PRO 278 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 1icp h ARG 279 N -0.57 -0.40 -6.24 -0.52 2.43 -1.93 -3.41 114.38 103.74 1icp h ARG 279 Ca -0.47 0.03 -0.56 0.00 -0.81 0.00 0.00 59.98 58.16 1icp h ARG 279 Cb 1.31 0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 30.92 1icp h ARG 279 CO 0.47 -0.11 1.02 -1.64 -1.51 0.00 0.00 179.97 178.20 1icp s MET 280 N -4.99 4.07 0.41 0.20 -1.94 -1.26 -4.99 119.30 110.81 1icp s MET 280 Ca -0.15 1.77 -0.21 0.00 -1.71 0.00 0.00 55.69 55.39 1icp s MET 280 Cb 0.03 -3.91 -0.11 0.00 2.01 0.00 0.00 34.83 32.85 1icp s MET 280 CO 0.57 -0.94 0.93 0.15 -0.01 0.00 0.00 175.02 175.72 1icp s LYS 281 N 4.02 4.23 0.00 2.03 3.01 -1.26 -5.01 119.74 126.76 1icp s LYS 281 Ca 0.64 1.09 0.00 0.00 -1.01 0.00 0.00 55.97 56.70 1icp s LYS 281 Cb -0.25 -2.24 0.00 0.00 -1.01 0.00 0.00 37.83 34.33 1icp s LYS 281 CO 0.23 0.00 0.00 -2.37 0.51 0.00 0.00 175.35 173.73 1icp n THR 282 N -0.55 0.00 0.00 2.17 5.66 -1.26 -5.19 114.28 115.11 1icp n THR 282 Ca 0.06 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.06 1icp n THR 282 Cb 0.54 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.32 1icp n THR 282 CO 0.00 0.00 0.00 1.07 -3.05 0.00 0.00 175.07 173.09 1icp n THR 290 N 0.00 0.00 -2.74 1.09 5.66 -1.26 -5.28 114.28 111.75 1icp n THR 290 Ca 0.00 0.00 -0.42 0.00 -3.05 0.00 0.00 64.05 60.58 1icp n THR 290 Cb 0.00 0.00 -0.03 0.00 -1.55 0.00 0.00 70.33 68.75 1icp n THR 290 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 175.07 170.41 1icp s GLU 291 N -3.55 4.30 0.02 1.09 2.02 -1.26 -5.01 118.70 116.30 1icp s GLU 291 Ca 0.00 1.25 -0.04 0.00 0.02 0.00 0.00 54.97 56.20 1icp s GLU 291 Cb 0.00 -3.61 -0.01 0.00 0.10 0.00 0.00 34.13 30.61 1icp s GLU 291 CO 0.00 -0.48 0.07 0.45 0.02 0.00 0.00 175.26 175.31 1icp s SER 292 N 1.19 0.15 0.00 -0.19 0.15 -1.26 -4.84 113.70 108.90 1icp s SER 292 Ca 0.43 -0.41 0.25 0.00 0.70 0.00 0.00 55.95 56.92 1icp s SER 292 Cb -0.16 0.17 0.44 0.00 -1.71 0.00 0.00 66.02 64.77 1icp s SER 292 CO 0.10 -0.38 1.39 0.18 1.20 0.00 0.00 173.24 175.73 1icp n LEU 293 N 1.30 2.33 -0.07 3.45 4.77 -1.26 -4.44 117.00 123.08 1icp n LEU 293 Ca -0.22 -0.78 -0.10 0.00 -0.03 0.00 0.00 56.01 54.88 1icp n LEU 293 Cb 0.56 -0.01 -0.02 0.00 -2.33 0.00 0.00 43.42 41.62 1icp n LEU 293 CO 0.21 0.39 0.97 0.58 -1.33 0.00 0.00 177.39 178.21 1icp h VAL 294 N 3.53 1.09 -0.57 4.08 2.07 -1.95 -0.69 116.25 123.81 1icp h VAL 294 Ca 0.00 -0.19 0.01 0.00 0.82 0.00 0.00 66.70 67.35 1icp h VAL 294 Cb 0.80 0.74 -0.03 0.00 -1.52 0.00 0.00 31.29 31.28 1icp h VAL 294 CO 0.00 0.08 0.38 -0.65 0.02 0.00 0.00 177.57 177.40 1icp h PRO 295 N 0.34 0.71 -0.39 1.57 0.11 -2.00 -0.10 132.00 132.25 1icp h PRO 295 Ca 0.10 -0.04 -0.13 0.00 0.11 0.00 0.00 66.00 66.03 1icp h PRO 295 Cb -0.01 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 30.93 1icp h PRO 295 CO -0.02 0.47 -0.27 0.52 -0.21 0.00 0.00 178.00 178.49 1icp h MET 296 N 0.73 0.87 -0.37 1.05 2.86 -1.71 -0.50 114.93 117.87 1icp h MET 296 Ca 0.21 -0.42 -0.02 0.00 -2.06 0.00 0.00 59.70 57.41 1icp h MET 296 Cb -0.03 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.61 1icp h MET 296 CO -0.05 1.06 0.14 -0.09 1.06 0.00 0.00 176.91 179.04 1icp h ARG 297 N 0.68 0.55 -0.80 1.72 1.12 -0.49 0.12 114.38 117.28 1icp h ARG 297 Ca 0.08 -0.10 -0.03 0.00 -1.11 0.00 0.00 59.98 58.82 1icp h ARG 297 Cb 0.85 -0.09 -0.04 0.00 -0.01 0.00 0.00 29.97 30.68 1icp h ARG 297 CO 0.07 0.54 0.39 0.87 -3.11 0.00 0.00 179.97 178.73 1icp h LYS 298 N 0.45 1.14 0.00 0.20 1.57 -0.91 -2.81 116.57 116.21 1icp h LYS 298 Ca 0.12 -0.16 -0.15 0.00 -1.87 0.00 0.00 60.65 58.60 1icp h LYS 298 Cb 0.20 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 32.28 1icp h LYS 298 CO -0.01 0.87 -0.71 0.00 -0.57 0.00 0.00 179.45 179.03 1icp h ALA 299 N 1.29 0.66 -2.42 3.86 0.00 -0.76 -3.44 119.26 118.45 1icp h ALA 299 Ca 0.28 -0.64 -0.54 0.00 0.00 0.00 0.00 54.91 54.00 1icp h ALA 299 Cb 0.10 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1icp h ALA 299 CO -0.04 0.88 0.37 -0.47 0.00 0.00 0.00 179.25 180.00 1icp s TYR 300 N -3.11 3.67 -1.60 0.00 6.14 0.37 -4.69 117.35 118.14 1icp s TYR 300 Ca 0.01 1.71 0.26 0.00 0.64 0.00 0.00 57.07 59.69 1icp s TYR 300 Cb 0.10 -3.12 0.70 0.00 0.42 0.00 0.00 41.96 40.07 1icp s TYR 300 CO 0.77 0.00 1.53 1.63 0.64 0.00 0.00 175.55 180.13 1icp n LYS 301 N 3.82 0.66 0.00 4.97 4.76 -1.26 -4.89 118.16 126.22 1icp n LYS 301 Ca 0.06 -0.39 0.00 0.00 -2.87 0.00 0.00 58.31 55.11 1icp n LYS 301 Cb 0.51 -1.49 0.00 0.00 -1.84 0.00 0.00 35.03 32.21 1icp n LYS 301 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1icp n GLY 302 N 1.37 2.95 3.71 0.72 0.00 -1.26 -5.06 105.19 107.62 1icp n GLY 302 Ca 0.11 -1.98 -0.42 0.00 0.00 0.00 0.00 46.02 43.73 1icp n GLY 302 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1icp s THR 303 N 2.18 4.57 -0.24 2.61 2.01 -1.26 -4.97 115.64 120.55 1icp s THR 303 Ca 0.00 1.85 -0.03 0.00 0.31 0.00 0.00 61.69 63.82 1icp s THR 303 Cb 0.00 -4.18 0.01 0.00 0.01 0.00 0.00 72.50 68.33 1icp s THR 303 CO 0.00 0.14 -0.04 0.12 -0.69 0.00 0.00 174.62 174.15 1icp s PHE 304 N 1.07 3.00 -0.17 4.92 5.36 -1.26 -1.47 117.98 129.43 1icp s PHE 304 Ca 0.54 -1.16 -0.06 0.00 -0.96 0.00 0.00 56.93 55.29 1icp s PHE 304 Cb -0.24 -2.10 -0.04 0.00 -0.34 0.00 0.00 43.02 40.30 1icp s PHE 304 CO 0.28 -0.62 0.03 0.42 -1.46 0.00 0.00 175.22 173.88 1icp s ILE 305 N 1.43 4.55 0.19 3.12 1.01 -0.44 -0.66 121.20 130.40 1icp s ILE 305 Ca 0.04 -0.12 0.09 0.00 0.00 0.00 0.00 60.65 60.66 1icp s ILE 305 Cb -0.15 -3.03 -0.04 0.00 0.01 0.00 0.00 42.46 39.24 1icp s ILE 305 CO -0.03 0.47 -0.10 0.68 0.00 0.00 0.00 174.94 175.96 1icp s VAL 306 N 0.32 3.13 0.04 2.92 -7.23 -0.50 -1.10 120.40 117.99 1icp s VAL 306 Ca 0.01 -1.74 -0.22 0.00 -1.81 0.00 0.00 61.98 58.23 1icp s VAL 306 Cb -0.13 -2.57 0.05 0.00 0.56 0.00 0.00 36.38 34.30 1icp s VAL 306 CO 0.01 -0.15 0.50 0.00 -0.31 0.00 0.00 175.10 175.15 1icp s ALA 307 N -1.80 -1.28 0.00 1.32 0.00 -1.11 -0.86 121.76 118.04 1icp s ALA 307 Ca 0.25 0.59 0.00 0.00 0.00 0.00 0.00 51.96 52.80 1icp s ALA 307 Cb -0.08 0.34 0.00 0.00 0.00 0.00 0.00 23.12 23.37 1icp s ALA 307 CO 0.15 -0.48 0.00 0.41 0.00 0.00 0.00 175.76 175.85 1icp n GLY 308 N 0.50 1.94 2.05 0.00 0.00 -1.26 -0.59 105.19 107.83 1icp n GLY 308 Ca -0.19 -0.62 -0.01 0.00 0.00 0.00 0.00 46.02 45.20 1icp n GLY 308 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1icp n GLY 309 N 0.00 0.50 3.83 -0.02 0.00 -1.26 -4.77 105.19 103.47 1icp n GLY 309 Ca 0.00 -0.89 -0.34 0.00 0.00 0.00 0.00 46.02 44.80 1icp n GLY 309 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1icp s TYR 310 N -2.04 3.43 0.12 1.61 1.51 -1.26 -5.05 117.35 115.66 1icp s TYR 310 Ca 0.00 1.45 0.01 0.00 -1.01 0.00 0.00 57.07 57.52 1icp s TYR 310 Cb 0.00 -2.71 -0.00 0.00 -0.11 0.00 0.00 41.96 39.14 1icp s TYR 310 CO 0.00 0.07 0.02 -0.40 -1.11 0.00 0.00 175.55 174.13 1icp n ASP 311 N -0.19 1.71 -0.02 2.29 5.68 -1.26 -4.97 116.55 119.79 1icp n ASP 311 Ca 0.04 -1.57 -0.11 0.00 -0.50 0.00 0.00 54.79 52.65 1icp n ASP 311 Cb 0.53 0.18 -0.05 0.00 -1.14 0.00 0.00 41.12 40.63 1icp n ASP 311 CO 0.00 0.00 0.00 -0.09 -1.33 0.00 0.00 177.20 175.78 1icp h ARG 312 N 0.00 0.19 0.41 0.11 2.43 -1.99 -2.20 114.38 113.32 1icp h ARG 312 Ca -0.10 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.04 1icp h ARG 312 Cb 0.32 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.82 1icp h ARG 312 CO 0.16 0.20 -0.30 1.49 -1.51 0.00 0.00 179.97 180.00 1icp h GLU 313 N 0.12 -0.68 0.00 0.20 4.81 -2.00 -1.80 114.58 115.24 1icp h GLU 313 Ca 0.05 0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.31 1icp h GLU 313 Cb 0.06 0.15 -0.00 0.00 0.63 0.00 0.00 28.75 29.60 1icp h GLU 313 CO -0.01 -0.45 -0.09 -0.44 -0.73 0.00 0.00 179.01 177.29 1icp h ASP 314 N -0.71 0.00 -0.02 1.04 3.32 -1.96 -1.13 116.42 116.96 1icp h ASP 314 Ca -0.04 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.01 1icp h ASP 314 Cb 0.60 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.15 1icp h ASP 314 CO 0.00 0.09 -0.01 1.23 -1.72 0.00 0.00 179.24 178.83 1icp h GLY 315 N 0.27 0.04 1.00 2.75 0.00 -1.04 -0.03 103.07 106.05 1icp h GLY 315 Ca -0.00 -0.03 0.01 0.00 0.00 0.00 0.00 47.33 47.30 1icp h GLY 315 CO 0.01 0.03 0.51 3.43 0.00 0.00 0.00 176.54 180.53 1icp h ASN 316 N -0.33 0.89 -0.21 0.19 2.35 -0.90 -2.28 115.58 115.29 1icp h ASN 316 Ca 0.00 -0.02 -0.01 0.00 -0.55 0.00 0.00 56.30 55.73 1icp h ASN 316 Cb 0.39 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.53 1icp h ASN 316 CO 0.00 0.64 0.11 -0.09 -1.65 0.00 0.00 177.43 176.44 1icp h ARG 317 N 1.05 0.29 -0.57 0.81 2.43 -1.13 -0.28 114.38 116.99 1icp h ARG 317 Ca 0.29 -0.04 0.06 0.00 -0.81 0.00 0.00 59.98 59.48 1icp h ARG 317 Cb -0.11 -0.06 -0.05 0.00 -0.42 0.00 0.00 29.97 29.33 1icp h ARG 317 CO -0.07 0.29 0.28 0.00 -1.51 0.00 0.00 179.97 178.96 1icp h ALA 318 N 0.99 0.74 -0.09 2.80 0.00 -0.75 0.14 119.26 123.09 1icp h ALA 318 Ca 0.07 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1icp h ALA 318 Cb 0.09 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1icp h ALA 318 CO -0.01 -0.07 0.01 -0.07 0.00 0.00 0.00 179.25 179.10 1icp h LEU 319 N 0.53 0.15 -0.66 0.00 3.38 -1.21 0.78 115.31 118.28 1icp h LEU 319 Ca 0.26 -0.28 0.05 0.00 0.09 0.00 0.00 57.88 57.99 1icp h LEU 319 Cb 0.19 -0.04 -0.05 0.00 0.09 0.00 0.00 40.66 40.85 1icp h LEU 319 CO -0.19 0.40 0.38 0.40 0.09 0.00 0.00 178.44 179.52 1icp h ILE 320 N -0.11 1.00 -0.14 1.22 1.08 -0.69 -1.85 117.51 118.03 1icp h ILE 320 Ca 0.03 -0.25 0.00 0.00 -0.39 0.00 0.00 64.86 64.25 1icp h ILE 320 Cb 0.32 0.22 0.00 0.00 -3.07 0.00 0.00 36.82 34.29 1icp h ILE 320 CO 0.00 0.13 0.00 -0.62 -0.69 0.00 0.00 178.15 176.97 1icp n GLU 321 N -4.76 1.72 -2.35 2.37 1.02 0.46 -4.89 120.64 114.21 1icp n GLU 321 Ca 0.08 -0.68 -0.19 0.00 -0.02 0.00 0.00 57.16 56.35 1icp n GLU 321 Cb 0.15 -1.49 -0.01 0.00 -0.02 0.00 0.00 31.44 30.06 1icp n GLU 321 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1icp n ASP 322 N 0.09 -5.43 0.01 1.62 2.03 -0.70 -4.86 116.55 109.32 1icp n ASP 322 Ca 0.06 0.06 0.13 0.00 0.52 0.00 0.00 54.79 55.56 1icp n ASP 322 Cb 0.36 -4.55 0.38 0.00 -0.72 0.00 0.00 41.12 36.58 1icp n ASP 322 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1icp n ARG 323 N -2.92 0.05 -3.60 -0.67 1.74 0.25 -4.95 116.66 106.57 1icp n ARG 323 Ca -0.22 0.02 -0.04 0.00 -0.77 0.00 0.00 57.85 56.84 1icp n ARG 323 Cb 0.67 -1.54 -0.02 0.00 -1.02 0.00 0.00 32.46 30.55 1icp n ARG 323 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1icp s ALA 324 N -3.03 -1.97 -0.13 7.54 0.00 -1.23 -4.89 121.76 118.06 1icp s ALA 324 Ca 0.11 1.02 0.16 0.00 0.00 0.00 0.00 51.96 53.26 1icp s ALA 324 Cb 0.17 0.25 -0.24 0.00 0.00 0.00 0.00 23.12 23.30 1icp s ALA 324 CO 0.64 -0.79 0.17 -0.25 0.00 0.00 0.00 175.76 175.53 1icp n ASP 325 N -0.28 0.73 -3.95 0.00 8.00 0.17 -4.42 116.55 116.81 1icp n ASP 325 Ca -0.05 0.00 -0.11 0.00 0.71 0.00 0.00 54.79 55.34 1icp n ASP 325 Cb 0.61 1.21 -0.13 0.00 -0.02 0.00 0.00 41.12 42.79 1icp n ASP 325 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1icp s LEU 326 N -4.97 2.13 -0.16 0.64 1.43 -0.98 -4.85 118.68 111.91 1icp s LEU 326 Ca -0.08 -0.28 0.01 0.00 -1.03 0.00 0.00 54.13 52.75 1icp s LEU 326 Cb 0.07 -0.01 0.02 0.00 0.03 0.00 0.00 46.19 46.30 1icp s LEU 326 CO 0.73 -0.14 -0.19 -0.69 0.23 0.00 0.00 176.35 176.29 1icp s VAL 327 N -0.78 1.95 -0.06 -1.59 1.01 -0.68 -1.41 120.40 118.85 1icp s VAL 327 Ca -0.08 -0.88 -0.13 0.00 0.00 0.00 0.00 61.98 60.90 1icp s VAL 327 Cb -0.05 -1.76 -0.05 0.00 0.00 0.00 0.00 36.38 34.51 1icp s VAL 327 CO -0.00 0.52 0.32 0.00 0.00 0.00 0.00 175.10 175.94 1icp s ALA 328 N 1.20 3.72 -0.07 5.51 0.00 -0.04 -1.31 121.76 130.77 1icp s ALA 328 Ca 0.02 -0.36 0.05 0.00 0.00 0.00 0.00 51.96 51.67 1icp s ALA 328 Cb -0.14 -2.29 -0.01 0.00 0.00 0.00 0.00 23.12 20.69 1icp s ALA 328 CO -0.10 0.44 -0.24 0.71 0.00 0.00 0.00 175.76 176.57 1icp s TYR 329 N -0.76 2.49 0.00 0.00 2.02 0.21 -4.34 117.35 116.97 1icp s TYR 329 Ca 0.20 -0.78 0.00 0.00 -0.37 0.00 0.00 57.07 56.13 1icp s TYR 329 Cb -0.15 -1.64 0.00 0.00 -0.40 0.00 0.00 41.96 39.77 1icp s TYR 329 CO 0.09 -0.25 0.00 0.41 -1.57 0.00 0.00 175.55 174.23 1icp n GLY 330 N 3.09 -0.20 0.29 0.71 0.00 -1.26 -1.34 105.19 106.48 1icp n GLY 330 Ca -0.18 0.00 0.05 0.00 0.00 0.00 0.00 46.02 45.90 1icp n GLY 330 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1icp h ARG 331 N 0.00 0.57 0.00 1.61 3.08 -1.97 -0.66 114.38 117.01 1icp h ARG 331 Ca 0.00 -0.03 -0.06 0.00 0.07 0.00 0.00 59.98 59.95 1icp h ARG 331 Cb 0.00 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 29.91 1icp h ARG 331 CO 0.00 0.38 -0.29 -0.07 -1.07 0.00 0.00 179.97 178.92 1icp h LEU 332 N 0.59 0.00 -0.22 3.04 3.38 -1.93 -2.28 115.31 117.89 1icp h LEU 332 Ca 0.43 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.30 1icp h LEU 332 Cb 0.58 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 1icp h LEU 332 CO -0.35 0.29 -0.47 0.15 0.09 0.00 0.00 178.44 178.15 1icp h PHE 333 N 0.00 0.00 -0.37 1.13 3.04 -1.38 -0.81 116.94 118.55 1icp h PHE 333 Ca -0.00 0.00 -0.03 0.00 3.98 0.00 0.00 57.97 61.91 1icp h PHE 333 Cb 0.62 0.00 -0.02 0.00 2.56 0.00 0.00 35.95 39.12 1icp h PHE 333 CO 0.00 0.47 0.09 0.82 -2.02 0.00 0.00 178.31 177.68 1icp h ILE 334 N 0.00 1.22 -0.00 1.41 2.04 -0.77 -3.24 117.51 118.18 1icp h ILE 334 Ca -0.00 -0.75 0.00 0.00 1.00 0.00 0.00 64.86 65.10 1icp h ILE 334 Cb 1.27 1.01 0.00 0.00 -0.74 0.00 0.00 36.82 38.36 1icp h ILE 334 CO 0.06 0.26 -0.56 -1.54 0.00 0.00 0.00 178.15 176.37 1icp n SER 335 N -4.60 0.67 -3.77 1.72 3.41 -1.10 -4.68 113.62 105.26 1icp n SER 335 Ca -0.01 -0.46 -0.30 0.00 -0.26 0.00 0.00 58.87 57.84 1icp n SER 335 Cb 0.19 0.37 -0.14 0.00 -0.26 0.00 0.00 64.21 64.37 1icp n SER 335 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1icp s ASN 336 N -2.94 4.01 0.32 4.04 0.01 -0.32 -4.54 114.94 115.52 1icp s ASN 336 Ca 0.12 -2.04 0.02 0.00 -0.71 0.00 0.00 52.86 50.26 1icp s ASN 336 Cb 0.17 -1.03 0.60 0.00 0.41 0.00 0.00 41.25 41.40 1icp s ASN 336 CO 0.71 -0.36 1.92 -0.65 -1.51 0.00 0.00 177.10 177.21 1icp h PRO 337 N 7.58 0.91 -1.49 -0.60 0.11 -1.82 -1.97 132.00 134.71 1icp h PRO 337 Ca -0.08 -0.05 -0.72 0.00 0.11 0.00 0.00 66.00 65.26 1icp h PRO 337 Cb 0.99 -0.21 -0.28 0.00 0.11 0.00 0.00 31.00 31.61 1icp h PRO 337 CO 0.48 0.60 0.96 -0.40 -0.21 0.00 0.00 178.00 179.43 1icp n ASP 338 N -4.49 7.60 -0.17 -2.05 5.75 -1.26 -4.09 116.55 117.84 1icp n ASP 338 Ca 0.13 -3.80 -0.02 0.00 -0.01 0.00 0.00 54.79 51.10 1icp n ASP 338 Cb 0.22 -1.03 0.07 0.00 -1.03 0.00 0.00 41.12 39.35 1icp n ASP 338 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 1icp h LEU 339 N 2.50 -0.15 -0.29 -2.12 6.46 -1.69 -0.91 115.31 119.11 1icp h LEU 339 Ca 0.58 0.11 0.04 0.00 -0.12 0.00 0.00 57.88 58.50 1icp h LEU 339 Cb 0.44 0.19 -0.04 0.00 -0.73 0.00 0.00 40.66 40.52 1icp h LEU 339 CO 1.51 -0.05 0.04 -0.65 -0.62 0.00 0.00 178.44 178.67 1icp h PRO 340 N 0.16 0.14 -0.55 5.25 0.11 -1.88 -0.76 132.00 134.46 1icp h PRO 340 Ca 0.27 -0.01 0.02 0.00 0.11 0.00 0.00 66.00 66.38 1icp h PRO 340 Cb 0.40 -0.03 -0.03 0.00 0.11 0.00 0.00 31.00 31.44 1icp h PRO 340 CO -0.41 0.09 0.35 -0.22 -0.21 0.00 0.00 178.00 177.61 1icp h LYS 341 N 0.14 0.68 -0.53 1.05 1.63 -1.82 0.05 116.57 117.78 1icp h LYS 341 Ca 0.14 -0.04 -0.00 0.00 -0.85 0.00 0.00 60.65 59.89 1icp h LYS 341 Cb 0.16 -0.15 -0.03 0.00 -0.60 0.00 0.00 32.23 31.61 1icp h LYS 341 CO -0.20 0.45 0.32 0.00 -3.45 0.00 0.00 179.45 176.57 1icp h ARG 342 N 0.70 0.72 -0.57 1.90 3.08 -0.71 -1.04 114.38 118.46 1icp h ARG 342 Ca 0.21 -0.07 -0.02 0.00 0.07 0.00 0.00 59.98 60.17 1icp h ARG 342 Cb -0.03 -0.15 -0.03 0.00 0.08 0.00 0.00 29.97 29.84 1icp h ARG 342 CO -0.07 0.52 0.27 0.74 -1.07 0.00 0.00 179.97 180.36 1icp h PHE 343 N 0.71 0.83 -0.74 3.04 0.04 -0.82 0.37 116.94 120.37 1icp h PHE 343 Ca 0.19 -0.04 0.09 0.00 2.80 0.00 0.00 57.97 61.01 1icp h PHE 343 Cb -0.01 -0.26 -0.07 0.00 2.20 0.00 0.00 35.95 37.81 1icp h PHE 343 CO -0.03 0.65 0.39 1.49 -0.60 0.00 0.00 178.31 180.21 1icp h GLU 344 N 0.78 0.64 -0.01 1.51 4.81 -0.42 -1.88 114.58 120.01 1icp h GLU 344 Ca 0.20 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.39 1icp h GLU 344 Cb 0.13 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.37 1icp h GLU 344 CO -0.02 0.42 -0.24 1.28 -0.73 0.00 0.00 179.01 179.73 1icp n LEU 345 N -4.82 1.64 -3.72 1.64 4.77 -0.44 -4.90 117.00 111.17 1icp n LEU 345 Ca 0.12 -0.54 -0.23 0.00 -0.03 0.00 0.00 56.01 55.32 1icp n LEU 345 Cb 0.27 -0.05 0.04 0.00 -2.33 0.00 0.00 43.42 41.35 1icp n LEU 345 CO 0.26 0.29 0.03 -3.20 -1.33 0.00 0.00 177.39 173.44 1icp n ASN 346 N -0.07 -2.78 -4.92 -1.43 5.15 0.11 -4.98 115.26 106.34 1icp n ASN 346 Ca 0.13 -0.76 -0.27 0.00 -0.60 0.00 0.00 54.58 53.09 1icp n ASN 346 Cb 0.41 -4.24 0.02 0.00 -0.53 0.00 0.00 39.78 35.45 1icp n ASN 346 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1icp s ALA 347 N -3.50 3.35 0.83 5.20 0.00 0.03 -5.02 121.76 122.65 1icp s ALA 347 Ca 0.24 -0.69 -0.10 0.00 0.00 0.00 0.00 51.96 51.41 1icp s ALA 347 Cb -0.12 -2.57 0.09 0.00 0.00 0.00 0.00 23.12 20.52 1icp s ALA 347 CO 0.80 -0.70 1.12 -2.14 0.00 0.00 0.00 175.76 174.83 1icp s PRO 348 N -4.93 1.73 0.02 0.00 0.02 -1.26 -4.80 135.00 125.78 1icp s PRO 348 Ca 0.53 1.34 0.05 0.00 0.02 0.00 0.00 61.00 62.94 1icp s PRO 348 Cb -0.10 -1.82 -0.03 0.00 0.02 0.00 0.00 34.50 32.56 1icp s PRO 348 CO 0.45 -2.06 -0.14 -0.51 -0.33 0.00 0.00 177.00 174.40 1icp s LEU 349 N -6.20 2.78 0.24 -5.54 1.43 -1.26 -5.00 118.68 105.14 1icp s LEU 349 Ca 0.64 -0.31 -0.30 0.00 -1.03 0.00 0.00 54.13 53.13 1icp s LEU 349 Cb -0.20 -1.61 -0.09 0.00 0.03 0.00 0.00 46.19 44.32 1icp s LEU 349 CO 0.57 0.28 1.19 0.20 0.23 0.00 0.00 176.35 178.81 1icp s ASN 350 N -1.32 7.09 0.62 2.29 0.01 -1.26 -5.00 114.94 117.37 1icp s ASN 350 Ca 0.15 2.33 -0.15 0.00 -0.71 0.00 0.00 52.86 54.48 1icp s ASN 350 Cb -0.11 -2.62 -0.02 0.00 0.41 0.00 0.00 41.25 38.91 1icp s ASN 350 CO 0.05 -0.33 1.07 -0.54 -1.51 0.00 0.00 177.10 175.84 1icp s LYS 351 N -0.90 3.17 0.04 -0.60 -0.14 -1.26 -4.70 119.74 115.36 1icp s LYS 351 Ca 0.49 1.22 0.01 0.00 -1.36 0.00 0.00 55.97 56.34 1icp s LYS 351 Cb -0.34 -2.01 -0.04 0.00 -1.68 0.00 0.00 37.83 33.76 1icp s LYS 351 CO 0.41 -0.93 0.09 1.52 -0.76 0.00 0.00 175.35 175.67 1icp s TYR 352 N -2.49 3.25 -0.46 3.18 -0.85 -1.26 -4.83 117.35 113.89 1icp s TYR 352 Ca 0.64 0.14 -0.09 0.00 -0.52 0.00 0.00 57.07 57.24 1icp s TYR 352 Cb -0.17 -1.68 0.11 0.00 0.38 0.00 0.00 41.96 40.61 1icp s TYR 352 CO 0.40 0.54 0.33 1.21 -1.52 0.00 0.00 175.55 176.50 1icp s ASN 353 N -2.12 5.70 0.58 -0.18 2.47 -1.26 -4.95 114.94 115.17 1icp s ASN 353 Ca 0.27 -1.84 0.27 0.00 0.42 0.00 0.00 52.86 51.98 1icp s ASN 353 Cb -0.12 -2.01 1.68 0.00 -1.45 0.00 0.00 41.25 39.35 1icp s ASN 353 CO 0.19 -0.67 2.19 0.08 -3.72 0.00 0.00 177.10 175.17 1icp h ARG 354 N 8.45 0.00 0.00 0.43 0.11 -2.01 -2.14 114.38 119.22 1icp h ARG 354 Ca -0.22 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.86 1icp h ARG 354 Cb 1.07 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.15 1icp h ARG 354 CO 0.84 0.00 0.00 -0.44 0.10 0.00 0.00 179.97 180.47 1icp h ASP 355 N 0.00 0.00 -0.04 0.08 3.32 -1.98 -2.55 116.42 115.25 1icp h ASP 355 Ca 0.03 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.08 1icp h ASP 355 Cb 0.16 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.71 1icp h ASP 355 CO -0.00 0.00 0.00 0.35 -1.72 0.00 0.00 179.24 177.87 1icp n THR 356 N -2.40 1.58 -0.17 0.35 -2.24 -0.81 -4.59 114.28 106.01 1icp n THR 356 Ca 0.00 -1.75 -0.08 0.00 -2.27 0.00 0.00 64.05 59.95 1icp n THR 356 Cb 0.14 0.04 0.01 0.00 -2.10 0.00 0.00 70.33 68.43 1icp n THR 356 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 1icp h PHE 357 N 0.24 0.75 -0.23 4.78 0.04 -1.50 -3.29 116.94 117.72 1icp h PHE 357 Ca 0.00 -0.06 0.00 0.00 2.80 0.00 0.00 57.97 60.71 1icp h PHE 357 Cb 0.85 -0.22 0.00 0.00 2.20 0.00 0.00 35.95 38.78 1icp h PHE 357 CO 0.05 0.63 0.00 0.66 -0.60 0.00 0.00 178.31 179.05 1icp n TYR 358 N -4.56 0.37 -1.46 -0.55 4.01 -1.26 -4.54 117.16 109.16 1icp n TYR 358 Ca 0.01 -0.55 -0.30 0.00 -0.16 0.00 0.00 57.90 56.90 1icp n TYR 358 Cb 0.16 -0.06 0.11 0.00 -0.31 0.00 0.00 39.34 39.23 1icp n TYR 358 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 1icp s THR 359 N -1.24 2.83 -2.31 -0.72 -4.23 -1.24 -4.73 115.64 104.00 1icp s THR 359 Ca 0.19 0.27 0.23 0.00 -1.18 0.00 0.00 61.69 61.20 1icp s THR 359 Cb 0.11 -2.95 0.50 0.00 1.34 0.00 0.00 72.50 71.50 1icp s THR 359 CO 0.10 -0.35 1.45 -1.54 -0.54 0.00 0.00 174.62 173.74 1icp n SER 360 N -3.59 3.51 -4.76 3.99 3.41 -1.26 -4.69 113.62 110.22 1icp n SER 360 Ca 0.07 -1.99 -0.41 0.00 -0.26 0.00 0.00 58.87 56.29 1icp n SER 360 Cb 0.56 -0.32 -0.03 0.00 -0.26 0.00 0.00 64.21 64.16 1icp n SER 360 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1icp s ASP 361 N -1.33 6.94 0.62 4.04 2.15 -1.26 -4.89 116.67 122.94 1icp s ASP 361 Ca 0.42 2.52 0.38 0.00 0.43 0.00 0.00 52.55 56.30 1icp s ASP 361 Cb 0.23 -2.64 2.05 0.00 -0.30 0.00 0.00 42.92 42.26 1icp s ASP 361 CO 0.32 -0.42 2.26 -0.65 -0.17 0.00 0.00 175.17 176.51 1icp h PRO 362 N 3.84 0.00 0.00 4.34 0.11 -1.95 -3.38 132.00 134.97 1icp h PRO 362 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1icp h PRO 362 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1icp h PRO 362 CO 0.68 0.02 -0.39 -0.89 -0.21 0.00 0.00 178.00 177.21 1icp n ILE 363 N -3.31 0.56 -1.67 4.15 5.41 -1.26 -4.60 119.36 118.65 1icp n ILE 363 Ca -0.02 0.19 -0.47 0.00 1.00 0.00 0.00 62.75 63.44 1icp n ILE 363 Cb 0.13 -1.38 -0.04 0.00 -0.71 0.00 0.00 39.64 37.63 1icp n ILE 363 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07 1icp n VAL 364 N -3.23 0.59 -0.99 1.39 0.31 -1.26 -0.35 118.33 114.78 1icp n VAL 364 Ca 0.00 -0.13 0.00 0.00 -0.01 0.00 0.00 64.34 64.20 1icp n VAL 364 Cb 0.19 -1.97 0.00 0.00 -0.91 0.00 0.00 33.84 31.16 1icp n VAL 364 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1icp n GLY 365 N 4.58 0.50 1.11 2.92 0.00 -1.26 -4.67 105.19 108.36 1icp n GLY 365 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.25 1icp n GLY 365 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1icp n TYR 366 N -2.72 -0.16 -0.12 1.61 9.36 0.52 -4.78 117.16 120.87 1icp n TYR 366 Ca 0.00 0.03 0.01 0.00 3.32 0.00 0.00 57.90 61.26 1icp n TYR 366 Cb 0.06 0.04 0.01 0.00 -0.63 0.00 0.00 39.34 38.82 1icp n TYR 366 CO 0.00 0.00 0.00 0.25 0.22 0.00 0.00 176.86 177.33 1icp n THR 367 N -3.42 1.07 -0.71 2.97 -2.24 -0.55 -4.71 114.28 106.70 1icp n THR 367 Ca 0.00 -1.11 0.08 0.00 -2.27 0.00 0.00 64.05 60.75 1icp n THR 367 Cb 0.07 0.43 0.33 0.00 -2.10 0.00 0.00 70.33 69.06 1icp n THR 367 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1icp n ASP 368 N -0.59 4.62 -4.69 3.42 5.75 -1.22 -4.89 116.55 118.95 1icp n ASP 368 Ca 0.02 -2.61 -0.41 0.00 -0.01 0.00 0.00 54.79 51.78 1icp n ASP 368 Cb 0.29 -0.56 -0.04 0.00 -1.03 0.00 0.00 41.12 39.78 1icp n ASP 368 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 1icp s TYR 369 N -2.13 3.50 0.53 2.11 2.02 -1.26 -4.96 117.35 117.16 1icp s TYR 369 Ca 0.47 1.29 -0.19 0.00 -0.37 0.00 0.00 57.07 58.27 1icp s TYR 369 Cb 0.33 -2.94 -0.06 0.00 -0.40 0.00 0.00 41.96 38.89 1icp s TYR 369 CO 0.19 -0.09 1.09 -1.25 -1.57 0.00 0.00 175.55 173.92 1icp s PRO 370 N 1.50 3.50 0.71 -1.71 0.04 -1.26 -4.67 135.00 133.11 1icp s PRO 370 Ca 0.39 1.48 -0.09 0.00 0.04 0.00 0.00 61.00 62.81 1icp s PRO 370 Cb -0.17 -2.04 0.04 0.00 0.04 0.00 0.00 34.50 32.36 1icp s PRO 370 CO 0.16 -0.70 1.06 -0.06 0.04 0.00 0.00 177.00 177.50 1icp s PHE 371 N -1.92 3.14 0.25 0.56 0.40 -1.26 -4.63 117.98 114.53 1icp s PHE 371 Ca 0.70 0.78 -0.31 0.00 -0.60 0.00 0.00 56.93 57.50 1icp s PHE 371 Cb -0.20 -3.12 -0.13 0.00 0.51 0.00 0.00 43.02 40.07 1icp s PHE 371 CO 0.25 -1.29 1.37 1.28 0.70 0.00 0.00 175.22 177.53 1icp n LEU 372 N -2.97 3.08 -4.64 -0.37 4.77 -1.26 -4.88 117.00 110.73 1icp n LEU 372 Ca 0.07 1.15 -0.40 0.00 -0.03 0.00 0.00 56.01 56.80 1icp n LEU 372 Cb 0.59 -1.43 0.03 0.00 -2.33 0.00 0.00 43.42 40.28 1icp n LEU 372 CO 0.55 -0.54 0.65 -1.84 -1.33 0.00 0.00 177.39 174.88 1icp n GLU 373 N 1.76 1.35 -0.83 3.23 -0.00 -1.26 -5.19 120.64 119.70 1icp n GLU 373 Ca 0.11 0.49 0.00 0.00 -0.00 0.00 0.00 57.16 57.76 1icp n GLU 373 Cb 0.32 -2.18 0.00 0.00 -0.00 0.00 0.00 31.44 29.58 1icp n GLU 373 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.13 177.38