#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ics s VAL 11 N 0.00 0.94 0.13 1.69 0.11 -1.26 -5.13 120.40 116.88 1ics s VAL 11 Ca 0.00 -0.50 -0.31 0.00 -2.93 0.00 0.00 61.98 58.24 1ics s VAL 11 Cb 0.00 -0.79 -0.08 0.00 -1.53 0.00 0.00 36.38 33.98 1ics s VAL 11 CO 0.00 0.27 1.31 -1.81 -3.33 0.00 0.00 175.10 171.54 1ics s ASP 12 N -0.23 6.92 0.62 3.54 1.01 -1.26 -4.98 116.67 122.28 1ics s ASP 12 Ca 0.04 2.26 -0.19 0.00 0.71 0.00 0.00 52.55 55.37 1ics s ASP 12 Cb -0.05 -2.59 -0.02 0.00 1.01 0.00 0.00 42.92 41.26 1ics s ASP 12 CO -0.00 -0.56 1.31 -0.54 0.21 0.00 0.00 175.17 175.58 1ics s LYS 13 N 0.73 2.73 0.13 8.23 1.02 -1.26 -5.04 119.74 126.28 1ics s LYS 13 Ca 0.61 2.10 0.04 0.00 0.02 0.00 0.00 55.97 58.74 1ics s LYS 13 Cb -0.35 -1.96 -0.04 0.00 -0.52 0.00 0.00 37.83 34.96 1ics s LYS 13 CO 0.32 -1.47 -0.10 0.96 -0.92 0.00 0.00 175.35 174.14 1ics s ILE 14 N -1.37 1.09 0.24 2.17 -4.36 -1.26 -5.06 121.20 112.64 1ics s ILE 14 Ca 0.79 -1.92 -0.08 0.00 -0.26 0.00 0.00 60.65 59.19 1ics s ILE 14 Cb -0.38 -1.69 0.25 0.00 1.25 0.00 0.00 42.46 41.89 1ics s ILE 14 CO 0.42 -0.68 1.65 -0.65 0.24 0.00 0.00 174.94 175.91 1ics h PRO 15 N 3.05 0.12 -0.07 0.37 0.11 -1.96 -1.03 132.00 132.59 1ics h PRO 15 Ca -0.37 -0.01 0.02 0.00 0.11 0.00 0.00 66.00 65.75 1ics h PRO 15 Cb 1.19 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.27 1ics h PRO 15 CO 0.60 0.08 0.10 -0.07 -0.21 0.00 0.00 178.00 178.49 1ics h LEU 16 N 0.12 0.00 -1.22 2.35 3.38 -1.89 -1.30 115.31 116.76 1ics h LEU 16 Ca 0.39 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.36 1ics h LEU 16 Cb 0.66 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.41 1ics h LEU 16 CO -0.61 0.00 -0.04 0.23 0.09 0.00 0.00 178.44 178.11 1ics n MET 17 N -3.67 1.78 -2.19 1.13 2.81 -0.40 -0.71 117.12 115.88 1ics n MET 17 Ca -0.01 -1.22 -0.41 0.00 -1.81 0.00 0.00 57.70 54.25 1ics n MET 17 Cb 0.19 -1.47 -0.03 0.00 -0.71 0.00 0.00 33.22 31.20 1ics n MET 17 CO 0.00 0.00 0.00 -1.12 1.51 0.00 0.00 175.97 176.36 1ics s SER 18 N -2.06 6.87 1.03 7.83 0.01 -0.49 -4.43 113.70 122.46 1ics s SER 18 Ca 0.33 2.58 -0.12 0.00 1.31 0.00 0.00 55.95 60.05 1ics s SER 18 Cb 0.20 -2.64 0.21 0.00 0.21 0.00 0.00 66.02 64.00 1ics s SER 18 CO 0.35 -0.47 1.07 -2.84 0.41 0.00 0.00 173.24 171.76 1ics s PRO 19 N -1.47 0.13 -0.27 12.44 0.02 -1.25 -3.70 135.00 140.90 1ics s PRO 19 Ca 0.49 0.93 -0.25 0.00 0.02 0.00 0.00 61.00 62.19 1ics s PRO 19 Cb -0.38 -1.67 0.09 0.00 0.02 0.00 0.00 34.50 32.56 1ics s PRO 19 CO 0.49 -3.04 0.84 0.00 -0.33 0.00 0.00 177.00 174.95 1ics s LYS 21 N 0.28 2.80 -0.17 0.00 -0.14 -1.26 0.81 119.74 122.06 1ics s LYS 21 Ca 0.01 -1.27 -0.00 0.00 -1.36 0.00 0.00 55.97 53.35 1ics s LYS 21 Cb -0.05 -3.87 0.00 0.00 -1.68 0.00 0.00 37.83 32.24 1ics s LYS 21 CO -0.01 -0.87 -0.15 1.41 -0.76 0.00 0.00 175.35 174.97 1ics s MET 22 N 1.54 3.19 5.62 1.68 1.75 -0.03 -4.96 119.30 128.09 1ics s MET 22 Ca 0.03 -0.75 0.00 0.00 -1.25 0.00 0.00 55.69 53.72 1ics s MET 22 Cb -0.22 -2.67 0.00 0.00 2.84 0.00 0.00 34.83 34.78 1ics s MET 22 CO 0.05 -0.07 0.00 0.41 -0.65 0.00 0.00 175.02 174.77 1ics n GLY 23 N 4.30 3.15 1.39 2.11 0.00 -1.24 -0.05 105.19 114.85 1ics n GLY 23 Ca -0.19 -0.14 0.06 0.00 0.00 0.00 0.00 46.02 45.74 1ics n GLY 23 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1ics n LYS 24 N 14.00 3.46 -4.59 1.61 2.85 -1.26 -4.94 118.16 129.30 1ics n LYS 24 Ca 0.00 -2.15 -0.31 0.00 -1.05 0.00 0.00 58.31 54.80 1ics n LYS 24 Cb 0.00 -1.92 -0.12 0.00 -0.65 0.00 0.00 35.03 32.33 1ics n LYS 24 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 177.40 177.29 1ics s PHE 25 N -2.07 2.58 -0.71 5.58 0.40 0.93 -5.09 117.98 119.61 1ics s PHE 25 Ca 0.38 -0.24 -0.11 0.00 -0.60 0.00 0.00 56.93 56.35 1ics s PHE 25 Cb 0.27 -1.46 0.18 0.00 0.51 0.00 0.00 43.02 42.53 1ics s PHE 25 CO 0.13 0.28 0.62 -1.21 0.70 0.00 0.00 175.22 175.75 1ics s GLU 26 N -1.55 3.19 0.42 0.44 0.41 -1.26 -0.85 118.70 119.50 1ics s GLU 26 Ca 0.15 -2.30 -0.22 0.00 -0.41 0.00 0.00 54.97 52.19 1ics s GLU 26 Cb -0.11 -4.22 -0.10 0.00 -1.78 0.00 0.00 34.13 27.93 1ics s GLU 26 CO 0.06 -1.26 0.99 -0.51 -0.49 0.00 0.00 175.26 174.05 1ics s LEU 27 N 0.44 4.03 0.02 1.80 1.43 0.24 -4.76 118.68 121.89 1ics s LEU 27 Ca 0.14 1.85 0.23 0.00 -1.03 0.00 0.00 54.13 55.32 1ics s LEU 27 Cb -0.17 -4.37 0.09 0.00 0.03 0.00 0.00 46.19 41.77 1ics s LEU 27 CO -0.05 -0.44 1.08 0.00 0.23 0.00 0.00 176.35 177.17 1ics s HIS 29 N -3.11 -0.05 -1.15 0.00 0.00 -1.25 -3.77 115.29 105.96 1ics s HIS 29 Ca 0.06 -0.49 0.14 0.00 -3.00 0.00 0.00 55.06 51.77 1ics s HIS 29 Cb 0.16 0.76 0.39 0.00 -4.00 0.00 0.00 32.58 29.89 1ics s HIS 29 CO 0.79 -1.36 1.33 0.54 -1.00 0.00 0.00 174.74 175.04 1ics n ARG 30 N -0.49 2.86 -2.88 -0.38 3.00 0.11 -4.77 116.66 114.11 1ics n ARG 30 Ca -0.06 -2.22 -0.42 0.00 -0.01 0.00 0.00 57.85 55.14 1ics n ARG 30 Cb 0.59 -1.36 -0.04 0.00 0.00 0.00 0.00 32.46 31.65 1ics n ARG 30 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 1ics s VAL 31 N -1.04 4.65 -0.09 1.55 1.01 -1.25 -1.64 120.40 123.59 1ics s VAL 31 Ca 0.30 1.03 -0.03 0.00 0.00 0.00 0.00 61.98 63.28 1ics s VAL 31 Cb 0.16 -4.28 -0.03 0.00 0.00 0.00 0.00 36.38 32.23 1ics s VAL 31 CO 0.20 -0.50 0.03 -0.69 0.00 0.00 0.00 175.10 174.14 1ics s VAL 32 N 3.30 4.55 -0.36 2.92 1.01 -0.14 -4.36 120.40 127.31 1ics s VAL 32 Ca 0.35 -0.17 -0.28 0.00 0.00 0.00 0.00 61.98 61.87 1ics s VAL 32 Cb -0.12 -2.93 0.02 0.00 0.00 0.00 0.00 36.38 33.34 1ics s VAL 32 CO 0.18 0.60 1.04 -0.22 0.00 0.00 0.00 175.10 176.69 1ics s LEU 33 N -0.95 3.90 0.67 3.92 2.96 -0.90 -0.15 118.68 128.13 1ics s LEU 33 Ca 0.14 0.79 -0.15 0.00 -0.22 0.00 0.00 54.13 54.69 1ics s LEU 33 Cb -0.11 -3.45 0.01 0.00 0.50 0.00 0.00 46.19 43.13 1ics s LEU 33 CO 0.03 -0.94 1.11 0.00 -1.32 0.00 0.00 176.35 175.23 1ics s ALA 34 N 3.74 2.45 0.03 5.97 0.00 -0.34 -1.91 121.76 131.71 1ics s ALA 34 Ca 0.43 0.52 -0.30 0.00 0.00 0.00 0.00 51.96 52.61 1ics s ALA 34 Cb -0.11 -3.31 -0.08 0.00 0.00 0.00 0.00 23.12 19.61 1ics s ALA 34 CO 0.19 -1.33 1.81 -2.14 0.00 0.00 0.00 175.76 174.30 1ics s PRO 35 N -4.17 4.16 -0.18 0.00 0.02 -1.23 -4.74 135.00 128.86 1ics s PRO 35 Ca 0.66 2.46 -0.01 0.00 0.02 0.00 0.00 61.00 64.13 1ics s PRO 35 Cb -0.20 -3.93 0.05 0.00 0.02 0.00 0.00 34.50 30.44 1ics s PRO 35 CO 0.43 -0.87 -0.03 -0.51 -0.33 0.00 0.00 177.00 175.69 1ics s LEU 36 N 3.75 1.63 -0.18 -5.54 1.43 -1.26 -4.85 118.68 113.66 1ics s LEU 36 Ca 0.81 -0.74 -0.29 0.00 -1.03 0.00 0.00 54.13 52.87 1ics s LEU 36 Cb -0.40 -0.87 -0.01 0.00 0.03 0.00 0.00 46.19 44.93 1ics s LEU 36 CO 0.36 -0.22 1.30 -0.89 0.23 0.00 0.00 176.35 177.14 1ics s THR 37 N 1.66 4.21 -0.66 5.49 2.01 -1.26 -4.20 115.64 122.88 1ics s THR 37 Ca -0.00 1.45 0.06 0.00 0.31 0.00 0.00 61.69 63.50 1ics s THR 37 Cb -0.16 -3.98 0.03 0.00 0.01 0.00 0.00 72.50 68.40 1ics s THR 37 CO -0.07 -0.18 0.62 0.54 -0.69 0.00 0.00 174.62 174.84 1ics n ARG 38 N 6.76 0.53 -4.16 4.92 5.12 -1.26 -4.79 116.66 123.78 1ics n ARG 38 Ca 0.14 -0.74 -0.33 0.00 -1.93 0.00 0.00 57.85 55.00 1ics n ARG 38 Cb 0.45 -1.06 -0.03 0.00 -1.16 0.00 0.00 32.46 30.66 1ics n ARG 38 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 1ics n GLN 39 N 0.14 -3.04 -0.18 5.56 6.02 -1.26 -4.50 117.38 120.11 1ics n GLN 39 Ca 0.03 0.36 0.09 0.00 -0.01 0.00 0.00 57.00 57.47 1ics n GLN 39 Cb 0.14 -4.84 0.17 0.00 1.02 0.00 0.00 30.24 26.73 1ics n GLN 39 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1ics n ARG 40 N -4.40 1.64 -3.46 -1.09 1.74 -1.06 -4.56 116.66 105.46 1ics n ARG 40 Ca -0.06 -2.68 -0.41 0.00 -0.77 0.00 0.00 57.85 53.93 1ics n ARG 40 Cb 0.56 -1.58 -0.03 0.00 -1.02 0.00 0.00 32.46 30.39 1ics n ARG 40 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1ics n SER 41 N -1.23 4.96 -4.64 0.55 7.64 0.13 -4.75 113.62 116.28 1ics n SER 41 Ca 0.18 -3.10 -0.48 0.00 1.01 0.00 0.00 58.87 56.47 1ics n SER 41 Cb 0.70 -1.22 -0.05 0.00 -1.01 0.00 0.00 64.21 62.63 1ics n SER 41 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 1ics n TYR 42 N 2.43 2.00 -1.18 1.43 0.53 -1.25 -1.49 117.16 119.62 1ics n TYR 42 Ca 0.23 0.40 -0.06 0.00 -1.02 0.00 0.00 57.90 57.45 1ics n TYR 42 Cb 0.38 -2.47 -0.03 0.00 -1.03 0.00 0.00 39.34 36.20 1ics n TYR 42 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1ics n GLY 43 N 3.10 0.82 2.35 2.72 0.00 -1.26 -2.61 105.19 110.30 1ics n GLY 43 Ca 0.18 -0.36 -0.12 0.00 0.00 0.00 0.00 46.02 45.71 1ics n GLY 43 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1ics n TYR 44 N -2.64 -0.03 -4.78 1.61 4.01 -0.55 -4.99 117.16 109.79 1ics n TYR 44 Ca -0.06 0.00 -0.33 0.00 -0.16 0.00 0.00 57.90 57.35 1ics n TYR 44 Cb 0.29 -2.28 -0.15 0.00 -0.31 0.00 0.00 39.34 36.90 1ics n TYR 44 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1ics s ILE 45 N -2.46 2.97 0.77 -0.72 1.01 -1.07 -1.22 121.20 120.48 1ics s ILE 45 Ca 0.00 -0.69 -0.15 0.00 0.00 0.00 0.00 60.65 59.81 1ics s ILE 45 Cb 0.00 -2.25 0.01 0.00 0.01 0.00 0.00 42.46 40.24 1ics s ILE 45 CO 0.00 0.52 0.81 -2.65 0.00 0.00 0.00 174.94 173.62 1ics n PRO 46 N 3.57 0.27 -4.44 2.79 -0.02 -1.26 -3.91 135.00 132.01 1ics n PRO 46 Ca -0.18 0.15 -0.22 0.00 -2.02 0.00 0.00 63.50 61.23 1ics n PRO 46 Cb 0.53 -2.10 -0.10 0.00 -0.02 0.00 0.00 33.50 31.81 1ics n PRO 46 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1ics s GLN 47 N -3.35 1.58 0.27 -0.52 -1.52 -1.26 -4.88 119.66 109.98 1ics s GLN 47 Ca 0.69 -1.81 -0.02 0.00 -1.95 0.00 0.00 55.36 52.27 1ics s GLN 47 Cb -0.32 -1.17 0.44 0.00 -0.22 0.00 0.00 33.01 31.74 1ics s GLN 47 CO 0.55 0.03 1.86 -1.35 -0.25 0.00 0.00 175.29 176.13 1ics h PRO 48 N 2.25 1.07 -0.03 2.91 0.11 -1.94 -2.22 132.00 134.14 1ics h PRO 48 Ca -0.40 -0.06 0.01 0.00 0.11 0.00 0.00 66.00 65.65 1ics h PRO 48 Cb 1.24 -0.24 -0.00 0.00 0.11 0.00 0.00 31.00 32.10 1ics h PRO 48 CO 0.68 0.71 0.02 1.12 -0.21 0.00 0.00 178.00 180.32 1ics h HIS 49 N 1.10 0.00 0.00 0.65 2.07 -1.96 0.21 115.15 117.22 1ics h HIS 49 Ca 0.44 0.00 -0.05 0.00 -2.85 0.00 0.00 60.37 57.91 1ics h HIS 49 Cb 0.26 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.23 1ics h HIS 49 CO -0.01 0.00 -0.25 0.00 -3.07 0.00 0.00 177.93 174.60 1ics h ALA 50 N 1.98 1.46 -0.68 6.11 0.00 -1.75 -1.44 119.26 124.94 1ics h ALA 50 Ca 0.01 -0.23 0.05 0.00 0.00 0.00 0.00 54.91 54.75 1ics h ALA 50 Cb 0.06 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.76 1ics h ALA 50 CO -0.00 0.31 0.39 0.82 0.00 0.00 0.00 179.25 180.78 1ics h ILE 51 N 0.00 1.00 -0.11 0.00 2.04 -1.02 -0.96 117.51 118.46 1ics h ILE 51 Ca -0.00 -0.25 -0.22 0.00 1.00 0.00 0.00 64.86 65.38 1ics h ILE 51 Cb 0.48 0.20 0.01 0.00 -0.74 0.00 0.00 36.82 36.77 1ics h ILE 51 CO 0.03 0.13 -0.82 0.25 0.00 0.00 0.00 178.15 177.75 1ics h LEU 52 N 0.74 0.85 0.70 1.44 5.85 -1.46 -2.17 115.31 121.27 1ics h LEU 52 Ca 0.30 -0.58 -0.03 0.00 0.84 0.00 0.00 57.88 58.41 1ics h LEU 52 Cb 0.14 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 40.92 1ics h LEU 52 CO -0.16 1.37 -0.41 -0.74 -0.34 0.00 0.00 178.44 178.16 1ics h HIS 53 N 0.47 -1.07 0.00 1.25 2.76 -0.67 0.61 115.15 118.50 1ics h HIS 53 Ca -0.06 -0.01 -0.02 0.00 -2.20 0.00 0.00 60.37 58.07 1ics h HIS 53 Cb 1.44 0.38 -0.00 0.00 1.55 0.00 0.00 27.41 30.78 1ics h HIS 53 CO 0.08 -0.62 -0.10 1.88 -1.30 0.00 0.00 177.93 177.87 1ics h TYR 54 N -1.04 0.00 -0.05 5.26 0.05 -1.31 -2.64 116.97 117.25 1ics h TYR 54 Ca -0.09 0.00 -0.24 0.00 0.05 0.00 0.00 58.73 58.45 1ics h TYR 54 Cb 0.83 0.00 0.02 0.00 1.01 0.00 0.00 36.73 38.58 1ics h TYR 54 CO -0.08 0.10 -0.90 1.03 -1.05 0.00 0.00 178.16 177.26 1ics h SER 55 N 0.00 0.88 0.08 3.88 0.87 -1.01 -2.72 113.55 115.52 1ics h SER 55 Ca -0.00 -0.70 -0.01 0.00 -1.23 0.00 0.00 61.79 59.85 1ics h SER 55 Cb 0.50 -0.26 -0.00 0.00 -0.44 0.00 0.00 62.40 62.19 1ics h SER 55 CO 0.01 1.46 -0.03 1.56 -0.53 0.00 0.00 176.83 179.30 1ics h GLN 56 N 0.37 0.00 -0.50 2.24 4.20 -0.52 -2.65 115.11 118.26 1ics h GLN 56 Ca -0.10 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.61 1ics h GLN 56 Cb 1.55 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.33 1ics h GLN 56 CO 0.18 0.03 0.00 0.54 -0.67 0.00 0.00 178.83 178.91 1ics n ARG 57 N -3.77 2.56 -3.28 1.46 1.74 -1.14 -4.42 116.66 109.81 1ics n ARG 57 Ca -0.03 -2.34 -0.39 0.00 -0.77 0.00 0.00 57.85 54.33 1ics n ARG 57 Cb 0.11 -1.47 -0.06 0.00 -1.02 0.00 0.00 32.46 30.02 1ics n ARG 57 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 1ics s SER 58 N -1.17 7.04 0.08 0.55 0.01 -1.00 -5.00 113.70 114.21 1ics s SER 58 Ca 0.39 1.23 0.01 0.00 1.31 0.00 0.00 55.95 58.88 1ics s SER 58 Cb 0.21 -2.35 -0.04 0.00 0.21 0.00 0.00 66.02 64.05 1ics s SER 58 CO 0.28 0.25 -0.05 0.42 0.41 0.00 0.00 173.24 174.55 1ics s THR 59 N -0.97 0.50 0.11 1.44 -4.23 -1.26 -4.94 115.64 106.29 1ics s THR 59 Ca 0.29 -1.87 -0.31 0.00 -1.18 0.00 0.00 61.69 58.62 1ics s THR 59 Cb -0.19 -1.60 -0.09 0.00 1.34 0.00 0.00 72.50 71.96 1ics s THR 59 CO 0.18 -0.92 1.67 0.21 -0.54 0.00 0.00 174.62 175.22 1ics s ASN 60 N -2.97 6.56 -1.68 3.99 2.47 -1.03 -1.89 114.94 120.39 1ics s ASN 60 Ca 0.09 2.58 0.00 0.00 0.42 0.00 0.00 52.86 55.96 1ics s ASN 60 Cb 0.06 -2.57 0.00 0.00 -1.45 0.00 0.00 41.25 37.29 1ics s ASN 60 CO -0.07 -0.90 0.00 0.61 -3.72 0.00 0.00 177.10 173.03 1ics n GLY 61 N 3.97 1.59 3.85 1.21 0.00 0.55 -4.37 105.19 111.99 1ics n GLY 61 Ca 0.16 -0.22 -0.37 0.00 0.00 0.00 0.00 46.02 45.59 1ics n GLY 61 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ics s GLY 62 N -2.79 2.23 -0.01 -0.02 0.00 -0.79 -0.06 107.32 105.87 1ics s GLY 62 Ca 0.00 -0.53 -0.19 0.00 0.00 0.00 0.00 44.72 44.00 1ics s GLY 62 CO 0.00 -0.16 0.53 -2.27 0.00 0.00 0.00 173.10 171.20 1ics s LEU 63 N -0.82 4.42 -0.08 0.66 2.96 -1.26 -1.47 118.68 123.09 1ics s LEU 63 Ca 0.17 1.06 0.03 0.00 -0.22 0.00 0.00 54.13 55.17 1ics s LEU 63 Cb -0.13 -2.80 0.01 0.00 0.50 0.00 0.00 46.19 43.77 1ics s LEU 63 CO 0.06 0.16 -0.17 -0.76 -1.32 0.00 0.00 176.35 174.32 1ics s LEU 64 N -0.38 1.81 -0.25 -0.68 1.02 0.75 -2.11 118.68 118.84 1ics s LEU 64 Ca 0.28 -0.40 -0.04 0.00 0.02 0.00 0.00 54.13 53.99 1ics s LEU 64 Cb -0.17 -1.04 0.01 0.00 0.02 0.00 0.00 46.19 45.00 1ics s LEU 64 CO 0.15 0.08 -0.00 -0.63 0.02 0.00 0.00 176.35 175.97 1ics s ILE 65 N 0.55 3.46 0.93 -0.59 1.01 -0.80 -0.78 121.20 124.98 1ics s ILE 65 Ca -0.16 -0.69 -0.12 0.00 0.00 0.00 0.00 60.65 59.68 1ics s ILE 65 Cb -0.17 -2.69 0.15 0.00 0.01 0.00 0.00 42.46 39.76 1ics s ILE 65 CO 0.06 0.25 1.09 -0.83 0.00 0.00 0.00 174.94 175.51 1ics s GLY 66 N 1.45 1.60 0.74 6.18 0.00 -0.38 -3.58 107.32 113.33 1ics s GLY 66 Ca 0.03 -0.15 -0.16 0.00 0.00 0.00 0.00 44.72 44.45 1ics s GLY 66 CO -0.02 0.37 1.04 -1.84 0.00 0.00 0.00 173.10 172.66 1ics n GLU 67 N -3.97 0.49 -1.68 2.90 0.28 -1.26 -4.07 120.64 113.32 1ics n GLU 67 Ca 0.06 0.23 -0.52 0.00 -0.16 0.00 0.00 57.16 56.77 1ics n GLU 67 Cb 0.56 -2.29 -0.06 0.00 1.43 0.00 0.00 31.44 31.08 1ics n GLU 67 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1ics n ALA 68 N -2.63 0.26 -3.20 -1.84 0.00 -1.26 -4.28 120.51 107.57 1ics n ALA 68 Ca 0.13 0.37 -0.34 0.00 0.00 0.00 0.00 53.44 53.60 1ics n ALA 68 Cb 0.50 -2.32 -0.13 0.00 0.00 0.00 0.00 19.45 17.50 1ics n ALA 68 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1ics s THR 69 N 3.05 3.63 0.24 0.00 2.01 0.30 -4.45 115.64 120.42 1ics s THR 69 Ca 0.92 -0.43 -0.30 0.00 0.31 0.00 0.00 61.69 62.19 1ics s THR 69 Cb -0.88 -2.62 -0.10 0.00 0.01 0.00 0.00 72.50 68.91 1ics s THR 69 CO 0.55 0.45 1.46 -0.69 -0.69 0.00 0.00 174.62 175.70 1ics s VAL 70 N 0.95 2.65 -0.17 3.82 1.01 0.58 -0.16 120.40 129.08 1ics s VAL 70 Ca 0.00 0.53 0.18 0.00 0.00 0.00 0.00 61.98 62.69 1ics s VAL 70 Cb -0.15 -3.34 -0.06 0.00 0.00 0.00 0.00 36.38 32.84 1ics s VAL 70 CO 0.01 0.08 0.99 0.16 0.00 0.00 0.00 175.10 176.34 1ics h ILE 71 N 3.62 0.40 -3.40 2.22 3.07 -1.43 -0.85 117.51 121.13 1ics h ILE 71 Ca -0.45 -1.74 -0.02 0.00 1.55 0.00 0.00 64.86 64.20 1ics h ILE 71 Cb 1.22 1.95 -0.07 0.00 -0.27 0.00 0.00 36.82 39.65 1ics h ILE 71 CO 0.80 0.23 0.03 -0.94 -1.05 0.00 0.00 178.15 177.22 1ics s SER 72 N -5.78 -0.08 0.46 2.16 1.04 -1.26 -4.43 113.70 105.80 1ics s SER 72 Ca -0.01 -0.87 0.11 0.00 0.48 0.00 0.00 55.95 55.66 1ics s SER 72 Cb 0.09 0.66 1.05 0.00 0.10 0.00 0.00 66.02 67.92 1ics s SER 72 CO 0.79 -1.27 2.10 -0.33 0.98 0.00 0.00 173.24 175.51 1ics h GLU 73 N 2.14 0.29 0.00 4.02 5.08 -1.98 -1.00 114.58 123.13 1ics h GLU 73 Ca -0.24 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.10 1ics h GLU 73 Cb 1.25 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.43 1ics h GLU 73 CO 0.32 0.19 0.00 0.25 -1.00 0.00 0.00 179.01 178.77 1ics n THR 74 N -4.50 0.11 -0.24 1.13 -2.24 -1.26 -3.51 114.28 103.77 1ics n THR 74 Ca 0.00 0.03 0.07 0.00 -2.27 0.00 0.00 64.05 61.88 1ics n THR 74 Cb 0.08 -0.57 0.29 0.00 -2.10 0.00 0.00 70.33 68.03 1ics n THR 74 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ics n GLY 75 N 1.15 2.30 3.71 3.38 0.00 -0.38 -4.66 105.19 110.69 1ics n GLY 75 Ca 0.11 -0.69 -0.38 0.00 0.00 0.00 0.00 46.02 45.07 1ics n GLY 75 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ics s ILE 76 N -1.94 5.21 0.00 -0.61 1.01 -1.23 -3.29 121.20 120.34 1ics s ILE 76 Ca 0.41 0.84 0.00 0.00 0.00 0.00 0.00 60.65 61.90 1ics s ILE 76 Cb 0.28 -3.77 0.00 0.00 0.01 0.00 0.00 42.46 38.98 1ics s ILE 76 CO 0.18 0.32 0.17 0.61 0.00 0.00 0.00 174.94 176.21 1ics n GLY 77 N 3.42 -0.02 3.19 6.18 0.00 -1.26 -4.62 105.19 112.08 1ics n GLY 77 Ca -0.08 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.83 1ics n GLY 77 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ics s TYR 78 N -0.02 0.01 0.46 1.61 2.02 -1.26 -4.79 117.35 115.38 1ics s TYR 78 Ca 0.00 -0.19 -0.20 0.00 -0.37 0.00 0.00 57.07 56.31 1ics s TYR 78 Cb 0.00 -0.00 -0.10 0.00 -0.40 0.00 0.00 41.96 41.46 1ics s TYR 78 CO 0.00 -0.43 0.99 0.15 -1.57 0.00 0.00 175.55 174.69 1ics s LYS 79 N -2.39 4.02 -1.30 -0.62 1.02 -1.26 -4.20 119.74 115.01 1ics s LYS 79 Ca -0.06 1.19 -0.02 0.00 0.02 0.00 0.00 55.97 57.09 1ics s LYS 79 Cb -0.02 -2.14 0.01 0.00 -0.52 0.00 0.00 37.83 35.17 1ics s LYS 79 CO -0.03 -0.22 0.17 -0.25 -0.92 0.00 0.00 175.35 174.10 1ics n ASP 80 N -0.90 -4.56 -4.88 2.83 8.00 -1.26 -4.70 116.55 111.09 1ics n ASP 80 Ca 0.08 -0.01 -0.35 0.00 0.71 0.00 0.00 54.79 55.22 1ics n ASP 80 Cb 0.53 -3.80 -0.05 0.00 -0.02 0.00 0.00 41.12 37.78 1ics n ASP 80 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1ics s VAL 81 N -2.83 5.28 0.53 2.53 -7.23 -1.25 0.19 120.40 117.62 1ics s VAL 81 Ca 0.11 0.22 -0.17 0.00 -1.81 0.00 0.00 61.98 60.33 1ics s VAL 81 Cb -0.06 -3.57 -0.07 0.00 0.56 0.00 0.00 36.38 33.24 1ics s VAL 81 CO 0.14 0.37 1.02 -2.16 -0.31 0.00 0.00 175.10 174.16 1ics s PRO 82 N -1.72 3.72 0.44 4.82 0.04 -1.26 -4.07 135.00 136.97 1ics s PRO 82 Ca 0.27 1.14 0.06 0.00 0.04 0.00 0.00 61.00 62.51 1ics s PRO 82 Cb -0.13 -2.09 -0.05 0.00 0.04 0.00 0.00 34.50 32.26 1ics s PRO 82 CO 0.16 -0.47 0.08 0.20 0.04 0.00 0.00 177.00 177.01 1ics s GLY 83 N -2.66 2.58 -0.30 0.56 0.00 -0.35 -0.31 107.32 106.84 1ics s GLY 83 Ca 0.63 -1.72 0.18 0.00 0.00 0.00 0.00 44.72 43.81 1ics s GLY 83 CO 0.29 -2.06 1.29 4.51 0.00 0.00 0.00 173.10 177.13 1ics n ILE 84 N -1.17 0.72 0.43 0.90 3.06 -0.32 -4.77 119.36 118.20 1ics n ILE 84 Ca -0.07 -2.11 0.05 0.00 -2.50 0.00 0.00 62.75 58.12 1ics n ILE 84 Cb 0.66 1.16 0.02 0.00 0.54 0.00 0.00 39.64 42.02 1ics n ILE 84 CO 0.00 0.00 0.00 -2.67 -2.50 0.00 0.00 176.55 171.38 1ics n TRP 85 N -0.97 0.00 -4.32 9.51 2.14 -1.26 -4.71 117.44 117.83 1ics n TRP 85 Ca -0.03 0.00 -0.24 0.00 2.07 0.00 0.00 57.50 59.29 1ics n TRP 85 Cb 0.83 0.00 -0.12 0.00 -0.81 0.00 0.00 31.31 31.21 1ics n TRP 85 CO 0.00 0.00 0.00 0.95 2.07 0.00 0.00 177.69 180.71 1ics s THR 86 N -1.12 1.83 0.34 -1.67 -4.23 -1.26 -5.03 115.64 104.50 1ics s THR 86 Ca 0.10 -1.67 0.05 0.00 -1.18 0.00 0.00 61.69 58.99 1ics s THR 86 Cb 0.08 -1.70 0.30 0.00 1.34 0.00 0.00 72.50 72.52 1ics s THR 86 CO 0.19 -0.10 1.92 0.11 -0.54 0.00 0.00 174.62 176.20 1ics h LYS 87 N 3.83 0.80 -0.96 3.99 1.57 -1.99 0.46 116.57 124.28 1ics h LYS 87 Ca -0.46 -0.05 0.01 0.00 -1.87 0.00 0.00 60.65 58.28 1ics h LYS 87 Cb 1.19 -0.18 -0.05 0.00 0.08 0.00 0.00 32.23 33.27 1ics h LYS 87 CO 0.42 0.53 0.63 1.49 -0.57 0.00 0.00 179.45 181.95 1ics h GLU 88 N 0.82 1.26 -0.13 3.15 4.81 -1.99 -0.56 114.58 121.94 1ics h GLU 88 Ca 0.38 -0.08 -0.18 0.00 -0.13 0.00 0.00 59.36 59.35 1ics h GLU 88 Cb 0.38 -0.28 0.01 0.00 0.63 0.00 0.00 28.75 29.49 1ics h GLU 88 CO -0.15 0.84 -0.62 1.96 -0.73 0.00 0.00 179.01 180.32 1ics h GLN 89 N 1.30 0.65 -0.71 1.92 4.20 -1.32 -2.55 115.11 118.60 1ics h GLN 89 Ca 0.35 -0.52 0.01 0.00 0.06 0.00 0.00 58.65 58.54 1ics h GLN 89 Cb -0.14 0.11 -0.04 0.00 0.30 0.00 0.00 27.48 27.71 1ics h GLN 89 CO -0.07 1.14 0.47 0.28 -0.67 0.00 0.00 178.83 179.97 1ics h VAL 90 N 0.31 1.18 -0.00 -0.54 2.07 -0.61 -1.60 116.25 117.06 1ics h VAL 90 Ca -0.04 -0.33 -0.15 0.00 0.82 0.00 0.00 66.70 67.01 1ics h VAL 90 Cb 1.25 0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 31.14 1ics h VAL 90 CO 0.13 0.17 -0.70 -0.33 0.02 0.00 0.00 177.57 176.86 1ics h GLU 91 N 0.95 0.01 0.00 1.57 4.39 -1.10 -3.10 114.58 117.31 1ics h GLU 91 Ca 0.26 -0.01 -0.11 0.00 0.34 0.00 0.00 59.36 59.84 1ics h GLU 91 Cb -0.11 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.53 1ics h GLU 91 CO -0.06 0.71 -0.50 0.00 -1.16 0.00 0.00 179.01 178.00 1ics h ALA 92 N 1.29 1.10 -0.11 3.43 0.00 -0.87 -3.16 119.26 120.95 1ics h ALA 92 Ca -0.01 -0.46 -0.20 0.00 0.00 0.00 0.00 54.91 54.25 1ics h ALA 92 Cb 1.24 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1ics h ALA 92 CO 0.09 0.63 -0.74 -1.49 0.00 0.00 0.00 179.25 177.74 1ics h TRP 93 N 0.00 0.74 -0.73 0.00 4.06 -1.34 -3.37 115.95 115.31 1ics h TRP 93 Ca -0.01 -0.32 0.12 0.00 2.06 0.00 0.00 58.89 60.74 1ics h TRP 93 Cb 0.92 -0.12 -0.13 0.00 -1.00 0.00 0.00 29.16 28.84 1ics h TRP 93 CO 0.00 1.10 -0.35 0.87 -3.56 0.00 0.00 178.44 176.50 1ics h LYS 94 N 0.38 -0.10 0.00 0.49 1.57 -1.50 0.17 116.57 117.58 1ics h LYS 94 Ca -0.04 0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.73 1ics h LYS 94 Cb 1.33 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 33.66 1ics h LYS 94 CO 0.14 -0.07 -0.11 -1.35 -0.57 0.00 0.00 179.45 177.49 1ics h PRO 95 N -0.11 0.00 -0.03 3.15 0.11 -1.75 0.12 132.00 133.51 1ics h PRO 95 Ca 0.27 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.34 1ics h PRO 95 Cb 0.57 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.68 1ics h PRO 95 CO -0.79 0.11 -0.15 0.82 -0.21 0.00 0.00 178.00 177.78 1ics h ILE 96 N 0.00 1.50 -0.37 4.15 2.04 -0.98 -2.35 117.51 121.50 1ics h ILE 96 Ca -0.00 -1.69 0.03 0.00 1.00 0.00 0.00 64.86 64.20 1ics h ILE 96 Cb 0.24 2.53 -0.03 0.00 -0.74 0.00 0.00 36.82 38.82 1ics h ILE 96 CO 0.01 0.46 0.16 0.58 0.00 0.00 0.00 178.15 179.37 1ics h VAL 97 N -0.46 0.95 -0.42 1.67 2.07 -0.36 -2.15 116.25 117.56 1ics h VAL 97 Ca -0.01 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 67.39 1ics h VAL 97 Cb 0.83 0.58 -0.02 0.00 -1.52 0.00 0.00 31.29 31.16 1ics h VAL 97 CO 0.03 0.06 0.27 0.44 0.02 0.00 0.00 177.57 178.39 1ics h ASP 98 N 0.34 0.48 0.03 0.57 3.32 -0.79 -1.07 116.42 119.30 1ics h ASP 98 Ca 0.16 -0.02 -0.13 0.00 0.02 0.00 0.00 57.03 57.06 1ics h ASP 98 Cb 0.09 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 1ics h ASP 98 CO -0.13 0.36 -0.42 0.00 -1.72 0.00 0.00 179.24 177.32 1ics h ALA 99 N 1.73 0.88 -0.18 3.45 0.00 -0.83 0.99 119.26 125.30 1ics h ALA 99 Ca 0.15 -0.44 -0.06 0.00 0.00 0.00 0.00 54.91 54.56 1ics h ALA 99 Cb -0.05 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.63 1ics h ALA 99 CO -0.03 0.64 -0.13 0.28 0.00 0.00 0.00 179.25 180.01 1ics h VAL 100 N 0.40 1.33 -0.24 0.00 2.07 -0.91 -3.00 116.25 115.90 1ics h VAL 100 Ca 0.03 -1.24 -0.02 0.00 0.82 0.00 0.00 66.70 66.29 1ics h VAL 100 Cb 0.91 1.75 -0.01 0.00 -1.52 0.00 0.00 31.29 32.42 1ics h VAL 100 CO 0.08 0.37 0.05 0.45 0.02 0.00 0.00 177.57 178.54 1ics h HIS 101 N 0.07 0.35 -0.02 1.57 -0.00 -1.06 -2.06 115.15 113.99 1ics h HIS 101 Ca 0.03 -0.01 0.01 0.00 -0.00 0.00 0.00 60.37 60.40 1ics h HIS 101 Cb 0.64 -0.11 -0.00 0.00 -0.00 0.00 0.00 27.41 27.94 1ics h HIS 101 CO 0.07 0.32 0.03 0.00 -0.00 0.00 0.00 177.93 178.35 1ics h ALA 102 N 1.71 1.47 -0.23 2.45 0.00 -0.65 0.16 119.26 124.18 1ics h ALA 102 Ca 0.08 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1ics h ALA 102 Cb 0.16 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1ics h ALA 102 CO -0.00 -0.03 0.00 1.63 0.00 0.00 0.00 179.25 180.84 1ics n LYS 103 N -3.72 2.08 -0.62 0.00 5.02 -0.83 -4.97 118.16 115.13 1ics n LYS 103 Ca -0.03 -1.94 0.00 0.00 -2.02 0.00 0.00 58.31 54.32 1ics n LYS 103 Cb 0.11 -1.41 0.00 0.00 -0.02 0.00 0.00 35.03 33.71 1ics n LYS 103 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1ics n GLY 104 N 1.16 0.65 3.89 0.72 0.00 0.56 -2.47 105.19 109.70 1ics n GLY 104 Ca 0.14 -0.38 -0.29 0.00 0.00 0.00 0.00 46.02 45.49 1ics n GLY 104 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ics s GLY 105 N -2.35 1.62 -0.17 -0.02 0.00 -0.88 -0.33 107.32 105.19 1ics s GLY 105 Ca 0.00 -0.35 -0.03 0.00 0.00 0.00 0.00 44.72 44.34 1ics s GLY 105 CO 0.00 -0.04 -0.05 -0.42 0.00 0.00 0.00 173.10 172.58 1ics s ILE 106 N -3.19 3.61 -0.18 0.90 -1.09 -0.54 -4.39 121.20 116.32 1ics s ILE 106 Ca 0.55 -0.45 -0.00 0.00 -2.23 0.00 0.00 60.65 58.53 1ics s ILE 106 Cb -0.11 -2.59 0.01 0.00 -1.58 0.00 0.00 42.46 38.19 1ics s ILE 106 CO 0.51 0.48 -0.15 0.12 -1.23 0.00 0.00 174.94 174.66 1ics s PHE 107 N 0.67 2.81 -0.10 3.97 5.99 -1.26 -0.18 117.98 129.89 1ics s PHE 107 Ca -0.03 -1.29 -0.01 0.00 0.00 0.00 0.00 56.93 55.60 1ics s PHE 107 Cb -0.15 -1.94 -0.03 0.00 0.00 0.00 0.00 43.02 40.90 1ics s PHE 107 CO 0.02 -0.64 -0.07 -0.06 -0.00 0.00 0.00 175.22 174.48 1ics s PHE 108 N 1.15 2.95 -0.20 10.12 2.99 0.04 -0.41 117.98 134.63 1ics s PHE 108 Ca 0.01 -0.12 -0.18 0.00 0.00 0.00 0.00 56.93 56.64 1ics s PHE 108 Cb -0.14 -1.79 -0.03 0.00 0.00 0.00 0.00 43.02 41.05 1ics s PHE 108 CO -0.06 0.18 0.51 0.00 -0.00 0.00 0.00 175.22 175.85 1ics s GLN 110 N 1.59 3.81 -0.01 0.00 0.74 -1.26 -0.79 119.66 123.76 1ics s GLN 110 Ca 0.24 0.40 -0.18 0.00 0.05 0.00 0.00 55.36 55.87 1ics s GLN 110 Cb -0.15 -3.79 -0.06 0.00 1.10 0.00 0.00 33.01 30.11 1ics s GLN 110 CO 0.09 -0.81 0.50 0.96 -0.55 0.00 0.00 175.29 175.48 1ics s ILE 111 N 3.08 4.96 0.02 -2.34 -4.36 -0.14 0.11 121.20 122.53 1ics s ILE 111 Ca 0.32 1.03 -0.05 0.00 -0.26 0.00 0.00 60.65 61.68 1ics s ILE 111 Cb -0.13 -3.82 -0.01 0.00 1.25 0.00 0.00 42.46 39.75 1ics s ILE 111 CO 0.16 0.49 0.09 0.86 0.24 0.00 0.00 174.94 176.78 1ics s TRP 112 N -0.58 0.13 -0.09 1.37 -0.00 0.77 -1.38 118.94 119.16 1ics s TRP 112 Ca 0.27 -0.31 -0.04 0.00 -0.00 0.00 0.00 56.10 56.02 1ics s TRP 112 Cb -0.17 -0.10 0.05 0.00 -0.00 0.00 0.00 33.47 33.24 1ics s TRP 112 CO 0.15 -0.29 0.18 -1.58 -0.00 0.00 0.00 176.95 175.41 1ics s HIS 113 N -1.73 -0.23 -0.63 5.86 5.65 -1.26 -1.08 115.29 121.86 1ics s HIS 113 Ca -0.12 0.66 0.25 0.00 0.25 0.00 0.00 55.06 56.10 1ics s HIS 113 Cb -0.06 -0.14 0.86 0.00 -1.18 0.00 0.00 32.58 32.05 1ics s HIS 113 CO -0.01 -0.25 1.76 -0.39 -0.65 0.00 0.00 174.74 175.20 1ics h VAL 114 N 6.21 0.00 0.00 0.89 -1.51 -1.85 -2.17 116.25 117.82 1ics h VAL 114 Ca -0.25 -0.42 0.00 0.00 -1.23 0.00 0.00 66.70 64.80 1ics h VAL 114 Cb 1.13 1.35 0.00 0.00 -2.13 0.00 0.00 31.29 31.63 1ics h VAL 114 CO 0.25 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 177.20 1ics n GLY 115 N 0.90 3.52 0.13 5.19 0.00 -1.26 -1.12 105.19 112.54 1ics n GLY 115 Ca 0.04 -0.04 0.11 0.00 0.00 0.00 0.00 46.02 46.13 1ics n GLY 115 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1ics n ARG 116 N 14.00 0.18 -1.95 1.61 1.85 -1.00 -4.13 116.66 127.21 1ics n ARG 116 Ca 0.00 0.45 -0.41 0.00 -1.00 0.00 0.00 57.85 56.89 1ics n ARG 116 Cb 0.00 -1.87 -0.01 0.00 -1.05 0.00 0.00 32.46 29.53 1ics n ARG 116 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 177.63 177.90 1ics n VAL 117 N -2.21 3.27 -3.48 8.89 0.31 -0.28 -4.76 118.33 120.09 1ics n VAL 117 Ca 0.02 -3.09 -0.03 0.00 -0.01 0.00 0.00 64.34 61.22 1ics n VAL 117 Cb 0.19 -2.45 0.01 0.00 -0.91 0.00 0.00 33.84 30.68 1ics n VAL 117 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1ics n SER 118 N 7.67 -0.93 -3.95 4.52 2.88 -1.26 -4.39 113.62 118.15 1ics n SER 118 Ca 0.50 -1.59 -0.09 0.00 -1.33 0.00 0.00 58.87 56.36 1ics n SER 118 Cb 0.42 1.54 -0.10 0.00 -0.75 0.00 0.00 64.21 65.32 1ics n SER 118 CO 0.00 0.00 0.00 0.21 -1.23 0.00 0.00 175.04 174.02 1ics s ASN 119 N -2.01 0.20 0.59 -3.46 3.84 -1.26 -2.42 114.94 110.42 1ics s ASN 119 Ca 0.09 -0.49 0.30 0.00 0.21 0.00 0.00 52.86 52.96 1ics s ASN 119 Cb -0.02 0.17 1.81 0.00 -0.55 0.00 0.00 41.25 42.66 1ics s ASN 119 CO 0.04 -0.40 2.24 0.07 -2.79 0.00 0.00 177.10 176.27 1ics h LYS 120 N 4.16 0.00 0.00 0.43 2.10 -1.89 -1.09 116.57 120.28 1ics h LYS 120 Ca -0.32 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.33 1ics h LYS 120 Cb 1.19 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.52 1ics h LYS 120 CO 0.46 0.01 0.00 -0.25 -2.00 0.00 0.00 179.45 177.67 1ics n ASP 121 N -3.80 0.52 -0.01 7.07 8.00 -1.26 -1.71 116.55 125.37 1ics n ASP 121 Ca -0.03 0.67 0.11 0.00 0.71 0.00 0.00 54.79 56.25 1ics n ASP 121 Cb 0.10 -0.77 -0.17 0.00 -0.02 0.00 0.00 41.12 40.26 1ics n ASP 121 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1ics n PHE 122 N -2.12 0.00 -2.90 1.24 3.72 -0.42 -4.99 117.46 111.99 1ics n PHE 122 Ca 0.01 0.00 -0.34 0.00 -0.05 0.00 0.00 57.45 57.07 1ics n PHE 122 Cb 0.15 -0.46 -0.07 0.00 -0.94 0.00 0.00 39.48 38.16 1ics n PHE 122 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 1ics s GLN 123 N -3.48 4.28 0.12 -1.08 -1.52 -0.69 -4.80 119.66 112.49 1ics s GLN 123 Ca -0.07 1.06 -0.31 0.00 -1.95 0.00 0.00 55.36 54.09 1ics s GLN 123 Cb 0.14 -2.46 -0.09 0.00 -0.22 0.00 0.00 33.01 30.37 1ics s GLN 123 CO 0.90 0.13 1.59 -2.14 -0.25 0.00 0.00 175.29 175.53 1ics s PRO 124 N -2.72 4.21 -1.60 2.91 0.02 -1.26 -2.30 135.00 134.26 1ics s PRO 124 Ca 0.55 2.33 0.00 0.00 0.02 0.00 0.00 61.00 63.91 1ics s PRO 124 Cb -0.13 -3.34 0.00 0.00 0.02 0.00 0.00 34.50 31.05 1ics s PRO 124 CO 0.17 -0.65 0.00 0.09 -0.33 0.00 0.00 177.00 176.28 1ics n ASN 125 N 4.64 -4.82 -0.95 2.53 3.02 -1.26 -2.32 115.26 116.10 1ics n ASN 125 Ca 0.15 0.35 -0.12 0.00 -0.03 0.00 0.00 54.58 54.93 1ics n ASN 125 Cb 0.39 -3.68 -0.05 0.00 -0.61 0.00 0.00 39.78 35.83 1ics n ASN 125 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ics n GLY 126 N -1.10 1.31 3.71 7.41 0.00 -0.98 -4.98 105.19 110.57 1ics n GLY 126 Ca -0.15 -0.45 -0.31 0.00 0.00 0.00 0.00 46.02 45.10 1ics n GLY 126 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ics s GLU 127 N -3.07 1.51 0.43 1.61 2.02 -0.98 -4.84 118.70 115.39 1ics s GLU 127 Ca 0.00 1.30 -0.21 0.00 0.02 0.00 0.00 54.97 56.08 1ics s GLU 127 Cb 0.00 -1.80 -0.11 0.00 0.10 0.00 0.00 34.13 32.32 1ics s GLU 127 CO 0.00 -2.21 0.96 -0.51 0.02 0.00 0.00 175.26 173.52 1ics s ASP 128 N -3.04 6.89 0.87 -0.19 1.01 -1.26 -4.40 116.67 116.54 1ics s ASP 128 Ca 0.64 1.71 -0.11 0.00 0.71 0.00 0.00 52.55 55.51 1ics s ASP 128 Cb -0.20 -2.54 0.11 0.00 1.01 0.00 0.00 42.92 41.30 1ics s ASP 128 CO 0.57 -0.40 1.11 -2.84 0.21 0.00 0.00 175.17 173.82 1ics s PRO 129 N -3.18 1.47 0.07 8.23 0.02 -1.26 -4.69 135.00 135.65 1ics s PRO 129 Ca 0.62 1.21 0.04 0.00 0.02 0.00 0.00 61.00 62.90 1ics s PRO 129 Cb -0.10 -1.80 -0.04 0.00 0.02 0.00 0.00 34.50 32.58 1ics s PRO 129 CO 0.14 -2.21 -0.01 0.96 -0.33 0.00 0.00 177.00 175.55 1ics s ILE 130 N -2.80 3.98 0.31 2.83 -4.36 -1.26 -0.03 121.20 119.87 1ics s ILE 130 Ca 0.64 -0.91 -0.15 0.00 -0.26 0.00 0.00 60.65 59.97 1ics s ILE 130 Cb -0.20 -2.86 0.06 0.00 1.25 0.00 0.00 42.46 40.71 1ics s ILE 130 CO 0.57 0.19 0.76 -0.24 0.24 0.00 0.00 174.94 176.46 1ics n SER 131 N 0.80 -1.95 0.06 4.36 2.88 -0.85 -2.37 113.62 116.56 1ics n SER 131 Ca -0.12 -2.28 0.13 0.00 -1.33 0.00 0.00 58.87 55.26 1ics n SER 131 Cb 0.52 3.23 0.34 0.00 -0.75 0.00 0.00 64.21 67.55 1ics n SER 131 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1ics s THR 133 N -3.10 0.99 -1.07 0.00 -1.32 -1.26 -4.58 115.64 105.30 1ics s THR 133 Ca 0.10 -2.00 0.11 0.00 -1.21 0.00 0.00 61.69 58.69 1ics s THR 133 Cb 0.14 -2.64 0.26 0.00 -1.51 0.00 0.00 72.50 68.76 1ics s THR 133 CO 0.64 0.00 1.17 -0.90 -2.21 0.00 0.00 174.62 173.32 1ics n ASP 134 N -0.87 2.72 -4.74 8.08 5.68 -1.26 -3.45 116.55 122.71 1ics n ASP 134 Ca -0.04 -1.88 -0.39 0.00 -0.50 0.00 0.00 54.79 51.99 1ics n ASP 134 Cb 0.66 -0.18 -0.05 0.00 -1.14 0.00 0.00 41.12 40.41 1ics n ASP 134 CO 0.00 0.00 0.00 -0.13 -1.33 0.00 0.00 177.20 175.74 1ics s ARG 135 N -0.99 4.37 0.59 0.11 0.52 -1.26 -4.17 118.95 118.11 1ics s ARG 135 Ca 0.21 0.72 0.05 0.00 -0.52 0.00 0.00 55.73 56.20 1ics s ARG 135 Cb 0.12 -3.40 0.08 0.00 0.52 0.00 0.00 34.95 32.26 1ics s ARG 135 CO 0.16 0.21 0.81 0.20 0.02 0.00 0.00 175.30 176.69 1ics s GLY 136 N 0.37 1.79 0.33 -3.53 0.00 -1.26 -4.46 107.32 100.56 1ics s GLY 136 Ca 0.32 -1.85 -0.05 0.00 0.00 0.00 0.00 44.72 43.14 1ics s GLY 136 CO 0.16 -1.43 0.61 1.08 0.00 0.00 0.00 173.10 173.52 1ics s LEU 137 N -4.76 3.97 0.55 0.66 1.43 -1.26 -5.02 118.68 114.25 1ics s LEU 137 Ca 0.61 0.78 -0.07 0.00 -1.03 0.00 0.00 54.13 54.43 1ics s LEU 137 Cb -0.07 -3.63 -0.02 0.00 0.03 0.00 0.00 46.19 42.50 1ics s LEU 137 CO 0.39 -0.28 0.88 0.42 0.23 0.00 0.00 176.35 178.00 1ics s THR 138 N -2.22 4.48 0.62 5.49 -4.23 -1.26 -4.54 115.64 113.99 1ics s THR 138 Ca 0.45 0.30 -0.18 0.00 -1.18 0.00 0.00 61.69 61.08 1ics s THR 138 Cb -0.10 -3.74 -0.04 0.00 1.34 0.00 0.00 72.50 69.95 1ics s THR 138 CO 0.32 -0.80 1.03 -2.65 -0.54 0.00 0.00 174.62 171.98 1ics n PRO 139 N -2.48 0.92 -4.21 3.99 -0.02 -1.26 -4.84 135.00 127.10 1ics n PRO 139 Ca 0.03 0.36 -0.17 0.00 -2.02 0.00 0.00 63.50 61.70 1ics n PRO 139 Cb 0.56 -2.24 -0.11 0.00 -0.02 0.00 0.00 33.50 31.68 1ics n PRO 139 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1ics s GLN 140 N -2.91 0.94 -0.08 -0.52 -0.21 -0.83 -4.97 119.66 111.08 1ics s GLN 140 Ca 0.78 -1.18 -0.21 0.00 0.02 0.00 0.00 55.36 54.77 1ics s GLN 140 Cb -0.40 -0.76 -0.04 0.00 1.00 0.00 0.00 33.01 32.81 1ics s GLN 140 CO 0.45 0.14 0.59 0.42 -2.12 0.00 0.00 175.29 174.77 1ics s ILE 141 N -2.16 5.09 1.22 1.08 1.01 -1.26 0.58 121.20 126.75 1ics s ILE 141 Ca 0.06 1.20 -0.18 0.00 0.00 0.00 0.00 60.65 61.74 1ics s ILE 141 Cb -0.05 -3.93 0.29 0.00 0.01 0.00 0.00 42.46 38.79 1ics s ILE 141 CO 0.02 0.31 1.06 -0.04 0.00 0.00 0.00 174.94 176.28 1ics s MET 142 N 0.59 -1.33 0.32 2.79 -1.94 0.15 -4.87 119.30 115.02 1ics s MET 142 Ca 0.32 0.16 0.04 0.00 -1.71 0.00 0.00 55.69 54.49 1ics s MET 142 Cb -0.17 -1.56 0.66 0.00 2.01 0.00 0.00 34.83 35.77 1ics s MET 142 CO 0.15 -3.83 1.89 0.66 -0.01 0.00 0.00 175.02 173.87 1ics h SER 143 N -2.67 0.80 0.00 3.03 4.64 -1.97 -2.36 113.55 115.02 1ics h SER 143 Ca -0.48 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1ics h SER 143 Cb 1.32 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 1ics h SER 143 CO 0.39 0.46 0.00 -0.46 -0.87 0.00 0.00 176.83 176.35 1ics n ASN 144 N -4.54 0.00 -0.86 4.97 0.23 -1.26 -4.87 115.26 108.93 1ics n ASN 144 Ca 0.16 -0.88 -0.11 0.00 -0.53 0.00 0.00 54.58 53.22 1ics n ASN 144 Cb 0.32 0.00 -0.05 0.00 -2.08 0.00 0.00 39.78 37.98 1ics n ASN 144 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1ics n GLY 145 N 0.41 1.03 0.01 4.83 0.00 -0.89 -4.73 105.19 105.86 1ics n GLY 145 Ca 0.14 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.15 1ics n GLY 145 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1ics n ILE 146 N -2.13 0.16 -4.43 -0.61 5.41 -1.26 -5.01 119.36 111.49 1ics n ILE 146 Ca -0.11 -0.10 -0.32 0.00 1.00 0.00 0.00 62.75 63.22 1ics n ILE 146 Cb 0.57 -0.90 -0.10 0.00 -0.71 0.00 0.00 39.64 38.51 1ics n ILE 146 CO 0.00 0.00 0.00 -1.81 0.00 0.00 0.00 176.55 174.74 1ics s ASP 147 N -3.26 4.69 -0.22 4.38 1.01 -1.26 -5.02 116.67 116.99 1ics s ASP 147 Ca -0.01 -0.13 -0.08 0.00 0.71 0.00 0.00 52.55 53.04 1ics s ASP 147 Cb 0.01 -1.11 -0.04 0.00 1.01 0.00 0.00 42.92 42.79 1ics s ASP 147 CO 0.10 0.28 0.08 -0.63 0.21 0.00 0.00 175.17 175.21 1ics s ILE 148 N -1.02 4.71 -0.13 0.77 1.01 -1.26 0.34 121.20 125.62 1ics s ILE 148 Ca 0.18 -0.05 -0.20 0.00 0.00 0.00 0.00 60.65 60.58 1ics s ILE 148 Cb -0.11 -3.16 -0.04 0.00 0.01 0.00 0.00 42.46 39.16 1ics s ILE 148 CO 0.08 0.39 0.56 0.00 0.00 0.00 0.00 174.94 175.98 1ics s ALA 149 N 0.94 3.47 0.13 9.38 0.00 0.20 -4.91 121.76 130.95 1ics s ALA 149 Ca 0.04 -0.16 0.05 0.00 0.00 0.00 0.00 51.96 51.89 1ics s ALA 149 Cb -0.14 -2.80 -0.04 0.00 0.00 0.00 0.00 23.12 20.14 1ics s ALA 149 CO 0.03 -0.19 0.05 -1.01 0.00 0.00 0.00 175.76 174.63 1ics s HIS 150 N 1.06 3.02 0.07 0.00 3.76 -1.26 -1.97 115.29 119.97 1ics s HIS 150 Ca 0.29 -0.04 0.07 0.00 -0.15 0.00 0.00 55.06 55.23 1ics s HIS 150 Cb -0.16 -1.50 -0.03 0.00 1.11 0.00 0.00 32.58 32.00 1ics s HIS 150 CO 0.12 0.50 -0.20 -0.06 -0.85 0.00 0.00 174.74 174.26 1ics s PHE 151 N -1.54 1.70 0.16 1.40 0.40 -1.26 -4.65 117.98 114.19 1ics s PHE 151 Ca 0.28 -0.40 -0.08 0.00 -0.60 0.00 0.00 56.93 56.13 1ics s PHE 151 Cb -0.11 -0.97 -0.06 0.00 0.51 0.00 0.00 43.02 42.39 1ics s PHE 151 CO 0.20 0.14 0.45 0.99 0.70 0.00 0.00 175.22 177.70 1ics s THR 152 N -1.01 5.06 0.24 0.64 2.01 -1.02 -4.79 115.64 116.77 1ics s THR 152 Ca 0.06 0.30 -0.30 0.00 0.31 0.00 0.00 61.69 62.05 1ics s THR 152 Cb -0.09 -3.63 -0.10 0.00 0.01 0.00 0.00 72.50 68.68 1ics s THR 152 CO 0.03 0.06 1.49 -0.13 -0.69 0.00 0.00 174.62 175.38 1ics s ARG 153 N -2.54 4.23 0.67 4.92 1.81 -1.26 -4.69 118.95 122.10 1ics s ARG 153 Ca 0.42 2.37 -0.08 0.00 -1.72 0.00 0.00 55.73 56.71 1ics s ARG 153 Cb -0.12 -3.10 0.03 0.00 -0.45 0.00 0.00 34.95 31.31 1ics s ARG 153 CO 0.22 -0.50 1.01 -1.25 -0.68 0.00 0.00 175.30 174.11 1ics s PRO 154 N -0.11 2.62 -0.09 3.54 0.04 -1.26 -4.33 135.00 135.41 1ics s PRO 154 Ca 0.62 0.08 -0.06 0.00 0.04 0.00 0.00 61.00 61.68 1ics s PRO 154 Cb -0.43 -2.14 -0.04 0.00 0.04 0.00 0.00 34.50 31.93 1ics s PRO 154 CO 0.42 -1.03 0.14 -0.98 0.04 0.00 0.00 177.00 175.59 1ics s ARG 155 N -5.22 3.40 -0.38 4.56 1.70 0.95 -4.28 118.95 119.68 1ics s ARG 155 Ca 0.57 -0.19 -0.29 0.00 -0.47 0.00 0.00 55.73 55.35 1ics s ARG 155 Cb -0.11 -3.14 0.01 0.00 -0.57 0.00 0.00 34.95 31.14 1ics s ARG 155 CO 0.47 0.75 1.31 0.50 -1.08 0.00 0.00 175.30 177.25 1ics s ARG 156 N -1.23 3.74 0.54 3.89 3.52 -1.22 -2.00 118.95 126.19 1ics s ARG 156 Ca 0.18 0.98 -0.21 0.00 -0.13 0.00 0.00 55.73 56.54 1ics s ARG 156 Cb -0.12 -3.94 -0.06 0.00 -1.56 0.00 0.00 34.95 29.27 1ics s ARG 156 CO 0.07 -1.35 1.15 1.28 -0.81 0.00 0.00 175.30 175.64 1ics n LEU 157 N 8.14 4.25 -4.90 -0.88 4.77 -0.45 -4.98 117.00 122.95 1ics n LEU 157 Ca 0.15 0.93 -0.28 0.00 -0.03 0.00 0.00 56.01 56.78 1ics n LEU 157 Cb 0.48 -1.46 0.03 0.00 -2.33 0.00 0.00 43.42 40.14 1ics n LEU 157 CO 0.68 -1.20 0.61 0.42 -1.33 0.00 0.00 177.39 176.57 1ics s THR 158 N -1.36 3.73 0.10 -5.08 -4.23 -1.26 -4.97 115.64 102.57 1ics s THR 158 Ca 0.71 0.23 -0.29 0.00 -1.18 0.00 0.00 61.69 61.16 1ics s THR 158 Cb -0.45 -3.51 -0.12 0.00 1.34 0.00 0.00 72.50 69.77 1ics s THR 158 CO 0.50 -0.58 1.63 0.74 -0.54 0.00 0.00 174.62 176.37 1ics h THR 159 N -0.33 0.38 0.00 3.99 2.02 -2.03 -2.80 112.91 114.14 1ics h THR 159 Ca -0.45 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.73 1ics h THR 159 Cb 1.25 0.38 0.00 0.00 -1.74 0.00 0.00 68.15 68.03 1ics h THR 159 CO 0.62 0.00 0.00 -0.90 0.37 0.00 0.00 175.52 175.61 1ics n ASP 160 N -5.41 0.00 0.01 4.18 3.85 -1.26 -3.05 116.55 114.87 1ics n ASP 160 Ca -0.09 -0.75 -0.10 0.00 -0.71 0.00 0.00 54.79 53.14 1ics n ASP 160 Cb 0.32 -0.07 -0.14 0.00 -1.35 0.00 0.00 41.12 39.88 1ics n ASP 160 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.20 176.11 1ics h GLU 161 N 0.00 0.05 -0.83 0.11 4.81 -1.89 -3.38 114.58 113.44 1ics h GLU 161 Ca 0.00 -0.08 0.17 0.00 -0.13 0.00 0.00 59.36 59.32 1ics h GLU 161 Cb 0.06 0.03 -0.11 0.00 0.63 0.00 0.00 28.75 29.37 1ics h GLU 161 CO 0.00 0.73 0.37 0.82 -0.73 0.00 0.00 179.01 180.20 1ics h ILE 162 N 0.01 0.61 -0.43 2.32 2.04 -1.45 -1.24 117.51 119.38 1ics h ILE 162 Ca -0.23 -0.16 0.12 0.00 1.00 0.00 0.00 64.86 65.59 1ics h ILE 162 Cb 1.96 0.09 -0.02 0.00 -0.74 0.00 0.00 36.82 38.11 1ics h ILE 162 CO 0.10 0.09 0.31 -0.65 0.00 0.00 0.00 178.15 178.00 1ics h PRO 163 N 0.48 0.00 -0.49 2.37 0.11 -1.78 0.15 132.00 132.84 1ics h PRO 163 Ca 0.48 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 66.47 1ics h PRO 163 Cb 0.78 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.88 1ics h PRO 163 CO -0.44 0.00 -0.17 1.96 -0.21 0.00 0.00 178.00 179.14 1ics h GLN 164 N 0.00 0.95 -0.36 1.05 4.20 -1.48 0.35 115.11 119.81 1ics h GLN 164 Ca 0.20 -0.37 -0.05 0.00 0.06 0.00 0.00 58.65 58.49 1ics h GLN 164 Cb 0.82 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.54 1ics h GLN 164 CO -0.00 1.04 0.02 0.82 -0.67 0.00 0.00 178.83 180.04 1ics h ILE 165 N 0.83 1.25 -0.90 2.54 1.08 -0.83 -2.00 117.51 119.49 1ics h ILE 165 Ca 0.12 -0.94 0.10 0.00 -0.39 0.00 0.00 64.86 63.75 1ics h ILE 165 Cb 0.72 1.16 -0.08 0.00 -3.07 0.00 0.00 36.82 35.55 1ics h ILE 165 CO 0.06 0.31 0.54 0.58 -0.69 0.00 0.00 178.15 178.95 1ics h VAL 166 N 0.45 0.92 -0.11 1.67 2.07 -0.57 -0.30 116.25 120.38 1ics h VAL 166 Ca 0.10 -0.30 -0.01 0.00 0.82 0.00 0.00 66.70 67.32 1ics h VAL 166 Cb 0.43 -0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.15 1ics h VAL 166 CO 0.01 0.16 0.04 -1.13 0.02 0.00 0.00 177.57 176.67 1ics h ASN 167 N 0.88 0.13 -0.45 0.57 -0.00 -0.23 -2.18 115.58 114.30 1ics h ASN 167 Ca 0.44 -0.01 -0.02 0.00 -0.00 0.00 0.00 56.30 56.70 1ics h ASN 167 Cb 0.40 -0.03 -0.02 0.00 -0.00 0.00 0.00 38.32 38.66 1ics h ASN 167 CO -0.25 0.13 0.21 -0.33 -0.00 0.00 0.00 177.43 177.19 1ics h GLU 168 N 0.15 0.71 -0.28 6.67 5.08 -0.48 -1.04 114.58 125.40 1ics h GLU 168 Ca 0.04 -0.10 -0.12 0.00 -1.00 0.00 0.00 59.36 58.18 1ics h GLU 168 Cb 0.04 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 1ics h GLU 168 CO -0.00 0.58 -0.32 0.74 -1.00 0.00 0.00 179.01 179.00 1ics h PHE 169 N 0.71 0.69 0.32 4.33 -1.00 -1.38 -1.84 116.94 118.77 1ics h PHE 169 Ca 0.17 -0.18 -0.01 0.00 2.81 0.00 0.00 57.97 60.76 1ics h PHE 169 Cb 0.13 -0.16 0.00 0.00 3.61 0.00 0.00 35.95 39.53 1ics h PHE 169 CO 0.01 0.85 -0.16 -0.09 -1.61 0.00 0.00 178.31 177.30 1ics h ARG 170 N 0.51 -0.43 -0.50 1.51 2.43 -1.11 -0.75 114.38 116.05 1ics h ARG 170 Ca 0.06 0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.25 1ics h ARG 170 Cb 0.80 0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 30.43 1ics h ARG 170 CO 0.07 -0.29 0.28 0.28 -1.51 0.00 0.00 179.97 178.80 1ics h VAL 171 N -0.45 1.16 -0.46 0.20 2.07 -1.20 -1.83 116.25 115.75 1ics h VAL 171 Ca -0.04 -0.40 0.07 0.00 0.82 0.00 0.00 66.70 67.15 1ics h VAL 171 Cb 0.35 0.53 -0.06 0.00 -1.52 0.00 0.00 31.29 30.59 1ics h VAL 171 CO 0.07 0.17 0.14 0.00 0.02 0.00 0.00 177.57 177.97 1ics h ALA 172 N 1.13 0.55 -0.49 1.67 0.00 -1.19 0.22 119.26 121.14 1ics h ALA 172 Ca 0.18 0.07 0.04 0.00 0.00 0.00 0.00 54.91 55.20 1ics h ALA 172 Cb 0.02 0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 1ics h ALA 172 CO -0.03 -0.26 0.24 0.00 0.00 0.00 0.00 179.25 179.20 1ics h ALA 173 N 1.33 0.62 -0.45 0.00 0.00 -0.79 0.14 119.26 120.11 1ics h ALA 173 Ca 0.22 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.15 1ics h ALA 173 Cb 0.25 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 1ics h ALA 173 CO -0.25 -0.11 0.26 -0.09 0.00 0.00 0.00 179.25 179.06 1ics h ARG 174 N 0.47 0.62 -0.78 0.00 9.65 -0.40 -2.44 114.38 121.50 1ics h ARG 174 Ca 0.22 -0.06 -0.00 0.00 -1.10 0.00 0.00 59.98 59.03 1ics h ARG 174 Cb 0.14 -0.13 -0.04 0.00 -1.39 0.00 0.00 29.97 28.55 1ics h ARG 174 CO -0.16 0.47 0.47 -0.91 2.80 0.00 0.00 179.97 182.63 1ics h ASN 175 N 0.60 0.93 -0.98 -3.80 2.35 0.23 -1.01 115.58 113.91 1ics h ASN 175 Ca 0.16 -0.06 0.05 0.00 -0.55 0.00 0.00 56.30 55.90 1ics h ASN 175 Cb 0.01 -0.24 -0.06 0.00 0.05 0.00 0.00 38.32 38.09 1ics h ASN 175 CO -0.03 0.72 0.64 0.00 -1.65 0.00 0.00 177.43 177.11 1ics h ALA 176 N 1.25 1.33 -0.57 -0.83 0.00 -0.42 0.14 119.26 120.16 1ics h ALA 176 Ca 0.28 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 55.09 1ics h ALA 176 Cb -0.04 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.40 1ics h ALA 176 CO -0.05 0.48 0.11 0.82 0.00 0.00 0.00 179.25 180.61 1ics h ILE 177 N 1.20 1.24 -0.19 0.00 1.08 -0.92 -1.37 117.51 118.55 1ics h ILE 177 Ca 0.41 -0.91 -0.07 0.00 -0.39 0.00 0.00 64.86 63.90 1ics h ILE 177 Cb 0.08 0.68 -0.01 0.00 -3.07 0.00 0.00 36.82 34.50 1ics h ILE 177 CO -0.15 0.34 -0.17 -0.08 -0.69 0.00 0.00 178.15 177.40 1ics h GLU 178 N 0.86 0.31 0.00 2.37 4.81 0.26 -1.22 114.58 121.98 1ics h GLU 178 Ca 0.18 -0.09 0.00 0.00 -0.13 0.00 0.00 59.36 59.32 1ics h GLU 178 Cb 0.35 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.70 1ics h GLU 178 CO 0.00 0.49 0.00 0.00 -0.73 0.00 0.00 179.01 178.77 1ics n ALA 179 N -2.48 1.99 0.00 2.92 0.00 0.32 -4.92 120.51 118.34 1ics n ALA 179 Ca -0.00 0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.47 1ics n ALA 179 Cb 0.32 -1.44 0.00 0.00 0.00 0.00 0.00 19.45 18.33 1ics n ALA 179 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ics n GLY 180 N 0.70 0.73 3.77 0.00 0.00 -0.46 -4.13 105.19 105.80 1ics n GLY 180 Ca 0.04 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 1ics n GLY 180 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ics s PHE 181 N -2.00 2.67 0.18 1.61 0.40 -0.60 -4.90 117.98 115.34 1ics s PHE 181 Ca 0.00 1.32 0.33 0.00 -0.60 0.00 0.00 56.93 57.98 1ics s PHE 181 Cb 0.00 -3.81 1.40 0.00 0.51 0.00 0.00 43.02 41.11 1ics s PHE 181 CO 0.00 -2.51 2.00 -0.44 0.70 0.00 0.00 175.22 174.97 1ics h ASP 182 N 2.66 0.00 -1.30 1.36 3.32 -1.07 -3.41 116.42 117.98 1ics h ASP 182 Ca -0.50 0.00 0.23 0.00 0.02 0.00 0.00 57.03 56.77 1ics h ASP 182 Cb 1.25 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.76 1ics h ASP 182 CO 0.62 0.04 0.58 0.61 -1.72 0.00 0.00 179.24 179.38 1ics n GLY 183 N -0.10 0.31 3.13 2.75 0.00 -1.16 -4.81 105.19 105.31 1ics n GLY 183 Ca 0.00 -0.95 -0.15 0.00 0.00 0.00 0.00 46.02 44.92 1ics n GLY 183 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ics s VAL 184 N -2.04 0.85 -0.14 1.61 -7.23 -0.52 -0.58 120.40 112.34 1ics s VAL 184 Ca 0.19 -1.32 0.00 0.00 -1.81 0.00 0.00 61.98 59.04 1ics s VAL 184 Cb -0.00 -0.99 -0.01 0.00 0.56 0.00 0.00 36.38 35.94 1ics s VAL 184 CO -0.01 -0.38 -0.15 -0.70 -0.31 0.00 0.00 175.10 173.54 1ics s GLU 185 N -2.00 3.26 -0.08 4.82 2.12 0.03 -0.67 118.70 126.19 1ics s GLU 185 Ca -0.03 -0.74 -0.28 0.00 0.36 0.00 0.00 54.97 54.28 1ics s GLU 185 Cb -0.08 -2.60 -0.02 0.00 0.26 0.00 0.00 34.13 31.69 1ics s GLU 185 CO 0.01 0.10 0.91 0.42 -0.54 0.00 0.00 175.26 176.16 1ics s ILE 186 N 0.61 4.88 -0.86 -3.70 1.01 -0.48 -0.96 121.20 121.68 1ics s ILE 186 Ca -0.09 1.86 -0.24 0.00 0.00 0.00 0.00 60.65 62.18 1ics s ILE 186 Cb -0.16 -4.23 0.05 0.00 0.01 0.00 0.00 42.46 38.13 1ics s ILE 186 CO 0.03 0.10 1.32 -2.28 0.00 0.00 0.00 174.94 174.11 1ics s HIS 187 N 1.51 2.47 -0.32 3.97 2.46 -0.48 -1.17 115.29 123.73 1ics s HIS 187 Ca 0.45 -0.50 0.08 0.00 0.47 0.00 0.00 55.06 55.56 1ics s HIS 187 Cb -0.19 -4.61 0.54 0.00 -0.13 0.00 0.00 32.58 28.19 1ics s HIS 187 CO 0.20 -1.95 1.55 0.41 -2.47 0.00 0.00 174.74 172.48 1ics n GLY 188 N 6.02 4.77 0.72 1.59 0.00 0.02 -4.60 105.19 113.70 1ics n GLY 188 Ca 0.16 -1.19 -0.06 0.00 0.00 0.00 0.00 46.02 44.93 1ics n GLY 188 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ics n ALA 189 N -1.08 0.11 -3.19 4.61 0.00 -1.17 -4.20 120.51 115.58 1ics n ALA 189 Ca 0.38 -0.45 -0.20 0.00 0.00 0.00 0.00 53.44 53.16 1ics n ALA 189 Cb 1.15 0.28 -0.01 0.00 0.00 0.00 0.00 19.45 20.87 1ics n ALA 189 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1ics n HIS 190 N -0.22 -1.71 -1.07 0.00 8.25 -1.26 -2.41 115.22 116.79 1ics n HIS 190 Ca -0.02 0.36 -0.03 0.00 -0.26 0.00 0.00 57.72 57.77 1ics n HIS 190 Cb 0.13 -2.65 -0.01 0.00 1.12 0.00 0.00 29.99 28.58 1ics n HIS 190 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ics n GLY 191 N -1.04 0.58 2.36 -1.41 0.00 -1.25 -4.53 105.19 99.90 1ics n GLY 191 Ca -0.03 -0.47 -0.16 0.00 0.00 0.00 0.00 46.02 45.36 1ics n GLY 191 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1ics n TYR 192 N -2.83 -3.54 -0.39 1.61 4.01 -1.01 -4.47 117.16 110.54 1ics n TYR 192 Ca -0.03 -0.90 -0.04 0.00 -0.16 0.00 0.00 57.90 56.77 1ics n TYR 192 Cb 0.13 -0.53 0.00 0.00 -0.31 0.00 0.00 39.34 38.63 1ics n TYR 192 CO 0.00 0.00 0.00 -0.11 -0.46 0.00 0.00 176.86 176.29 1ics n LEU 193 N 0.00 -0.76 -0.17 7.72 7.94 -0.82 0.75 117.00 131.66 1ics n LEU 193 Ca 0.10 1.75 -0.08 0.00 -1.11 0.00 0.00 56.01 56.67 1ics n LEU 193 Cb 0.36 -0.35 0.01 0.00 0.53 0.00 0.00 43.42 43.96 1ics n LEU 193 CO 0.25 -1.53 0.94 0.40 -1.11 0.00 0.00 177.39 176.34 1ics h ILE 194 N 0.00 1.22 -0.41 1.96 2.04 -1.81 -2.56 117.51 117.96 1ics h ILE 194 Ca 0.30 -0.71 -0.09 0.00 1.00 0.00 0.00 64.86 65.36 1ics h ILE 194 Cb 0.54 0.74 -0.02 0.00 -0.74 0.00 0.00 36.82 37.35 1ics h ILE 194 CO -0.98 0.26 -0.12 -0.78 0.00 0.00 0.00 178.15 176.53 1ics h ASP 195 N 0.67 0.72 -0.92 1.72 3.58 -1.34 -2.39 116.42 118.46 1ics h ASP 195 Ca 0.16 -0.22 0.11 0.00 0.42 0.00 0.00 57.03 57.50 1ics h ASP 195 Cb 0.23 -0.19 -0.07 0.00 1.72 0.00 0.00 39.33 41.01 1ics h ASP 195 CO -0.01 0.87 0.59 1.56 -2.88 0.00 0.00 179.24 179.37 1ics h GLN 196 N 0.66 0.88 -0.11 0.28 4.20 0.69 -0.54 115.11 121.17 1ics h GLN 196 Ca 0.11 -0.05 -0.16 0.00 0.06 0.00 0.00 58.65 58.61 1ics h GLN 196 Cb 0.59 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 28.17 1ics h GLN 196 CO 0.04 0.58 -0.62 0.74 -0.67 0.00 0.00 178.83 178.90 1ics h PHE 197 N 0.90 0.51 -0.07 2.96 -1.00 -1.05 -3.24 116.94 115.95 1ics h PHE 197 Ca 0.44 -0.20 -0.16 0.00 2.81 0.00 0.00 57.97 60.85 1ics h PHE 197 Cb 0.45 -0.09 0.01 0.00 3.61 0.00 0.00 35.95 39.93 1ics h PHE 197 CO -0.00 0.91 -0.59 0.52 -1.61 0.00 0.00 178.31 177.53 1ics h MET 198 N 0.29 0.53 -6.27 1.51 2.86 -0.89 -3.42 114.93 109.53 1ics h MET 198 Ca -0.01 -0.47 -0.55 0.00 -2.06 0.00 0.00 59.70 56.60 1ics h MET 198 Cb 1.16 0.11 -0.02 0.00 0.06 0.00 0.00 31.60 32.91 1ics h MET 198 CO 0.11 1.10 0.84 0.15 1.06 0.00 0.00 176.91 180.17 1ics s LYS 199 N -3.54 4.28 0.61 1.72 -0.14 -0.32 -4.86 119.74 117.49 1ics s LYS 199 Ca -0.12 1.81 0.39 0.00 -1.36 0.00 0.00 55.97 56.69 1ics s LYS 199 Cb 0.05 -3.67 1.91 0.00 -1.68 0.00 0.00 37.83 34.44 1ics s LYS 199 CO 0.84 -0.61 2.18 0.38 -0.76 0.00 0.00 175.35 177.39 1ics h ASP 200 N 8.02 0.00 0.67 2.83 3.04 -1.87 -0.30 116.42 128.82 1ics h ASP 200 Ca -0.33 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.46 1ics h ASP 200 Cb 1.15 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.44 1ics h ASP 200 CO 0.92 0.01 0.00 0.00 -2.04 0.00 0.00 179.24 178.13 1ics n GLN 201 N -3.12 0.20 -0.02 4.15 1.13 -0.96 -4.06 117.38 114.71 1ics n GLN 201 Ca -0.01 0.05 -0.06 0.00 -1.94 0.00 0.00 57.00 55.04 1ics n GLN 201 Cb 0.19 -1.50 -0.02 0.00 0.11 0.00 0.00 30.24 29.02 1ics n GLN 201 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 1ics n VAL 202 N -1.38 0.45 -2.04 5.09 0.31 -0.60 -4.94 118.33 115.22 1ics n VAL 202 Ca 0.10 -0.03 -0.41 0.00 -0.01 0.00 0.00 64.34 63.98 1ics n VAL 202 Cb 0.25 -1.60 -0.03 0.00 -0.91 0.00 0.00 33.84 31.55 1ics n VAL 202 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 1ics s ASN 203 N -5.59 5.72 -0.23 4.52 3.84 -0.22 -4.65 114.94 118.31 1ics s ASN 203 Ca -0.08 0.95 0.12 0.00 0.21 0.00 0.00 52.86 54.06 1ics s ASN 203 Cb 0.03 -2.53 0.46 0.00 -0.55 0.00 0.00 41.25 38.66 1ics s ASN 203 CO 0.10 -1.91 1.35 -0.90 -2.79 0.00 0.00 177.10 172.95 1ics n ASP 204 N 11.01 2.39 -4.81 -4.21 3.85 -1.26 -4.69 116.55 118.83 1ics n ASP 204 Ca 0.22 -3.64 -0.33 0.00 -0.71 0.00 0.00 54.79 50.32 1ics n ASP 204 Cb 0.49 -0.57 -0.03 0.00 -1.35 0.00 0.00 41.12 39.66 1ics n ASP 204 CO 0.00 0.00 0.00 -0.13 -1.01 0.00 0.00 177.20 176.06 1ics s ARG 205 N -3.15 3.75 0.00 0.11 0.52 -1.26 -4.99 118.95 113.93 1ics s ARG 205 Ca 0.41 1.25 0.11 0.00 -0.52 0.00 0.00 55.73 56.98 1ics s ARG 205 Cb 0.37 -2.09 0.19 0.00 0.52 0.00 0.00 34.95 33.94 1ics s ARG 205 CO -0.01 -0.46 1.04 -1.13 0.02 0.00 0.00 175.30 174.77 1ics n SER 206 N -1.25 2.40 -0.62 0.23 3.41 -1.26 -3.55 113.62 112.98 1ics n SER 206 Ca 0.09 -1.72 0.00 0.00 -0.26 0.00 0.00 58.87 56.98 1ics n SER 206 Cb 0.53 -0.11 0.00 0.00 -0.26 0.00 0.00 64.21 64.37 1ics n SER 206 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1ics n ASP 207 N 0.57 0.11 0.00 4.04 5.75 -1.26 -4.96 116.55 120.80 1ics n ASP 207 Ca 0.09 -0.31 0.09 0.00 -0.01 0.00 0.00 54.79 54.65 1ics n ASP 207 Cb 0.35 0.00 0.53 0.00 -1.03 0.00 0.00 41.12 40.97 1ics n ASP 207 CO 0.00 0.00 0.00 2.29 -0.11 0.00 0.00 177.20 179.38 1ics n LYS 208 N -0.29 0.62 -0.38 0.11 2.85 -1.26 -2.53 118.16 117.28 1ics n LYS 208 Ca 0.00 0.00 0.08 0.00 -1.05 0.00 0.00 58.31 57.34 1ics n LYS 208 Cb 0.00 -1.45 0.24 0.00 -0.65 0.00 0.00 35.03 33.17 1ics n LYS 208 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1ics n TYR 209 N -0.95 0.88 -4.05 5.58 4.01 -1.26 -4.52 117.16 116.84 1ics n TYR 209 Ca 0.13 -0.66 -0.11 0.00 -0.16 0.00 0.00 57.90 57.10 1ics n TYR 209 Cb 0.06 -0.18 -0.05 0.00 -0.31 0.00 0.00 39.34 38.86 1ics n TYR 209 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1ics s GLY 210 N -1.31 0.99 0.00 2.72 0.00 -1.05 -4.08 107.32 104.59 1ics s GLY 210 Ca 0.37 -1.21 0.00 0.00 0.00 0.00 0.00 44.72 43.87 1ics s GLY 210 CO 0.15 -0.85 0.00 0.61 0.00 0.00 0.00 173.10 173.01 1ics n GLY 211 N -0.44 1.35 3.72 0.20 0.00 -1.23 -4.62 105.19 104.17 1ics n GLY 211 Ca -0.00 -0.53 -0.32 0.00 0.00 0.00 0.00 46.02 45.16 1ics n GLY 211 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ics s SER 212 N -4.00 3.87 0.43 1.61 1.04 -1.26 -4.81 113.70 110.58 1ics s SER 212 Ca 0.00 2.09 0.09 0.00 0.48 0.00 0.00 55.95 58.62 1ics s SER 212 Cb 0.00 -2.56 0.93 0.00 0.10 0.00 0.00 66.02 64.50 1ics s SER 212 CO 0.00 -2.47 2.06 0.25 0.98 0.00 0.00 173.24 174.06 1ics h LEU 213 N -1.14 0.40 -0.45 2.42 5.85 -1.97 -1.81 115.31 118.61 1ics h LEU 213 Ca -0.44 -0.01 -0.09 0.00 0.84 0.00 0.00 57.88 58.18 1ics h LEU 213 Cb 1.26 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 42.18 1ics h LEU 213 CO 0.47 0.28 -0.06 -0.08 -0.34 0.00 0.00 178.44 178.71 1ics h GLU 214 N 0.47 0.84 -0.18 1.25 4.81 -1.96 -2.98 114.58 116.83 1ics h GLU 214 Ca 0.16 -0.30 -0.16 0.00 -0.13 0.00 0.00 59.36 58.93 1ics h GLU 214 Cb 0.05 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.36 1ics h GLU 214 CO -0.04 0.93 -0.54 -0.91 -0.73 0.00 0.00 179.01 177.72 1ics h ASN 215 N 0.68 0.59 0.49 1.04 -0.26 -1.59 -2.94 115.58 113.59 1ics h ASN 215 Ca 0.12 -0.31 -0.02 0.00 -0.56 0.00 0.00 56.30 55.52 1ics h ASN 215 Cb 0.59 -0.17 -0.00 0.00 -1.06 0.00 0.00 38.32 37.67 1ics h ASN 215 CO 0.04 1.02 -0.12 0.03 -1.06 0.00 0.00 177.43 177.34 1ics h ARG 216 N 0.41 0.00 -0.01 0.81 3.08 -1.35 -2.55 114.38 114.78 1ics h ARG 216 Ca 0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.06 1ics h ARG 216 Cb 1.08 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.13 1ics h ARG 216 CO 0.10 0.12 -0.58 0.00 -1.07 0.00 0.00 179.97 178.54 1ics h ARG 218 N 1.48 0.41 0.09 0.00 2.43 -1.27 0.89 114.38 118.41 1ics h ARG 218 Ca 0.00 -0.02 0.02 0.00 -0.81 0.00 0.00 59.98 59.17 1ics h ARG 218 Cb 0.64 -0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 30.06 1ics h ARG 218 CO 0.00 0.27 -0.27 0.35 -1.51 0.00 0.00 179.97 178.81 1ics h PHE 219 N 0.42 -0.73 -0.62 2.20 3.57 -1.77 0.96 116.94 120.97 1ics h PHE 219 Ca 0.23 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.76 1ics h PHE 219 Cb 0.19 0.31 -0.04 0.00 2.79 0.00 0.00 35.95 39.21 1ics h PHE 219 CO -0.13 -0.37 0.40 0.00 -2.23 0.00 0.00 178.31 175.97 1ics h ALA 220 N 0.27 0.80 -0.30 2.41 0.00 -1.73 -0.35 119.26 120.35 1ics h ALA 220 Ca 0.04 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.81 1ics h ALA 220 Cb 0.51 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1ics h ALA 220 CO -0.17 0.17 -0.26 -0.07 0.00 0.00 0.00 179.25 178.91 1ics h LEU 221 N 0.79 0.60 -0.78 0.00 3.38 -0.18 0.88 115.31 120.01 1ics h LEU 221 Ca 0.24 -0.22 -0.09 0.00 0.09 0.00 0.00 57.88 57.90 1ics h LEU 221 Cb -0.03 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 1ics h LEU 221 CO -0.08 0.85 -0.09 -0.33 0.09 0.00 0.00 178.44 178.88 1ics h GLU 222 N 0.52 0.83 -0.32 1.13 5.08 0.14 -1.13 114.58 120.83 1ics h GLU 222 Ca 0.07 -0.27 -0.03 0.00 -1.00 0.00 0.00 59.36 58.13 1ics h GLU 222 Cb 0.72 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.89 1ics h GLU 222 CO 0.06 0.89 0.09 0.82 -1.00 0.00 0.00 179.01 179.86 1ics h ILE 223 N 0.75 1.22 -0.96 3.13 2.04 -0.47 0.12 117.51 123.33 1ics h ILE 223 Ca 0.13 -0.71 0.01 0.00 1.00 0.00 0.00 64.86 65.29 1ics h ILE 223 Cb 0.58 1.07 -0.05 0.00 -0.74 0.00 0.00 36.82 37.68 1ics h ILE 223 CO 0.04 0.24 0.63 0.58 0.00 0.00 0.00 178.15 179.64 1ics h VAL 224 N 0.37 1.24 -0.20 1.67 2.07 -0.60 -0.96 116.25 119.84 1ics h VAL 224 Ca 0.10 -0.44 -0.05 0.00 0.82 0.00 0.00 66.70 67.13 1ics h VAL 224 Cb 0.28 -0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 29.88 1ics h VAL 224 CO -0.00 0.24 -0.05 -0.08 0.02 0.00 0.00 177.57 177.69 1ics h GLU 225 N 1.29 0.38 -0.28 1.57 4.81 -0.82 -0.41 114.58 121.12 1ics h GLU 225 Ca 0.35 -0.15 -0.00 0.00 -0.13 0.00 0.00 59.36 59.43 1ics h GLU 225 Cb -0.14 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.21 1ics h GLU 225 CO -0.08 0.64 0.17 0.00 -0.73 0.00 0.00 179.01 179.02 1ics h ALA 226 N 0.73 0.36 -0.25 2.92 0.00 -0.44 -1.77 119.26 120.80 1ics h ALA 226 Ca 0.05 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 1ics h ALA 226 Cb 0.50 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1ics h ALA 226 CO 0.02 -0.13 0.00 0.28 0.00 0.00 0.00 179.25 179.42 1ics h VAL 227 N 0.36 1.26 -0.08 0.00 2.07 -1.16 -0.57 116.25 118.12 1ics h VAL 227 Ca 0.10 -0.91 0.01 0.00 0.82 0.00 0.00 66.70 66.72 1ics h VAL 227 Cb 0.01 1.35 -0.01 0.00 -1.52 0.00 0.00 31.29 31.13 1ics h VAL 227 CO -0.02 0.29 0.02 0.00 0.02 0.00 0.00 177.57 177.88 1ics h ALA 228 N 0.81 0.08 -0.79 1.67 0.00 -1.02 -0.53 119.26 119.48 1ics h ALA 228 Ca 0.07 0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.03 1ics h ALA 228 Cb 0.41 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.16 1ics h ALA 228 CO 0.01 -0.44 0.50 -0.91 0.00 0.00 0.00 179.25 178.40 1ics h ASN 229 N 0.06 0.80 -0.03 0.00 2.35 -1.27 1.09 115.58 118.59 1ics h ASN 229 Ca 0.03 0.01 -0.00 0.00 -0.55 0.00 0.00 56.30 55.79 1ics h ASN 229 Cb 0.02 -0.17 -0.00 0.00 0.05 0.00 0.00 38.32 38.22 1ics h ASN 229 CO -0.04 0.54 0.01 -0.08 -1.65 0.00 0.00 177.43 176.21 1ics h GLU 230 N 0.94 0.04 -0.01 0.81 4.57 -0.61 -3.36 114.58 116.96 1ics h GLU 230 Ca 0.33 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.50 1ics h GLU 230 Cb 0.07 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 28.65 1ics h GLU 230 CO -0.13 0.25 -0.06 0.44 -1.18 0.00 0.00 179.01 178.33 1ics n ILE 231 N -4.96 0.00 -0.00 2.32 -5.35 -0.25 -4.99 119.36 106.13 1ics n ILE 231 Ca -0.07 -0.47 0.00 0.00 -0.27 0.00 0.00 62.75 61.94 1ics n ILE 231 Cb 0.13 1.09 0.00 0.00 -1.74 0.00 0.00 39.64 39.12 1ics n ILE 231 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1ics n GLY 232 N 0.53 1.48 0.27 3.28 0.00 0.37 -4.71 105.19 106.40 1ics n GLY 232 Ca 0.03 -1.33 0.10 0.00 0.00 0.00 0.00 46.02 44.83 1ics n GLY 232 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1ics h SER 233 N 0.00 0.00 0.00 1.61 4.64 -1.83 -1.90 113.55 116.07 1ics h SER 233 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ics h SER 233 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1ics h SER 233 CO 0.00 0.04 0.00 -0.90 -0.87 0.00 0.00 176.83 175.10 1ics n ASP 234 N -4.18 0.00 -0.07 4.97 3.85 -1.26 -1.85 116.55 118.01 1ics n ASP 234 Ca -0.03 -0.88 0.08 0.00 -0.71 0.00 0.00 54.79 53.26 1ics n ASP 234 Cb 0.12 0.00 0.11 0.00 -1.35 0.00 0.00 41.12 40.01 1ics n ASP 234 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 1ics n ARG 235 N -0.90 1.49 -4.67 0.11 1.74 -0.71 -4.00 116.66 109.72 1ics n ARG 235 Ca 0.14 -2.35 -0.25 0.00 -0.77 0.00 0.00 57.85 54.62 1ics n ARG 235 Cb 0.06 -1.39 -0.16 0.00 -1.02 0.00 0.00 32.46 29.96 1ics n ARG 235 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1ics s VAL 236 N -2.49 1.23 0.34 1.55 1.01 -0.77 -1.44 120.40 119.83 1ics s VAL 236 Ca 0.26 -0.57 0.04 0.00 0.00 0.00 0.00 61.98 61.71 1ics s VAL 236 Cb 0.23 -1.08 -0.06 0.00 0.00 0.00 0.00 36.38 35.46 1ics s VAL 236 CO 0.02 0.37 0.06 -0.83 0.00 0.00 0.00 175.10 174.72 1ics s GLY 237 N 0.34 2.18 -0.09 4.51 0.00 0.16 -0.17 107.32 114.25 1ics s GLY 237 Ca -0.09 -1.93 -0.13 0.00 0.00 0.00 0.00 44.72 42.57 1ics s GLY 237 CO 0.03 -1.84 0.34 -1.50 0.00 0.00 0.00 173.10 170.13 1ics s ILE 238 N -3.25 0.02 -0.05 0.90 2.07 -1.17 -1.39 121.20 118.33 1ics s ILE 238 Ca 0.34 -0.16 0.05 0.00 -1.41 0.00 0.00 60.65 59.47 1ics s ILE 238 Cb 0.08 -0.54 -0.02 0.00 0.13 0.00 0.00 42.46 42.10 1ics s ILE 238 CO 0.15 -0.09 -0.19 -0.60 -1.91 0.00 0.00 174.94 172.31 1ics s ARG 239 N -0.34 2.46 0.05 3.50 3.52 -0.32 -0.89 118.95 126.92 1ics s ARG 239 Ca -0.05 -0.78 -0.01 0.00 -0.13 0.00 0.00 55.73 54.76 1ics s ARG 239 Cb -0.03 -2.28 -0.04 0.00 -1.56 0.00 0.00 34.95 31.04 1ics s ARG 239 CO 0.02 0.55 -0.03 0.96 -0.81 0.00 0.00 175.30 175.99 1ics s ILE 240 N -0.56 0.22 -0.42 4.11 -4.36 -0.14 -0.80 121.20 119.24 1ics s ILE 240 Ca 0.08 -1.77 0.07 0.00 -0.26 0.00 0.00 60.65 58.76 1ics s ILE 240 Cb -0.11 -1.48 0.23 0.00 1.25 0.00 0.00 42.46 42.35 1ics s ILE 240 CO 0.01 -0.98 0.56 -1.54 0.24 0.00 0.00 174.94 173.23 1ics n SER 241 N 0.15 -0.78 -0.15 4.36 3.41 -1.26 -1.87 113.62 117.48 1ics n SER 241 Ca -0.14 -2.75 0.11 0.00 -0.26 0.00 0.00 58.87 55.83 1ics n SER 241 Cb 0.61 -0.01 0.45 0.00 -0.26 0.00 0.00 64.21 65.00 1ics n SER 241 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 1ics h PRO 242 N 4.43 0.52 0.00 4.33 0.11 -1.89 -2.59 132.00 136.92 1ics h PRO 242 Ca 0.07 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.15 1ics h PRO 242 Cb 0.93 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 31.92 1ics h PRO 242 CO 0.38 0.35 -0.68 1.19 -0.21 0.00 0.00 178.00 179.03 1ics n PHE 243 N -4.49 0.46 -2.17 0.65 3.01 -1.26 -4.64 117.46 109.02 1ics n PHE 243 Ca 0.12 0.13 -0.34 0.00 1.01 0.00 0.00 57.45 58.37 1ics n PHE 243 Cb 0.38 -0.58 0.01 0.00 -0.01 0.00 0.00 39.48 39.27 1ics n PHE 243 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1ics s ALA 244 N -3.16 2.68 -0.13 4.37 0.00 -0.98 -4.86 121.76 119.69 1ics s ALA 244 Ca 0.06 0.66 0.01 0.00 0.00 0.00 0.00 51.96 52.70 1ics s ALA 244 Cb 0.14 -3.31 0.04 0.00 0.00 0.00 0.00 23.12 19.98 1ics s ALA 244 CO 0.73 -0.80 1.01 0.72 0.00 0.00 0.00 175.76 177.41 1ics n HIS 245 N -1.59 0.06 -1.58 0.00 8.25 -1.26 -4.43 115.22 114.67 1ics n HIS 245 Ca 0.11 -0.47 -0.43 0.00 -0.26 0.00 0.00 57.72 56.66 1ics n HIS 245 Cb 0.52 -0.04 -0.01 0.00 1.12 0.00 0.00 29.99 31.58 1ics n HIS 245 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1ics n TYR 246 N -0.34 1.00 -3.83 4.41 4.01 -1.26 -2.32 117.16 118.84 1ics n TYR 246 Ca 0.02 0.66 -0.26 0.00 -0.16 0.00 0.00 57.90 58.15 1ics n TYR 246 Cb 0.26 -2.21 0.03 0.00 -0.31 0.00 0.00 39.34 37.11 1ics n TYR 246 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1ics n ASN 247 N 1.04 -2.96 -4.16 7.72 3.02 -1.26 -2.18 115.26 116.48 1ics n ASN 247 Ca 0.10 -0.81 -0.34 0.00 -0.03 0.00 0.00 54.58 53.50 1ics n ASN 247 Cb 0.35 -3.91 -0.03 0.00 -0.61 0.00 0.00 39.78 35.58 1ics n ASN 247 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1ics n GLU 248 N -4.49 -3.20 -2.92 3.52 1.02 -0.98 -4.89 120.64 108.70 1ics n GLU 248 Ca -0.13 0.38 -0.30 0.00 -0.02 0.00 0.00 57.16 57.09 1ics n GLU 248 Cb 0.60 -4.94 -0.03 0.00 -0.02 0.00 0.00 31.44 27.05 1ics n GLU 248 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1ics n ALA 249 N -4.41 4.89 -2.45 0.62 0.00 -0.92 -4.75 120.51 113.49 1ics n ALA 249 Ca -0.02 -4.70 -0.25 0.00 0.00 0.00 0.00 53.44 48.47 1ics n ALA 249 Cb 0.54 -1.02 -0.00 0.00 0.00 0.00 0.00 19.45 18.97 1ics n ALA 249 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1ics s GLY 250 N -3.02 1.45 0.03 0.00 0.00 -1.26 -4.57 107.32 99.95 1ics s GLY 250 Ca 0.46 -0.85 0.06 0.00 0.00 0.00 0.00 44.72 44.39 1ics s GLY 250 CO -0.12 -0.72 -0.17 -0.35 0.00 0.00 0.00 173.10 171.73 1ics s ASP 251 N -4.11 2.04 0.00 1.64 -1.08 -1.26 -2.26 116.67 111.64 1ics s ASP 251 Ca 0.45 -0.45 0.26 0.00 -0.52 0.00 0.00 52.55 52.28 1ics s ASP 251 Cb -0.10 -0.17 1.53 0.00 -1.46 0.00 0.00 42.92 42.72 1ics s ASP 251 CO 0.39 0.12 1.89 0.35 0.52 0.00 0.00 175.17 178.44 1ics n THR 252 N 2.03 0.01 -2.83 1.71 -2.24 -1.26 -4.01 114.28 107.69 1ics n THR 252 Ca -0.17 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.50 1ics n THR 252 Cb 0.54 -0.60 0.04 0.00 -2.10 0.00 0.00 70.33 68.21 1ics n THR 252 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1ics n ASN 253 N -1.01 -2.05 -0.29 3.42 2.85 -1.26 -5.02 115.26 111.90 1ics n ASN 253 Ca 0.19 -3.33 0.10 0.00 -0.11 0.00 0.00 54.58 51.43 1ics n ASN 253 Cb 0.09 1.37 0.26 0.00 1.24 0.00 0.00 39.78 42.74 1ics n ASN 253 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1ics h PRO 254 N 3.61 0.46 -0.32 1.20 0.11 -1.83 -1.40 132.00 133.83 1ics h PRO 254 Ca -0.09 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.98 1ics h PRO 254 Cb 1.03 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.02 1ics h PRO 254 CO 0.30 0.31 0.14 1.15 -0.21 0.00 0.00 178.00 179.68 1ics h THR 255 N 0.48 1.17 -0.25 -1.15 2.02 -1.95 0.19 112.91 113.42 1ics h THR 255 Ca 0.50 -0.52 -0.16 0.00 0.77 0.00 0.00 66.41 67.01 1ics h THR 255 Cb 0.86 0.92 -0.01 0.00 -1.74 0.00 0.00 68.15 68.19 1ics h THR 255 CO -0.46 0.18 -0.49 0.00 0.37 0.00 0.00 175.52 175.13 1ics h ALA 256 N 0.99 0.68 -0.72 6.16 0.00 -1.89 -0.49 119.26 123.99 1ics h ALA 256 Ca 0.11 -0.49 -0.01 0.00 0.00 0.00 0.00 54.91 54.52 1ics h ALA 256 Cb 0.16 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1ics h ALA 256 CO -0.01 0.68 0.42 1.25 0.00 0.00 0.00 179.25 181.58 1ics h LEU 257 N 0.53 0.87 -0.35 0.00 5.85 -1.03 0.35 115.31 121.52 1ics h LEU 257 Ca 0.03 -0.07 -0.11 0.00 0.84 0.00 0.00 57.88 58.56 1ics h LEU 257 Cb 1.04 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.84 1ics h LEU 257 CO 0.10 0.69 -0.22 1.23 -0.34 0.00 0.00 178.44 179.90 1ics h GLY 258 N 0.98 0.84 1.25 3.75 0.00 -0.41 -2.39 103.07 107.09 1ics h GLY 258 Ca 0.26 -0.79 -0.10 0.00 0.00 0.00 0.00 47.33 46.70 1ics h GLY 258 CO -0.05 0.72 -0.08 -2.00 0.00 0.00 0.00 176.54 175.14 1ics h LEU 259 N 0.56 0.88 -0.12 3.11 5.85 -0.76 -2.03 115.31 122.80 1ics h LEU 259 Ca 0.07 -0.26 -0.00 0.00 0.84 0.00 0.00 57.88 58.53 1ics h LEU 259 Cb 0.78 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.57 1ics h LEU 259 CO 0.06 0.99 0.06 0.22 -0.34 0.00 0.00 178.44 179.43 1ics h TYR 260 N 0.81 0.17 0.00 1.25 3.20 -0.22 -1.98 116.97 120.19 1ics h TYR 260 Ca 0.14 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.00 1ics h TYR 260 Cb 0.59 -0.05 0.00 0.00 1.54 0.00 0.00 36.73 38.81 1ics h TYR 260 CO 0.03 0.21 -0.00 0.52 -1.64 0.00 0.00 178.16 177.29 1ics h MET 261 N 0.07 -0.00 -0.73 1.82 2.86 -1.31 -0.07 114.93 117.56 1ics h MET 261 Ca 0.04 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.66 1ics h MET 261 Cb 0.11 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.73 1ics h MET 261 CO -0.01 0.06 0.38 -0.39 1.06 0.00 0.00 176.91 178.01 1ics h VAL 262 N -0.06 1.23 -0.81 -2.22 -1.51 -1.35 0.21 116.25 111.75 1ics h VAL 262 Ca -0.00 -0.62 -0.04 0.00 -1.23 0.00 0.00 66.70 64.81 1ics h VAL 262 Cb 0.06 0.29 -0.04 0.00 -2.13 0.00 0.00 31.29 29.48 1ics h VAL 262 CO 0.00 0.27 0.34 -0.33 -1.23 0.00 0.00 177.57 176.61 1ics h GLU 263 N 1.02 1.20 0.00 5.19 5.08 -1.22 -1.73 114.58 124.12 1ics h GLU 263 Ca 0.26 -0.21 -0.04 0.00 -1.00 0.00 0.00 59.36 58.36 1ics h GLU 263 Cb 0.08 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.13 1ics h GLU 263 CO -0.04 0.96 -0.20 0.77 -1.00 0.00 0.00 179.01 179.50 1ics h SER 264 N 1.17 0.00 1.34 1.42 0.02 -0.36 -2.81 113.55 114.34 1ics h SER 264 Ca 0.27 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.22 1ics h SER 264 Cb 0.20 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.74 1ics h SER 264 CO -0.02 0.20 -0.16 -0.07 -1.14 0.00 0.00 176.83 175.64 1ics h LEU 265 N 0.00 0.00 -1.45 5.07 3.38 -0.06 -3.32 115.31 118.93 1ics h LEU 265 Ca -0.00 -0.05 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 1ics h LEU 265 Cb 0.61 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.34 1ics h LEU 265 CO 0.03 0.03 0.17 0.78 0.09 0.00 0.00 178.44 179.54 1ics h ASN 266 N 0.00 0.49 0.68 -0.43 2.35 -1.20 -2.10 115.58 115.37 1ics h ASN 266 Ca 0.00 -0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.71 1ics h ASN 266 Cb 0.75 -0.12 0.00 0.00 0.05 0.00 0.00 38.32 39.00 1ics h ASN 266 CO 0.00 0.43 0.00 0.07 -1.65 0.00 0.00 177.43 176.28 1ics h LYS 267 N 0.55 0.00 -0.00 0.81 2.10 -1.76 -3.17 116.57 115.10 1ics h LYS 267 Ca 0.14 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.79 1ics h LYS 267 Cb 0.08 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.41 1ics h LYS 267 CO -0.02 0.00 -0.36 0.66 -2.00 0.00 0.00 179.45 177.74 1ics n TYR 268 N -2.44 0.00 -3.71 0.07 4.02 -0.79 -4.98 117.16 109.32 1ics n TYR 268 Ca 0.01 0.00 -0.24 0.00 -0.01 0.00 0.00 57.90 57.66 1ics n TYR 268 Cb 0.22 -0.19 0.05 0.00 -0.02 0.00 0.00 39.34 39.39 1ics n TYR 268 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 176.86 172.38 1ics n ASP 269 N -1.09 -3.63 -4.69 7.72 -0.08 -1.20 -4.79 116.55 108.80 1ics n ASP 269 Ca 0.09 -0.72 -0.29 0.00 -1.51 0.00 0.00 54.79 52.37 1ics n ASP 269 Cb 0.34 -4.36 0.17 0.00 2.34 0.00 0.00 41.12 39.61 1ics n ASP 269 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 1ics s LEU 270 N -6.97 1.64 0.25 -2.67 1.43 -1.26 -3.98 118.68 107.12 1ics s LEU 270 Ca 0.35 1.14 0.11 0.00 -1.03 0.00 0.00 54.13 54.71 1ics s LEU 270 Cb -0.17 -3.34 0.23 0.00 0.03 0.00 0.00 46.19 42.94 1ics s LEU 270 CO 0.79 -3.07 1.53 0.00 0.23 0.00 0.00 176.35 175.83 1ics h ALA 271 N -1.85 0.78 0.00 4.21 0.00 -0.25 -3.44 119.26 118.71 1ics h ALA 271 Ca -0.54 -0.61 0.00 0.00 0.00 0.00 0.00 54.91 53.76 1ics h ALA 271 Cb 1.33 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1ics h ALA 271 CO 0.58 0.84 0.00 2.48 0.00 0.00 0.00 179.25 183.15 1ics n TYR 272 N -3.58 0.00 -4.71 0.00 0.18 -1.23 -3.66 117.16 104.16 1ics n TYR 272 Ca -0.00 0.00 -0.31 0.00 1.88 0.00 0.00 57.90 59.47 1ics n TYR 272 Cb 0.70 0.00 -0.17 0.00 -0.38 0.00 0.00 39.34 39.49 1ics n TYR 272 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 1ics s HIS 274 N 0.77 3.03 -0.03 0.00 2.46 -0.07 -0.18 115.29 121.27 1ics s HIS 274 Ca -0.10 -1.04 0.07 0.00 0.47 0.00 0.00 55.06 54.46 1ics s HIS 274 Cb -0.16 -2.14 -0.01 0.00 -0.13 0.00 0.00 32.58 30.14 1ics s HIS 274 CO 0.01 -0.58 -0.24 0.08 -2.47 0.00 0.00 174.74 171.54 1ics s VAL 275 N 1.46 1.94 -0.08 0.89 1.01 0.41 -0.97 120.40 125.06 1ics s VAL 275 Ca 0.04 -1.03 -0.20 0.00 0.00 0.00 0.00 61.98 60.79 1ics s VAL 275 Cb -0.15 -1.62 -0.04 0.00 0.00 0.00 0.00 36.38 34.56 1ics s VAL 275 CO -0.02 0.54 0.57 -0.69 0.00 0.00 0.00 175.10 175.50 1ics s VAL 276 N -0.39 5.08 0.50 2.92 1.01 -0.78 -2.82 120.40 125.92 1ics s VAL 276 Ca 0.04 1.16 -0.23 0.00 0.00 0.00 0.00 61.98 62.95 1ics s VAL 276 Cb -0.11 -3.90 -0.06 0.00 0.00 0.00 0.00 36.38 32.30 1ics s VAL 276 CO 0.01 0.33 1.30 -1.61 0.00 0.00 0.00 175.10 175.13 1ics s GLU 277 N 0.46 3.42 0.32 2.72 0.41 0.57 -4.77 118.70 121.83 1ics s GLU 277 Ca 0.30 2.11 -0.29 0.00 -0.41 0.00 0.00 54.97 56.69 1ics s GLU 277 Cb -0.17 -2.37 -0.10 0.00 -1.78 0.00 0.00 34.13 29.72 1ics s GLU 277 CO 0.14 -0.93 1.25 -1.25 -0.49 0.00 0.00 175.26 173.98 1ics s PRO 278 N -2.76 4.41 -0.03 0.39 0.04 -1.26 -4.87 135.00 130.91 1ics s PRO 278 Ca 0.67 2.09 0.02 0.00 0.04 0.00 0.00 61.00 63.82 1ics s PRO 278 Cb -0.37 -3.08 0.10 0.00 0.04 0.00 0.00 34.50 31.19 1ics s PRO 278 CO 0.45 -0.09 0.71 0.54 0.04 0.00 0.00 177.00 178.64 1ics n ARG 279 N 0.86 1.47 0.00 4.56 5.12 -1.26 -5.09 116.66 122.32 1ics n ARG 279 Ca -0.00 -0.41 0.00 0.00 -1.93 0.00 0.00 57.85 55.51 1ics n ARG 279 Cb 0.43 -1.56 0.00 0.00 -1.16 0.00 0.00 32.46 30.17 1ics n ARG 279 CO 0.00 0.00 0.00 2.41 -1.93 0.00 0.00 177.63 178.11 1ics n THR 290 N 0.10 0.00 -4.94 0.55 -1.04 -1.26 -5.20 114.28 102.50 1ics n THR 290 Ca 0.04 0.00 -0.33 0.00 -2.04 0.00 0.00 64.05 61.72 1ics n THR 290 Cb 0.40 0.00 -0.15 0.00 -1.82 0.00 0.00 70.33 68.76 1ics n THR 290 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1ics s GLU 291 N 0.00 3.21 0.07 -2.82 2.02 -1.26 -5.02 118.70 114.90 1ics s GLU 291 Ca 0.00 -0.75 -0.09 0.00 0.02 0.00 0.00 54.97 54.15 1ics s GLU 291 Cb 0.00 -2.50 0.00 0.00 0.10 0.00 0.00 34.13 31.73 1ics s GLU 291 CO 0.00 0.23 0.19 0.45 0.02 0.00 0.00 175.26 176.15 1ics s SER 292 N 0.28 0.09 -0.00 -0.19 0.15 -1.26 -4.91 113.70 107.86 1ics s SER 292 Ca -0.12 -0.55 0.21 0.00 0.70 0.00 0.00 55.95 56.19 1ics s SER 292 Cb -0.16 0.32 -0.23 0.00 -1.71 0.00 0.00 66.02 64.24 1ics s SER 292 CO 0.06 -0.67 0.89 0.18 1.20 0.00 0.00 173.24 174.91 1ics n LEU 293 N 0.20 0.99 -0.06 3.45 4.77 -1.26 -4.49 117.00 120.60 1ics n LEU 293 Ca -0.16 -0.50 -0.09 0.00 -0.03 0.00 0.00 56.01 55.23 1ics n LEU 293 Cb 0.61 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.67 1ics n LEU 293 CO 0.22 0.25 0.65 0.58 -1.33 0.00 0.00 177.39 177.76 1ics h VAL 294 N 0.00 0.27 -0.52 4.08 2.07 -1.95 0.24 116.25 120.44 1ics h VAL 294 Ca 0.00 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.61 1ics h VAL 294 Cb 0.50 0.27 -0.07 0.00 -1.52 0.00 0.00 31.29 30.47 1ics h VAL 294 CO 0.00 0.00 0.10 -0.65 0.02 0.00 0.00 177.57 177.04 1ics h PRO 295 N -0.32 0.23 -0.69 1.57 0.11 -1.99 0.15 132.00 131.06 1ics h PRO 295 Ca 0.13 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.23 1ics h PRO 295 Cb 0.53 -0.05 -0.03 0.00 0.11 0.00 0.00 31.00 31.56 1ics h PRO 295 CO -0.44 0.15 0.42 0.52 -0.21 0.00 0.00 178.00 178.44 1ics h MET 296 N 0.24 0.93 -0.91 1.05 2.86 -1.55 0.19 114.93 117.73 1ics h MET 296 Ca 0.26 -0.08 -0.00 0.00 -2.06 0.00 0.00 59.70 57.82 1ics h MET 296 Cb 0.36 -0.20 -0.04 0.00 0.06 0.00 0.00 31.60 31.78 1ics h MET 296 CO -0.35 0.66 0.56 -0.09 1.06 0.00 0.00 176.91 178.75 1ics h ARG 297 N 0.94 1.23 -0.42 1.72 1.12 0.46 0.77 114.38 120.20 1ics h ARG 297 Ca 0.25 -0.10 -0.13 0.00 -1.11 0.00 0.00 59.98 58.89 1ics h ARG 297 Cb -0.04 -0.26 -0.01 0.00 -0.01 0.00 0.00 29.97 29.65 1ics h ARG 297 CO -0.05 0.85 -0.23 0.87 -3.11 0.00 0.00 179.97 178.30 1ics h LYS 298 N 1.26 0.91 0.00 0.20 1.57 0.49 -3.13 116.57 117.87 1ics h LYS 298 Ca 0.33 -0.41 -0.04 0.00 -1.87 0.00 0.00 60.65 58.67 1ics h LYS 298 Cb -0.07 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.21 1ics h LYS 298 CO -0.06 1.06 -0.17 0.00 -0.57 0.00 0.00 179.45 179.71 1ics h ALA 299 N 0.82 0.91 -2.67 3.86 0.00 -0.24 -3.44 119.26 118.50 1ics h ALA 299 Ca 0.09 -0.15 -0.55 0.00 0.00 0.00 0.00 54.91 54.29 1ics h ALA 299 Cb 0.81 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.52 1ics h ALA 299 CO 0.07 0.21 0.12 -0.47 0.00 0.00 0.00 179.25 179.18 1ics s TYR 300 N -3.26 3.65 -1.62 0.00 6.04 0.23 -4.64 117.35 117.75 1ics s TYR 300 Ca 0.05 1.36 0.25 0.00 0.04 0.00 0.00 57.07 58.76 1ics s TYR 300 Cb 0.07 -2.81 0.53 0.00 -1.04 0.00 0.00 41.96 38.70 1ics s TYR 300 CO 0.67 0.18 1.42 1.63 -1.54 0.00 0.00 175.55 177.91 1ics n LYS 301 N 3.31 0.70 0.00 4.97 4.76 -1.26 -4.90 118.16 125.74 1ics n LYS 301 Ca -0.02 -0.46 0.00 0.00 -2.87 0.00 0.00 58.31 54.97 1ics n LYS 301 Cb 0.51 -1.49 0.00 0.00 -1.84 0.00 0.00 35.03 32.21 1ics n LYS 301 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1ics n GLY 302 N 1.39 3.63 3.69 0.72 0.00 -1.26 -5.06 105.19 108.31 1ics n GLY 302 Ca 0.10 -2.02 -0.42 0.00 0.00 0.00 0.00 46.02 43.67 1ics n GLY 302 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ics s THR 303 N 1.78 3.69 -0.25 2.61 2.01 -1.26 -4.93 115.64 119.29 1ics s THR 303 Ca 0.00 1.11 -0.07 0.00 0.31 0.00 0.00 61.69 63.04 1ics s THR 303 Cb 0.00 -3.71 -0.02 0.00 0.01 0.00 0.00 72.50 68.77 1ics s THR 303 CO 0.00 0.02 0.06 0.12 -0.69 0.00 0.00 174.62 174.12 1ics s PHE 304 N 2.10 3.07 -0.14 4.92 5.36 -1.26 -0.81 117.98 131.22 1ics s PHE 304 Ca 0.63 -0.51 -0.04 0.00 -0.96 0.00 0.00 56.93 56.06 1ics s PHE 304 Cb -0.32 -2.22 -0.03 0.00 -0.34 0.00 0.00 43.02 40.11 1ics s PHE 304 CO 0.27 -0.39 -0.02 0.42 -1.46 0.00 0.00 175.22 174.04 1ics s ILE 305 N 1.59 4.10 0.22 3.12 1.01 0.75 -0.82 121.20 131.17 1ics s ILE 305 Ca 0.06 -0.30 0.11 0.00 0.00 0.00 0.00 60.65 60.53 1ics s ILE 305 Cb -0.15 -2.78 -0.05 0.00 0.01 0.00 0.00 42.46 39.49 1ics s ILE 305 CO 0.03 0.52 -0.21 0.68 0.00 0.00 0.00 174.94 175.95 1ics s VAL 306 N 0.02 2.49 0.13 2.92 -7.23 -0.82 -0.44 120.40 117.47 1ics s VAL 306 Ca 0.02 -2.09 -0.20 0.00 -1.81 0.00 0.00 61.98 57.90 1ics s VAL 306 Cb -0.13 -2.23 0.05 0.00 0.56 0.00 0.00 36.38 34.63 1ics s VAL 306 CO 0.02 -0.19 0.49 0.00 -0.31 0.00 0.00 175.10 175.11 1ics s ALA 307 N -1.90 -1.24 0.00 1.32 0.00 -1.13 -1.01 121.76 117.80 1ics s ALA 307 Ca 0.24 0.24 0.00 0.00 0.00 0.00 0.00 51.96 52.44 1ics s ALA 307 Cb -0.07 0.74 0.00 0.00 0.00 0.00 0.00 23.12 23.78 1ics s ALA 307 CO 0.12 -0.68 0.00 0.41 0.00 0.00 0.00 175.76 175.61 1ics n GLY 308 N -0.22 1.68 1.90 0.00 0.00 -1.26 -0.31 105.19 106.98 1ics n GLY 308 Ca -0.17 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.20 1ics n GLY 308 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ics n GLY 309 N 0.00 0.44 3.88 -0.02 0.00 -1.26 -4.78 105.19 103.45 1ics n GLY 309 Ca 0.00 -0.80 -0.30 0.00 0.00 0.00 0.00 46.02 44.93 1ics n GLY 309 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ics s TYR 310 N -2.00 3.58 0.02 1.61 1.51 -1.26 -5.04 117.35 115.76 1ics s TYR 310 Ca 0.00 1.15 0.00 0.00 -1.01 0.00 0.00 57.07 57.21 1ics s TYR 310 Cb 0.00 -2.58 -0.00 0.00 -0.11 0.00 0.00 41.96 39.27 1ics s TYR 310 CO 0.00 -0.49 0.01 -0.40 -1.11 0.00 0.00 175.55 173.56 1ics n ASP 311 N -2.38 0.19 -0.19 2.29 5.68 -1.26 -4.97 116.55 115.91 1ics n ASP 311 Ca 0.04 -1.10 -0.09 0.00 -0.50 0.00 0.00 54.79 53.14 1ics n ASP 311 Cb 0.54 0.07 0.01 0.00 -1.14 0.00 0.00 41.12 40.61 1ics n ASP 311 CO 0.00 0.00 0.00 -0.09 -1.33 0.00 0.00 177.20 175.78 1ics h ARG 312 N 0.00 0.90 0.70 0.11 2.43 -1.99 -1.89 114.38 114.66 1ics h ARG 312 Ca -0.01 -0.24 -0.03 0.00 -0.81 0.00 0.00 59.98 58.88 1ics h ARG 312 Cb 0.06 -0.10 0.01 0.00 -0.42 0.00 0.00 29.97 29.51 1ics h ARG 312 CO 0.02 0.88 -0.34 1.49 -1.51 0.00 0.00 179.97 180.51 1ics h GLU 313 N 0.79 -0.91 0.00 0.20 4.81 -1.99 -2.09 114.58 115.39 1ics h GLU 313 Ca 0.16 0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.44 1ics h GLU 313 Cb 0.41 0.21 -0.00 0.00 0.63 0.00 0.00 28.75 30.00 1ics h GLU 313 CO 0.01 -0.58 -0.07 -0.44 -0.73 0.00 0.00 179.01 177.20 1ics h ASP 314 N -1.10 0.00 0.42 1.04 3.32 -1.96 -1.26 116.42 116.88 1ics h ASP 314 Ca -0.10 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.93 1ics h ASP 314 Cb 0.75 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.31 1ics h ASP 314 CO 0.16 0.07 -0.20 1.23 -1.72 0.00 0.00 179.24 178.78 1ics h GLY 315 N 0.24 -0.59 0.50 2.75 0.00 -1.25 -1.15 103.07 103.56 1ics h GLY 315 Ca -0.00 0.22 0.09 0.00 0.00 0.00 0.00 47.33 47.64 1ics h GLY 315 CO 0.01 -0.21 0.35 3.43 0.00 0.00 0.00 176.54 180.12 1ics h ASN 316 N -0.85 0.46 -0.48 0.19 2.35 -1.02 -2.07 115.58 114.16 1ics h ASN 316 Ca -0.06 0.06 -0.06 0.00 -0.55 0.00 0.00 56.30 55.69 1ics h ASN 316 Cb 0.55 -0.02 -0.02 0.00 0.05 0.00 0.00 38.32 38.88 1ics h ASN 316 CO 0.09 0.27 0.10 -0.09 -1.65 0.00 0.00 177.43 176.16 1ics h ARG 317 N 0.61 0.84 -0.46 0.81 2.43 -1.19 -1.50 114.38 115.91 1ics h ARG 317 Ca 0.34 -0.18 -0.11 0.00 -0.81 0.00 0.00 59.98 59.21 1ics h ARG 317 Cb 0.34 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.76 1ics h ARG 317 CO -0.26 0.77 -0.17 0.00 -1.51 0.00 0.00 179.97 178.81 1ics h ALA 318 N 1.31 0.84 -0.03 2.80 0.00 -0.55 0.12 119.26 123.76 1ics h ALA 318 Ca 0.17 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 1ics h ALA 318 Cb 0.33 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 1ics h ALA 318 CO 0.00 0.65 -0.00 -0.07 0.00 0.00 0.00 179.25 179.83 1ics h LEU 319 N 0.78 0.05 -0.58 0.00 3.38 -1.14 0.30 115.31 118.09 1ics h LEU 319 Ca 0.12 -0.32 0.00 0.00 0.09 0.00 0.00 57.88 57.76 1ics h LEU 319 Cb 0.70 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.41 1ics h LEU 319 CO 0.05 0.36 0.36 0.40 0.09 0.00 0.00 178.44 179.70 1ics h ILE 320 N -0.27 1.16 -0.03 1.22 1.08 -1.20 -2.24 117.51 117.24 1ics h ILE 320 Ca 0.01 -0.34 0.00 0.00 -0.39 0.00 0.00 64.86 64.14 1ics h ILE 320 Cb 0.34 0.35 0.00 0.00 -3.07 0.00 0.00 36.82 34.43 1ics h ILE 320 CO 0.00 0.16 0.00 -0.62 -0.69 0.00 0.00 178.15 177.01 1ics n GLU 321 N -4.65 1.17 -2.87 2.37 1.02 0.02 -4.86 120.64 112.84 1ics n GLU 321 Ca 0.04 -0.15 -0.21 0.00 -0.02 0.00 0.00 57.16 56.82 1ics n GLU 321 Cb 0.04 -1.43 0.01 0.00 -0.02 0.00 0.00 31.44 30.04 1ics n GLU 321 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1ics n ASP 322 N -0.06 -5.40 -0.23 1.62 2.03 -0.84 -4.89 116.55 108.78 1ics n ASP 322 Ca 0.01 -0.18 0.12 0.00 0.52 0.00 0.00 54.79 55.26 1ics n ASP 322 Cb 0.24 -4.43 0.26 0.00 -0.72 0.00 0.00 41.12 36.48 1ics n ASP 322 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1ics n ARG 323 N -3.60 0.71 -3.59 -0.67 1.74 0.10 -4.97 116.66 106.38 1ics n ARG 323 Ca -0.13 -0.47 -0.04 0.00 -0.77 0.00 0.00 57.85 56.44 1ics n ARG 323 Cb 0.62 -1.49 -0.02 0.00 -1.02 0.00 0.00 32.46 30.55 1ics n ARG 323 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ics s ALA 324 N -2.61 -2.07 -0.10 7.54 0.00 -1.22 -4.90 121.76 118.40 1ics s ALA 324 Ca 0.20 1.52 0.18 0.00 0.00 0.00 0.00 51.96 53.86 1ics s ALA 324 Cb 0.19 -0.06 -0.26 0.00 0.00 0.00 0.00 23.12 22.98 1ics s ALA 324 CO 0.58 -0.62 0.25 -0.25 0.00 0.00 0.00 175.76 175.72 1ics n ASP 325 N -0.12 0.54 -3.90 0.00 8.00 -0.00 -4.46 116.55 116.62 1ics n ASP 325 Ca -0.00 0.00 -0.11 0.00 0.71 0.00 0.00 54.79 55.39 1ics n ASP 325 Cb 0.59 1.44 -0.12 0.00 -0.02 0.00 0.00 41.12 43.00 1ics n ASP 325 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1ics s LEU 326 N -4.82 1.94 -0.17 0.64 1.43 -1.02 -4.85 118.68 111.83 1ics s LEU 326 Ca -0.08 -0.13 0.01 0.00 -1.03 0.00 0.00 54.13 52.89 1ics s LEU 326 Cb 0.09 0.18 0.02 0.00 0.03 0.00 0.00 46.19 46.51 1ics s LEU 326 CO 0.78 -0.14 -0.18 -0.69 0.23 0.00 0.00 176.35 176.34 1ics s VAL 327 N -0.59 1.91 0.01 -1.59 1.01 -0.65 -1.94 120.40 118.55 1ics s VAL 327 Ca -0.07 -0.85 -0.16 0.00 0.00 0.00 0.00 61.98 60.90 1ics s VAL 327 Cb -0.04 -1.74 -0.06 0.00 0.00 0.00 0.00 36.38 34.54 1ics s VAL 327 CO -0.00 0.52 0.46 0.00 0.00 0.00 0.00 175.10 176.08 1ics s ALA 328 N 1.34 3.64 -0.06 5.51 0.00 -0.18 -0.97 121.76 131.04 1ics s ALA 328 Ca 0.05 -0.14 0.05 0.00 0.00 0.00 0.00 51.96 51.93 1ics s ALA 328 Cb -0.13 -2.49 -0.01 0.00 0.00 0.00 0.00 23.12 20.49 1ics s ALA 328 CO -0.12 0.41 -0.23 0.71 0.00 0.00 0.00 175.76 176.53 1ics s TYR 329 N -0.92 2.49 0.00 0.00 2.02 0.79 -4.38 117.35 117.36 1ics s TYR 329 Ca 0.26 -0.65 0.00 0.00 -0.37 0.00 0.00 57.07 56.30 1ics s TYR 329 Cb -0.17 -1.62 0.00 0.00 -0.40 0.00 0.00 41.96 39.77 1ics s TYR 329 CO 0.15 -0.17 0.00 0.41 -1.57 0.00 0.00 175.55 174.37 1ics n GLY 330 N 2.91 -0.05 0.27 0.71 0.00 -1.26 -1.20 105.19 106.58 1ics n GLY 330 Ca -0.17 0.00 0.05 0.00 0.00 0.00 0.00 46.02 45.90 1ics n GLY 330 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1ics h ARG 331 N 0.00 0.13 0.00 1.61 3.08 -1.97 1.00 114.38 118.22 1ics h ARG 331 Ca 0.00 -0.01 -0.05 0.00 0.07 0.00 0.00 59.98 59.99 1ics h ARG 331 Cb 0.00 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 1ics h ARG 331 CO 0.00 0.09 -0.23 -0.07 -1.07 0.00 0.00 179.97 178.69 1ics h LEU 332 N 0.14 0.00 -0.37 3.04 3.38 -1.93 -1.67 115.31 117.89 1ics h LEU 332 Ca 0.41 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.36 1ics h LEU 332 Cb 0.71 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.46 1ics h LEU 332 CO -0.62 0.23 -0.07 0.15 0.09 0.00 0.00 178.44 178.22 1ics h PHE 333 N 0.00 0.00 -0.04 1.13 3.04 -1.06 -0.80 116.94 119.20 1ics h PHE 333 Ca -0.00 0.00 -0.01 0.00 3.98 0.00 0.00 57.97 61.94 1ics h PHE 333 Cb 0.41 0.00 -0.00 0.00 2.56 0.00 0.00 35.95 38.92 1ics h PHE 333 CO 0.00 0.07 -0.02 0.82 -2.02 0.00 0.00 178.31 177.16 1ics h ILE 334 N 0.00 1.31 0.00 1.41 2.04 -0.51 -3.29 117.51 118.47 1ics h ILE 334 Ca -0.00 -0.96 0.00 0.00 1.00 0.00 0.00 64.86 64.90 1ics h ILE 334 Cb 0.93 1.86 0.00 0.00 -0.74 0.00 0.00 36.82 38.87 1ics h ILE 334 CO 0.01 0.26 -0.49 -1.54 0.00 0.00 0.00 178.15 176.38 1ics n SER 335 N -4.83 0.59 -3.91 1.72 3.41 -1.09 -4.63 113.62 104.88 1ics n SER 335 Ca -0.07 0.08 -0.30 0.00 -0.26 0.00 0.00 58.87 58.32 1ics n SER 335 Cb 0.23 0.06 -0.14 0.00 -0.26 0.00 0.00 64.21 64.09 1ics n SER 335 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1ics s ASN 336 N -3.80 4.37 0.39 4.04 -0.87 -0.31 -4.60 114.94 114.16 1ics s ASN 336 Ca 0.09 -2.34 0.12 0.00 -1.57 0.00 0.00 52.86 49.15 1ics s ASN 336 Cb 0.15 -1.41 0.91 0.00 -0.02 0.00 0.00 41.25 40.88 1ics s ASN 336 CO 0.69 -0.33 1.90 -0.65 -2.57 0.00 0.00 177.10 176.13 1ics h PRO 337 N 7.30 0.56 -2.07 -0.60 0.11 -1.80 -2.31 132.00 133.19 1ics h PRO 337 Ca -0.06 -0.03 -0.72 0.00 0.11 0.00 0.00 66.00 65.30 1ics h PRO 337 Cb 0.97 -0.13 -0.33 0.00 0.11 0.00 0.00 31.00 31.63 1ics h PRO 337 CO 0.55 0.37 0.40 -0.40 -0.21 0.00 0.00 178.00 178.71 1ics n ASP 338 N -4.52 6.37 -0.14 -2.05 5.75 -1.26 -4.02 116.55 116.69 1ics n ASP 338 Ca 0.16 -3.74 -0.07 0.00 -0.01 0.00 0.00 54.79 51.13 1ics n ASP 338 Cb 0.48 -0.90 0.01 0.00 -1.03 0.00 0.00 41.12 39.68 1ics n ASP 338 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 1ics h LEU 339 N 3.36 0.48 -0.11 -2.12 6.46 -1.76 -1.88 115.31 119.75 1ics h LEU 339 Ca 0.42 -0.01 0.03 0.00 -0.12 0.00 0.00 57.88 58.21 1ics h LEU 339 Cb 0.37 -0.11 -0.04 0.00 -0.73 0.00 0.00 40.66 40.15 1ics h LEU 339 CO 1.12 0.34 -0.11 -0.65 -0.62 0.00 0.00 178.44 178.53 1ics h PRO 340 N 0.57 -0.13 -0.70 5.25 0.11 -1.89 -1.42 132.00 133.79 1ics h PRO 340 Ca 0.16 0.01 0.05 0.00 0.11 0.00 0.00 66.00 66.33 1ics h PRO 340 Cb -0.05 0.03 -0.05 0.00 0.11 0.00 0.00 31.00 31.04 1ics h PRO 340 CO -0.04 -0.09 0.41 -0.22 -0.21 0.00 0.00 178.00 177.85 1ics h LYS 341 N -0.13 0.74 -0.52 1.05 1.63 -1.93 0.40 116.57 117.82 1ics h LYS 341 Ca 0.08 -0.04 -0.05 0.00 -0.85 0.00 0.00 60.65 59.78 1ics h LYS 341 Cb 0.24 -0.17 -0.02 0.00 -0.60 0.00 0.00 32.23 31.68 1ics h LYS 341 CO -0.19 0.49 0.12 0.00 -3.45 0.00 0.00 179.45 176.42 1ics h ARG 342 N 0.76 0.79 -0.29 1.90 3.08 -0.95 -1.90 114.38 117.78 1ics h ARG 342 Ca 0.31 -0.16 -0.18 0.00 0.07 0.00 0.00 59.98 60.01 1ics h ARG 342 Cb 0.15 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 30.08 1ics h ARG 342 CO -0.17 0.72 -0.54 0.74 -1.07 0.00 0.00 179.97 179.65 1ics h PHE 343 N 0.76 1.08 0.00 3.04 0.04 -0.64 0.37 116.94 121.60 1ics h PHE 343 Ca 0.17 -0.38 0.00 0.00 2.80 0.00 0.00 57.97 60.55 1ics h PHE 343 Cb 0.30 -0.20 0.00 0.00 2.20 0.00 0.00 35.95 38.24 1ics h PHE 343 CO 0.02 1.21 0.00 -1.91 -0.60 0.00 0.00 178.31 177.03 1ics n GLU 344 N -4.01 0.16 0.00 1.51 2.13 0.07 -1.85 120.64 118.66 1ics n GLU 344 Ca -0.04 0.49 0.00 0.00 0.66 0.00 0.00 57.16 58.27 1ics n GLU 344 Cb 0.62 -1.87 0.00 0.00 0.27 0.00 0.00 31.44 30.46 1ics n GLU 344 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 1ics n LEU 345 N -2.19 0.71 -3.87 4.31 4.77 -0.76 -4.93 117.00 115.03 1ics n LEU 345 Ca 0.01 -0.77 -0.25 0.00 -0.03 0.00 0.00 56.01 54.97 1ics n LEU 345 Cb 0.15 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.24 1ics n LEU 345 CO 0.15 0.18 -0.19 -3.20 -1.33 0.00 0.00 177.39 173.00 1ics n ASN 346 N -0.13 -0.84 -4.95 -1.43 5.15 0.10 -4.96 115.26 108.21 1ics n ASN 346 Ca 0.00 -0.96 -0.23 0.00 -0.60 0.00 0.00 54.58 52.78 1ics n ASN 346 Cb 0.03 -3.31 0.00 0.00 -0.53 0.00 0.00 39.78 35.98 1ics n ASN 346 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1ics s ALA 347 N -3.86 3.73 0.92 5.20 0.00 0.31 -5.02 121.76 123.04 1ics s ALA 347 Ca 0.03 -0.99 -0.11 0.00 0.00 0.00 0.00 51.96 50.90 1ics s ALA 347 Cb -0.01 -2.14 0.13 0.00 0.00 0.00 0.00 23.12 21.10 1ics s ALA 347 CO 0.87 -0.24 1.02 -2.30 0.00 0.00 0.00 175.76 175.11 1ics n PRO 348 N -1.97 -0.41 -5.15 0.00 -0.02 -1.26 -4.80 135.00 121.38 1ics n PRO 348 Ca -0.01 -0.06 -0.31 0.00 -2.02 0.00 0.00 63.50 61.10 1ics n PRO 348 Cb 0.57 -2.29 -0.15 0.00 -0.02 0.00 0.00 33.50 31.61 1ics n PRO 348 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1ics s LEU 349 N -5.61 2.19 0.41 2.45 1.43 -1.26 -5.00 118.68 113.30 1ics s LEU 349 Ca 0.65 -0.45 -0.25 0.00 -1.03 0.00 0.00 54.13 53.05 1ics s LEU 349 Cb -0.23 -1.37 -0.08 0.00 0.03 0.00 0.00 46.19 44.54 1ics s LEU 349 CO 0.59 0.31 1.22 0.20 0.23 0.00 0.00 176.35 178.91 1ics s ASN 350 N -0.77 6.38 0.51 2.29 0.01 -1.26 -5.00 114.94 117.10 1ics s ASN 350 Ca 0.11 2.47 -0.18 0.00 -0.71 0.00 0.00 52.86 54.55 1ics s ASN 350 Cb -0.10 -2.62 -0.08 0.00 0.41 0.00 0.00 41.25 38.86 1ics s ASN 350 CO 0.00 -0.79 1.00 -0.54 -1.51 0.00 0.00 177.10 175.27 1ics s LYS 351 N -2.32 3.84 0.02 -0.60 -0.14 -1.26 -4.71 119.74 114.57 1ics s LYS 351 Ca 0.58 1.09 -0.00 0.00 -1.36 0.00 0.00 55.97 56.28 1ics s LYS 351 Cb -0.34 -2.12 -0.04 0.00 -1.68 0.00 0.00 37.83 33.66 1ics s LYS 351 CO 0.42 -0.37 0.11 1.52 -0.76 0.00 0.00 175.35 176.28 1ics s TYR 352 N -2.43 3.34 -0.47 3.18 -0.85 -1.26 -4.83 117.35 114.04 1ics s TYR 352 Ca 0.62 0.22 -0.09 0.00 -0.52 0.00 0.00 57.07 57.30 1ics s TYR 352 Cb -0.12 -1.74 0.12 0.00 0.38 0.00 0.00 41.96 40.60 1ics s TYR 352 CO 0.28 0.57 0.34 1.21 -1.52 0.00 0.00 175.55 176.43 1ics s ASN 353 N -1.96 5.68 0.37 -0.18 3.04 -1.26 -4.94 114.94 115.68 1ics s ASN 353 Ca 0.26 -1.95 0.24 0.00 0.04 0.00 0.00 52.86 51.45 1ics s ASN 353 Cb -0.12 -2.00 1.33 0.00 -1.54 0.00 0.00 41.25 38.92 1ics s ASN 353 CO 0.18 -0.68 1.74 0.08 -3.04 0.00 0.00 177.10 175.38 1ics h ARG 354 N 8.38 0.00 0.00 0.43 0.11 -2.01 -1.94 114.38 119.36 1ics h ARG 354 Ca -0.20 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 59.85 1ics h ARG 354 Cb 1.07 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.14 1ics h ARG 354 CO 0.85 0.00 -0.15 -0.44 0.10 0.00 0.00 179.97 180.32 1ics h ASP 355 N 0.00 0.00 -0.21 0.08 3.32 -1.96 -2.94 116.42 114.71 1ics h ASP 355 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1ics h ASP 355 Cb 0.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.59 1ics h ASP 355 CO 0.00 0.15 0.00 0.35 -1.72 0.00 0.00 179.24 178.02 1ics n THR 356 N -3.41 2.06 -0.00 0.35 -2.24 -0.73 -4.49 114.28 105.81 1ics n THR 356 Ca -0.01 -1.86 -0.12 0.00 -2.27 0.00 0.00 64.05 59.79 1ics n THR 356 Cb 0.34 -0.17 -0.08 0.00 -2.10 0.00 0.00 70.33 68.32 1ics n THR 356 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 1ics h PHE 357 N 1.40 0.07 -0.33 4.78 0.04 -1.58 -3.30 116.94 118.01 1ics h PHE 357 Ca 0.00 -0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.76 1ics h PHE 357 Cb 1.27 -0.02 0.00 0.00 2.20 0.00 0.00 35.95 39.40 1ics h PHE 357 CO 0.36 0.28 0.00 0.66 -0.60 0.00 0.00 178.31 179.01 1ics n TYR 358 N -4.93 0.64 -1.71 -0.55 4.01 -1.26 -4.57 117.16 108.79 1ics n TYR 358 Ca -0.07 -0.62 -0.31 0.00 -0.16 0.00 0.00 57.90 56.75 1ics n TYR 358 Cb 0.15 -0.12 0.05 0.00 -0.31 0.00 0.00 39.34 39.10 1ics n TYR 358 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 1ics s THR 359 N -1.59 3.87 -2.35 -0.72 -4.23 -1.24 -4.78 115.64 104.59 1ics s THR 359 Ca 0.30 0.61 0.21 0.00 -1.18 0.00 0.00 61.69 61.63 1ics s THR 359 Cb 0.19 -3.47 0.44 0.00 1.34 0.00 0.00 72.50 71.01 1ics s THR 359 CO 0.14 -0.79 1.45 -1.54 -0.54 0.00 0.00 174.62 173.34 1ics n SER 360 N -3.08 2.76 -4.76 3.99 3.41 -1.26 -4.72 113.62 109.96 1ics n SER 360 Ca 0.07 -1.90 -0.41 0.00 -0.26 0.00 0.00 58.87 56.37 1ics n SER 360 Cb 0.55 -0.21 -0.03 0.00 -0.26 0.00 0.00 64.21 64.26 1ics n SER 360 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1ics s ASP 361 N -1.45 6.86 0.60 4.04 2.15 -1.26 -4.88 116.67 122.73 1ics s ASP 361 Ca 0.36 2.56 0.38 0.00 0.43 0.00 0.00 52.55 56.28 1ics s ASP 361 Cb 0.20 -2.63 1.89 0.00 -0.30 0.00 0.00 42.92 42.08 1ics s ASP 361 CO 0.29 -0.50 2.19 -0.65 -0.17 0.00 0.00 175.17 176.33 1ics h PRO 362 N 4.06 0.00 0.00 4.34 0.11 -1.94 -3.38 132.00 135.19 1ics h PRO 362 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1ics h PRO 362 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1ics h PRO 362 CO 0.70 0.02 0.00 -0.89 -0.21 0.00 0.00 178.00 177.61 1ics n ILE 363 N -3.18 1.08 -1.51 4.15 5.41 -1.26 -4.66 119.36 119.39 1ics n ILE 363 Ca -0.01 0.36 -0.49 0.00 1.00 0.00 0.00 62.75 63.60 1ics n ILE 363 Cb 0.18 -1.47 -0.06 0.00 -0.71 0.00 0.00 39.64 37.58 1ics n ILE 363 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07 1ics n VAL 364 N -3.45 0.26 -0.77 1.39 0.31 -1.26 -0.49 118.33 114.32 1ics n VAL 364 Ca 0.00 -0.28 0.00 0.00 -0.01 0.00 0.00 64.34 64.05 1ics n VAL 364 Cb 0.00 -1.84 0.00 0.00 -0.91 0.00 0.00 33.84 31.09 1ics n VAL 364 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1ics n GLY 365 N 6.09 0.69 0.95 2.92 0.00 -1.26 -4.68 105.19 109.89 1ics n GLY 365 Ca 0.36 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.38 1ics n GLY 365 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1ics n TYR 366 N -2.57 0.00 -0.43 1.61 9.36 0.36 -4.77 117.16 120.72 1ics n TYR 366 Ca 0.00 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.22 1ics n TYR 366 Cb 0.00 0.06 0.00 0.00 -0.63 0.00 0.00 39.34 38.77 1ics n TYR 366 CO 0.00 0.00 0.00 0.25 0.22 0.00 0.00 176.86 177.33 1ics n THR 367 N -2.83 0.08 1.19 2.97 -2.24 -0.33 -4.77 114.28 108.35 1ics n THR 367 Ca 0.00 -0.32 0.08 0.00 -2.27 0.00 0.00 64.05 61.54 1ics n THR 367 Cb 0.43 1.34 0.29 0.00 -2.10 0.00 0.00 70.33 70.28 1ics n THR 367 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1ics n ASP 368 N -0.04 1.54 -4.70 3.42 5.75 -1.20 -4.84 116.55 116.49 1ics n ASP 368 Ca 0.00 -1.81 -0.42 0.00 -0.01 0.00 0.00 54.79 52.55 1ics n ASP 368 Cb 0.14 -0.14 -0.03 0.00 -1.03 0.00 0.00 41.12 40.06 1ics n ASP 368 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 1ics s TYR 369 N -1.72 3.42 0.60 2.11 2.02 -1.26 -4.99 117.35 117.52 1ics s TYR 369 Ca 0.27 1.40 -0.17 0.00 -0.37 0.00 0.00 57.07 58.20 1ics s TYR 369 Cb 0.14 -3.33 -0.03 0.00 -0.40 0.00 0.00 41.96 38.34 1ics s TYR 369 CO 0.21 -0.88 1.09 -1.25 -1.57 0.00 0.00 175.55 173.14 1ics s PRO 370 N 1.54 3.19 0.53 -1.71 0.04 -1.26 -4.67 135.00 132.66 1ics s PRO 370 Ca 0.55 1.36 -0.02 0.00 0.04 0.00 0.00 61.00 62.93 1ics s PRO 370 Cb -0.25 -2.00 0.01 0.00 0.04 0.00 0.00 34.50 32.30 1ics s PRO 370 CO 0.25 -0.93 0.79 -0.06 0.04 0.00 0.00 177.00 177.09 1ics s PHE 371 N -2.24 3.14 -1.39 0.56 0.40 -1.26 -4.54 117.98 112.65 1ics s PHE 371 Ca 0.67 0.33 0.00 0.00 -0.60 0.00 0.00 56.93 57.33 1ics s PHE 371 Cb -0.19 -2.60 0.00 0.00 0.51 0.00 0.00 43.02 40.74 1ics s PHE 371 CO 0.35 -0.68 0.35 1.28 0.70 0.00 0.00 175.22 177.21