#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i0b s SER 5 N 0.00 4.94 0.26 2.89 0.15 -1.26 -1.50 113.70 119.18 2i0b s SER 5 Ca 0.00 -0.13 0.11 0.00 0.70 0.00 0.00 55.95 56.63 2i0b s SER 5 Cb 0.00 -1.83 -0.05 0.00 -1.71 0.00 0.00 66.02 62.43 2i0b s SER 5 CO 0.00 0.13 -0.18 -0.76 1.20 0.00 0.00 173.24 173.63 2i0b s LEU 6 N 0.63 2.58 -0.24 3.45 1.43 0.25 -4.96 118.68 121.82 2i0b s LEU 6 Ca -0.01 -1.03 -0.08 0.00 -1.03 0.00 0.00 54.13 51.98 2i0b s LEU 6 Cb -0.14 -0.97 -0.04 0.00 0.03 0.00 0.00 46.19 45.08 2i0b s LEU 6 CO 0.02 -0.03 0.09 -0.63 0.23 0.00 0.00 176.35 176.03 2i0b s ILE 7 N -2.65 4.60 -0.19 -0.59 -1.09 -1.26 -1.13 121.20 118.89 2i0b s ILE 7 Ca 0.28 -0.08 -0.03 0.00 -2.23 0.00 0.00 60.65 58.60 2i0b s ILE 7 Cb -0.03 -3.15 -0.01 0.00 -1.58 0.00 0.00 42.46 37.69 2i0b s ILE 7 CO 0.13 0.34 -0.08 -0.69 -1.23 0.00 0.00 174.94 173.41 2i0b s VAL 8 N 1.40 3.20 0.14 2.92 1.01 0.10 -0.54 120.40 128.62 2i0b s VAL 8 Ca 0.06 -0.57 -0.07 0.00 0.00 0.00 0.00 61.98 61.40 2i0b s VAL 8 Cb -0.15 -2.42 -0.06 0.00 0.00 0.00 0.00 36.38 33.75 2i0b s VAL 8 CO 0.05 0.46 0.41 0.28 0.00 0.00 0.00 175.10 176.30 2i0b s THR 9 N 1.14 5.10 0.22 3.92 -1.32 0.21 -0.15 115.64 124.77 2i0b s THR 9 Ca 0.01 0.24 -0.05 0.00 -1.21 0.00 0.00 61.69 60.68 2i0b s THR 9 Cb -0.14 -3.63 0.02 0.00 -1.51 0.00 0.00 72.50 67.24 2i0b s THR 9 CO -0.02 0.10 0.39 1.07 -2.21 0.00 0.00 174.62 173.95 2i0b n THR 10 N 0.31 0.00 -3.85 5.08 5.66 -0.65 -1.74 114.28 119.09 2i0b n THR 10 Ca -0.04 -0.79 -0.12 0.00 -3.05 0.00 0.00 64.05 60.06 2i0b n THR 10 Cb 0.52 0.62 -0.10 0.00 -1.55 0.00 0.00 70.33 69.81 2i0b n THR 10 CO 0.00 0.00 0.00 -0.51 -3.05 0.00 0.00 175.07 171.51 2i0b s ILE 11 N -2.55 0.06 -0.02 1.09 2.07 -1.26 -0.84 121.20 119.75 2i0b s ILE 11 Ca 0.13 -0.52 -0.30 0.00 -1.41 0.00 0.00 60.65 58.55 2i0b s ILE 11 Cb -0.02 -0.41 -0.05 0.00 0.13 0.00 0.00 42.46 42.11 2i0b s ILE 11 CO 0.09 -0.29 1.35 -0.76 -1.91 0.00 0.00 174.94 173.43 2i0b s LEU 12 N -1.05 4.30 -0.30 8.50 1.43 -1.26 -4.60 118.68 125.70 2i0b s LEU 12 Ca -0.11 2.02 -0.09 0.00 -1.03 0.00 0.00 54.13 54.92 2i0b s LEU 12 Cb -0.06 -3.56 0.17 0.00 0.03 0.00 0.00 46.19 42.77 2i0b s LEU 12 CO 0.01 -0.69 0.78 -0.70 0.23 0.00 0.00 176.35 175.98 2i0b s GLU 13 N 2.46 0.44 0.29 1.70 2.56 0.33 -4.98 118.70 121.51 2i0b s GLU 13 Ca 0.62 0.94 -0.29 0.00 0.00 0.00 0.00 54.97 56.24 2i0b s GLU 13 Cb -0.29 0.55 -0.10 0.00 2.00 0.00 0.00 34.13 36.29 2i0b s GLU 13 CO 0.25 -0.32 1.13 -2.00 -0.56 0.00 0.00 175.26 173.76 2i0b s GLU 14 N 2.79 4.57 -0.29 4.30 2.12 -1.26 -0.82 118.70 130.11 2i0b s GLU 14 Ca 0.05 1.85 0.11 0.00 0.36 0.00 0.00 54.97 57.34 2i0b s GLU 14 Cb -0.11 -3.13 0.78 0.00 0.26 0.00 0.00 34.13 31.92 2i0b s GLU 14 CO -0.18 0.13 1.79 -0.35 -0.54 0.00 0.00 175.26 176.11 2i0b n PRO 15 N 1.06 4.21 0.04 4.30 -0.04 -1.26 -4.90 135.00 138.41 2i0b n PRO 15 Ca -0.01 -3.10 -0.20 0.00 -0.04 0.00 0.00 63.50 60.16 2i0b n PRO 15 Cb 0.45 -2.24 -0.14 0.00 -0.04 0.00 0.00 33.50 31.52 2i0b n PRO 15 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 2i0b h TYR 16 N 3.21 0.60 -2.60 0.54 -1.99 -1.32 -0.45 116.97 114.96 2i0b h TYR 16 Ca 0.16 -0.40 -0.12 0.00 2.00 0.00 0.00 58.73 60.38 2i0b h TYR 16 Cb 2.21 -0.04 -0.28 0.00 2.00 0.00 0.00 36.73 40.63 2i0b h TYR 16 CO 1.22 1.28 -0.36 0.08 -0.00 0.00 0.00 178.16 180.38 2i0b s VAL 17 N -2.68 -0.42 0.15 -2.88 1.01 -0.20 -0.74 120.40 114.65 2i0b s VAL 17 Ca -0.13 0.16 -0.04 0.00 0.00 0.00 0.00 61.98 61.97 2i0b s VAL 17 Cb 0.02 -0.62 -0.03 0.00 0.00 0.00 0.00 36.38 35.75 2i0b s VAL 17 CO 0.84 0.06 0.15 -0.76 0.00 0.00 0.00 175.10 175.39 2i0b s LEU 18 N 2.18 1.42 0.05 3.92 1.02 0.12 -0.51 118.68 126.88 2i0b s LEU 18 Ca -0.04 -1.11 -0.29 0.00 0.02 0.00 0.00 54.13 52.71 2i0b s LEU 18 Cb -0.11 0.62 -0.05 0.00 0.02 0.00 0.00 46.19 46.68 2i0b s LEU 18 CO -0.12 -0.80 0.93 -0.36 0.02 0.00 0.00 176.35 176.01 2i0b s PHE 19 N -4.03 3.73 0.49 0.29 0.40 -1.26 -1.37 117.98 116.23 2i0b s PHE 19 Ca 0.23 1.69 -0.23 0.00 -0.60 0.00 0.00 56.93 58.02 2i0b s PHE 19 Cb 0.06 -3.04 -0.06 0.00 0.51 0.00 0.00 43.02 40.49 2i0b s PHE 19 CO 0.02 0.12 1.27 0.15 0.70 0.00 0.00 175.22 177.49 2i0b s LYS 20 N 0.43 3.52 -0.16 0.44 1.02 0.11 -4.85 119.74 120.25 2i0b s LYS 20 Ca 0.47 2.04 -0.21 0.00 0.02 0.00 0.00 55.97 58.30 2i0b s LYS 20 Cb -0.22 -2.40 -0.03 0.00 -0.52 0.00 0.00 37.83 34.66 2i0b s LYS 20 CO 0.28 -0.82 0.64 0.15 -0.92 0.00 0.00 175.35 174.67 2i0b s LYS 21 N -2.71 4.27 -0.02 1.68 1.02 -1.26 -5.00 119.74 117.71 2i0b s LYS 21 Ca 0.66 0.67 -0.13 0.00 0.02 0.00 0.00 55.97 57.19 2i0b s LYS 21 Cb -0.35 -3.54 0.02 0.00 -0.52 0.00 0.00 37.83 33.44 2i0b s LYS 21 CO 0.43 -0.15 0.28 0.45 -0.92 0.00 0.00 175.35 175.45 2i0b s SER 22 N 1.06 -0.17 -0.00 2.83 0.15 -1.26 -5.06 113.70 111.25 2i0b s SER 22 Ca 0.31 0.09 -0.22 0.00 0.70 0.00 0.00 55.95 56.83 2i0b s SER 22 Cb -0.16 0.33 -0.19 0.00 -1.71 0.00 0.00 66.02 64.29 2i0b s SER 22 CO 0.12 -0.40 1.21 -0.78 1.20 0.00 0.00 173.24 174.59 2i0b h ASP 23 N 4.11 0.29 -3.28 5.45 3.58 -2.07 -3.43 116.42 121.06 2i0b h ASP 23 Ca -0.29 -0.60 -0.57 0.00 0.42 0.00 0.00 57.03 55.99 2i0b h ASP 23 Cb 1.18 -0.08 -0.06 0.00 1.72 0.00 0.00 39.33 42.09 2i0b h ASP 23 CO 0.39 0.83 -0.05 -1.59 -2.88 0.00 0.00 179.24 175.94 2i0b s LYS 24 N -3.84 4.29 0.47 0.28 -2.85 -1.26 -5.04 119.74 111.79 2i0b s LYS 24 Ca -0.15 0.66 -0.23 0.00 -1.00 0.00 0.00 55.97 55.25 2i0b s LYS 24 Cb 0.03 -3.35 -0.08 0.00 -2.06 0.00 0.00 37.83 32.37 2i0b s LYS 24 CO 0.74 0.35 1.14 -2.30 0.10 0.00 0.00 175.35 175.39 2i0b n PRO 25 N 2.84 1.52 -3.78 1.78 -0.02 -1.26 -5.01 135.00 131.07 2i0b n PRO 25 Ca -0.07 0.55 -0.21 0.00 -2.02 0.00 0.00 63.50 61.75 2i0b n PRO 25 Cb 0.51 -2.26 -0.04 0.00 -0.02 0.00 0.00 33.50 31.69 2i0b n PRO 25 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2i0b s LEU 26 N -1.63 3.56 0.11 2.45 1.43 -1.26 -5.13 118.68 118.20 2i0b s LEU 26 Ca 0.66 -0.54 0.05 0.00 -1.03 0.00 0.00 54.13 53.26 2i0b s LEU 26 Cb -0.49 -2.18 -0.04 0.00 0.03 0.00 0.00 46.19 43.51 2i0b s LEU 26 CO 0.54 -0.40 -0.12 -0.31 0.23 0.00 0.00 176.35 176.30 2i0b s TYR 27 N -2.33 1.19 0.00 0.29 1.51 -1.26 -4.76 117.35 111.98 2i0b s TYR 27 Ca 0.42 -0.62 0.00 0.00 -1.01 0.00 0.00 57.07 55.86 2i0b s TYR 27 Cb -0.05 -0.64 0.00 0.00 -0.11 0.00 0.00 41.96 41.16 2i0b s TYR 27 CO 0.27 0.06 0.00 0.41 -1.11 0.00 0.00 175.55 175.17 2i0b n GLY 28 N 0.54 2.62 0.29 0.71 0.00 -1.26 -2.08 105.19 106.01 2i0b n GLY 28 Ca -0.16 -0.34 0.17 0.00 0.00 0.00 0.00 46.02 45.69 2i0b n GLY 28 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2i0b h ASN 29 N 7.74 0.00 0.39 1.61 2.35 -1.93 -2.60 115.58 123.13 2i0b h ASN 29 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2i0b h ASN 29 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 2i0b h ASN 29 CO 0.00 0.06 0.00 -0.78 -1.65 0.00 0.00 177.43 175.06 2i0b h ASP 30 N 0.00 0.00 0.28 5.81 -0.00 -1.82 -2.42 116.42 118.27 2i0b h ASP 30 Ca -0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 57.03 57.00 2i0b h ASP 30 Cb 0.27 0.00 -0.00 0.00 -0.00 0.00 0.00 39.33 39.60 2i0b h ASP 30 CO 0.01 0.00 -0.14 0.03 -0.00 0.00 0.00 179.24 179.14 2i0b h ARG 31 N 0.00 0.00 -6.26 0.28 3.08 -1.53 -3.45 114.38 106.50 2i0b h ARG 31 Ca 0.00 0.00 -0.58 0.00 0.07 0.00 0.00 59.98 59.47 2i0b h ARG 31 Cb 0.19 0.00 -0.09 0.00 0.08 0.00 0.00 29.97 30.15 2i0b h ARG 31 CO 0.00 0.14 -0.61 -0.06 -1.07 0.00 0.00 179.97 178.37 2i0b s PHE 32 N -4.36 2.98 0.19 3.04 0.40 -0.91 0.05 117.98 119.37 2i0b s PHE 32 Ca -0.03 -0.09 -0.10 0.00 -0.60 0.00 0.00 56.93 56.10 2i0b s PHE 32 Cb 0.14 -1.42 -0.01 0.00 0.51 0.00 0.00 43.02 42.24 2i0b s PHE 32 CO 0.62 0.52 0.35 -1.83 0.70 0.00 0.00 175.22 175.59 2i0b s GLU 33 N -3.12 1.29 0.00 0.44 -1.05 -0.47 -4.77 118.70 111.02 2i0b s GLU 33 Ca 0.29 -1.19 0.00 0.00 -0.15 0.00 0.00 54.97 53.92 2i0b s GLU 33 Cb -0.09 0.41 0.00 0.00 -0.44 0.00 0.00 34.13 34.01 2i0b s GLU 33 CO 0.21 -0.50 0.00 0.41 0.95 0.00 0.00 175.26 176.33 2i0b n GLY 34 N -0.28 1.86 0.16 -3.83 0.00 -1.26 -0.70 105.19 101.15 2i0b n GLY 34 Ca -0.05 -1.89 -0.05 0.00 0.00 0.00 0.00 46.02 44.02 2i0b n GLY 34 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2i0b h TYR 35 N 0.00 0.20 -0.01 1.61 3.20 -0.69 -0.84 116.97 120.44 2i0b h TYR 35 Ca 0.00 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 61.82 2i0b h TYR 35 Cb 0.00 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.23 2i0b h TYR 35 CO 0.00 0.07 -0.32 0.00 -1.64 0.00 0.00 178.16 176.27 2i0b h ILE 37 N 0.02 1.29 -0.65 0.00 1.08 -1.48 0.88 117.51 118.65 2i0b h ILE 37 Ca -0.00 -1.18 -0.01 0.00 -0.39 0.00 0.00 64.86 63.28 2i0b h ILE 37 Cb 0.58 1.47 -0.03 0.00 -3.07 0.00 0.00 36.82 35.77 2i0b h ILE 37 CO 0.04 0.37 0.38 0.44 -0.69 0.00 0.00 178.15 178.70 2i0b h ASP 38 N 0.32 0.79 -0.55 1.72 3.32 -0.85 -0.07 116.42 121.09 2i0b h ASP 38 Ca 0.07 -0.07 -0.03 0.00 0.02 0.00 0.00 57.03 57.02 2i0b h ASP 38 Cb 0.61 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.94 2i0b h ASP 38 CO 0.04 0.63 0.24 0.25 -1.72 0.00 0.00 179.24 178.68 2i0b h LEU 39 N 0.88 0.75 -0.79 1.55 5.85 -1.01 -1.76 115.31 120.78 2i0b h LEU 39 Ca 0.23 -0.15 -0.04 0.00 0.84 0.00 0.00 57.88 58.76 2i0b h LEU 39 Cb -0.00 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 40.80 2i0b h LEU 39 CO -0.04 0.69 0.34 0.25 -0.34 0.00 0.00 178.44 179.34 2i0b h LEU 40 N 0.75 1.07 -0.59 2.25 5.85 -0.48 -0.55 115.31 123.61 2i0b h LEU 40 Ca 0.19 -0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 2i0b h LEU 40 Cb 0.16 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 40.89 2i0b h LEU 40 CO -0.02 0.94 0.34 -0.09 -0.34 0.00 0.00 178.44 179.27 2i0b h ARG 41 N 1.14 0.81 -0.48 1.25 2.43 -0.73 -0.59 114.38 118.22 2i0b h ARG 41 Ca 0.27 -0.08 -0.04 0.00 -0.81 0.00 0.00 59.98 59.31 2i0b h ARG 41 Cb 0.18 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.55 2i0b h ARG 41 CO -0.03 0.60 0.14 0.93 -1.51 0.00 0.00 179.97 180.10 2i0b h GLU 42 N 0.80 0.75 -0.65 0.20 4.39 -0.95 -1.80 114.58 117.32 2i0b h GLU 42 Ca 0.21 -0.17 0.00 0.00 0.34 0.00 0.00 59.36 59.75 2i0b h GLU 42 Cb 0.01 -0.10 -0.03 0.00 -0.10 0.00 0.00 28.75 28.52 2i0b h GLU 42 CO -0.04 0.72 0.42 -0.07 -1.16 0.00 0.00 179.01 178.88 2i0b h LEU 43 N 0.64 0.75 -1.37 1.33 3.38 -0.82 -0.08 115.31 119.15 2i0b h LEU 43 Ca 0.15 -0.03 -0.05 0.00 0.09 0.00 0.00 57.88 58.04 2i0b h LEU 43 Cb 0.29 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 2i0b h LEU 43 CO -0.00 0.56 -0.14 0.77 0.09 0.00 0.00 178.44 179.72 2i0b h SER 44 N 0.88 0.23 -0.07 -0.43 4.64 -0.90 0.11 113.55 118.01 2i0b h SER 44 Ca 0.24 -0.05 -0.11 0.00 -0.47 0.00 0.00 61.79 61.40 2i0b h SER 44 Cb -0.08 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 61.95 2i0b h SER 44 CO -0.05 0.40 -0.37 0.74 -0.87 0.00 0.00 176.83 176.68 2i0b h THR 45 N 0.23 1.41 -0.12 2.95 2.02 -0.90 -0.30 112.91 118.21 2i0b h THR 45 Ca 0.05 -1.76 -0.02 0.00 0.77 0.00 0.00 66.41 65.44 2i0b h THR 45 Cb 0.40 2.31 -0.00 0.00 -1.74 0.00 0.00 68.15 69.12 2i0b h THR 45 CO 0.02 0.51 -0.01 0.40 0.37 0.00 0.00 175.52 176.82 2i0b h ILE 46 N -0.10 1.26 0.19 3.11 2.04 -0.68 -3.28 117.51 120.06 2i0b h ILE 46 Ca -0.03 -0.86 -0.31 0.00 1.00 0.00 0.00 64.86 64.66 2i0b h ILE 46 Cb 1.02 1.60 0.03 0.00 -0.74 0.00 0.00 36.82 38.72 2i0b h ILE 46 CO 0.08 0.25 -1.36 -0.07 0.00 0.00 0.00 178.15 177.05 2i0b h LEU 47 N -0.06 0.71 -0.72 1.44 4.07 -0.93 -3.49 115.31 116.33 2i0b h LEU 47 Ca 0.03 -0.73 0.00 0.00 0.08 0.00 0.00 57.88 57.26 2i0b h LEU 47 Cb 0.39 -0.23 0.00 0.00 1.08 0.00 0.00 40.66 41.90 2i0b h LEU 47 CO 0.01 1.57 0.00 0.61 -1.08 0.00 0.00 178.44 179.55 2i0b n GLY 48 N 1.59 0.49 3.32 0.83 0.00 -0.14 -5.07 105.19 106.20 2i0b n GLY 48 Ca -0.13 -0.18 -0.18 0.00 0.00 0.00 0.00 46.02 45.53 2i0b n GLY 48 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2i0b s PHE 49 N -1.74 1.63 0.22 1.61 -0.12 -1.08 -4.99 117.98 113.51 2i0b s PHE 49 Ca 0.00 -0.59 0.08 0.00 -0.05 0.00 0.00 56.93 56.36 2i0b s PHE 49 Cb 0.00 -0.77 -0.04 0.00 -0.63 0.00 0.00 43.02 41.58 2i0b s PHE 49 CO 0.00 0.30 0.07 0.95 -0.05 0.00 0.00 175.22 176.50 2i0b s THR 50 N -2.91 3.96 0.15 -4.49 -4.23 -0.56 -4.71 115.64 102.84 2i0b s THR 50 Ca 0.20 -1.51 -0.15 0.00 -1.18 0.00 0.00 61.69 59.06 2i0b s THR 50 Cb -0.01 -3.08 0.02 0.00 1.34 0.00 0.00 72.50 70.78 2i0b s THR 50 CO 0.06 -0.25 0.40 -0.72 -0.54 0.00 0.00 174.62 173.56 2i0b s TYR 51 N -2.01 -0.04 -0.08 3.99 -0.85 -1.26 -0.58 117.35 116.51 2i0b s TYR 51 Ca 0.31 -0.30 0.04 0.00 -0.52 0.00 0.00 57.07 56.60 2i0b s TYR 51 Cb -0.08 0.22 0.00 0.00 0.38 0.00 0.00 41.96 42.47 2i0b s TYR 51 CO 0.21 -0.75 -0.21 -2.00 -1.52 0.00 0.00 175.55 171.28 2i0b s GLU 52 N -3.86 2.48 -0.15 -3.49 2.12 -0.28 -4.91 118.70 110.61 2i0b s GLU 52 Ca 0.07 -0.75 -0.22 0.00 0.36 0.00 0.00 54.97 54.43 2i0b s GLU 52 Cb 0.02 -1.97 -0.03 0.00 0.26 0.00 0.00 34.13 32.40 2i0b s GLU 52 CO -0.07 0.20 0.69 0.42 -0.54 0.00 0.00 175.26 175.95 2i0b s ILE 53 N 0.27 5.00 -0.04 -3.70 1.01 -1.26 -0.72 121.20 121.75 2i0b s ILE 53 Ca -0.13 1.35 0.05 0.00 0.00 0.00 0.00 60.65 61.92 2i0b s ILE 53 Cb -0.16 -4.01 -0.02 0.00 0.01 0.00 0.00 42.46 38.28 2i0b s ILE 53 CO 0.06 0.14 -0.18 0.00 0.00 0.00 0.00 174.94 174.96 2i0b s ARG 54 N 1.58 2.40 0.06 2.79 1.70 0.79 -4.89 118.95 123.38 2i0b s ARG 54 Ca 0.33 -0.76 -0.22 0.00 -0.47 0.00 0.00 55.73 54.61 2i0b s ARG 54 Cb -0.16 -2.28 -0.06 0.00 -0.57 0.00 0.00 34.95 31.87 2i0b s ARG 54 CO 0.13 0.60 0.66 -0.51 -1.08 0.00 0.00 175.30 175.10 2i0b s LEU 55 N -0.68 4.48 0.04 -1.89 1.43 -1.26 -1.64 118.68 119.16 2i0b s LEU 55 Ca 0.11 1.33 -0.34 0.00 -1.03 0.00 0.00 54.13 54.20 2i0b s LEU 55 Cb -0.10 -3.04 -0.13 0.00 0.03 0.00 0.00 46.19 42.94 2i0b s LEU 55 CO 0.00 0.15 1.69 0.55 0.23 0.00 0.00 176.35 178.97 2i0b n VAL 56 N 2.28 0.24 -0.28 -1.59 3.14 -0.02 -4.85 118.33 117.26 2i0b n VAL 56 Ca -0.07 -0.04 -0.04 0.00 -2.96 0.00 0.00 64.34 61.23 2i0b n VAL 56 Cb 0.50 -1.61 0.11 0.00 -1.06 0.00 0.00 33.84 31.78 2i0b n VAL 56 CO 0.00 0.00 0.00 -0.33 -6.46 0.00 0.00 176.83 170.04 2i0b h GLU 57 N 7.16 1.15 -0.01 1.45 4.39 -1.94 -2.62 114.58 124.16 2i0b h GLU 57 Ca -0.47 -0.17 0.00 0.00 0.34 0.00 0.00 59.36 59.07 2i0b h GLU 57 Cb 1.27 -0.21 0.00 0.00 -0.10 0.00 0.00 28.75 29.71 2i0b h GLU 57 CO 0.91 0.89 -0.01 -0.40 -1.16 0.00 0.00 179.01 179.23 2i0b n ASP 58 N -4.31 0.99 -1.49 1.42 5.75 -1.26 -4.93 116.55 112.72 2i0b n ASP 58 Ca 0.08 -1.30 -0.16 0.00 -0.01 0.00 0.00 54.79 53.40 2i0b n ASP 58 Cb 0.15 0.00 -0.04 0.00 -1.03 0.00 0.00 41.12 40.19 2i0b n ASP 58 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2i0b n GLY 59 N 1.13 0.81 3.45 6.12 0.00 -0.99 -4.97 105.19 110.73 2i0b n GLY 59 Ca 0.20 -0.24 -0.27 0.00 0.00 0.00 0.00 46.02 45.72 2i0b n GLY 59 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2i0b s LYS 60 N -3.98 1.60 -0.11 1.61 1.02 -1.26 -5.00 119.74 113.62 2i0b s LYS 60 Ca 0.00 -1.50 -0.20 0.00 0.02 0.00 0.00 55.97 54.29 2i0b s LYS 60 Cb 0.00 -1.89 -0.18 0.00 -0.52 0.00 0.00 37.83 35.25 2i0b s LYS 60 CO 0.00 0.40 0.60 1.88 -0.92 0.00 0.00 175.35 177.31 2i0b h TYR 61 N 3.12 -0.03 0.00 3.18 -1.99 -1.88 -1.74 116.97 117.64 2i0b h TYR 61 Ca -0.46 -0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.27 2i0b h TYR 61 Cb 1.21 0.01 0.00 0.00 2.00 0.00 0.00 36.73 39.95 2i0b h TYR 61 CO 0.69 0.61 0.00 0.41 -0.00 0.00 0.00 178.16 179.87 2i0b n GLY 62 N 1.46 3.25 3.19 3.88 0.00 -0.52 -1.27 105.19 115.19 2i0b n GLY 62 Ca -0.07 -0.22 -0.08 0.00 0.00 0.00 0.00 46.02 45.64 2i0b n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2i0b s ALA 63 N 0.00 -0.01 -0.11 4.61 0.00 -1.23 -4.50 121.76 120.53 2i0b s ALA 63 Ca 0.00 -0.80 -0.13 0.00 0.00 0.00 0.00 51.96 51.03 2i0b s ALA 63 Cb 0.00 0.49 -0.05 0.00 0.00 0.00 0.00 23.12 23.56 2i0b s ALA 63 CO 0.00 -0.49 0.30 -1.14 0.00 0.00 0.00 175.76 174.43 2i0b s GLN 64 N -3.89 4.01 0.02 0.00 0.74 -1.26 -2.09 119.66 117.19 2i0b s GLN 64 Ca 0.07 0.16 -0.30 0.00 0.05 0.00 0.00 55.36 55.33 2i0b s GLN 64 Cb 0.05 -3.32 -0.06 0.00 1.10 0.00 0.00 33.01 30.78 2i0b s GLN 64 CO -0.09 0.47 1.39 0.34 -0.55 0.00 0.00 175.29 176.84 2i0b s ASP 65 N -0.25 6.86 0.25 6.67 -1.08 0.76 -4.93 116.67 124.96 2i0b s ASP 65 Ca 0.19 2.13 -0.02 0.00 -0.52 0.00 0.00 52.55 54.32 2i0b s ASP 65 Cb -0.14 -2.56 0.51 0.00 -1.46 0.00 0.00 42.92 39.26 2i0b s ASP 65 CO 0.07 -0.70 1.73 0.44 0.52 0.00 0.00 175.17 177.23 2i0b h ASP 66 N 7.65 0.33 0.35 -0.34 3.32 -1.97 -1.42 116.42 124.35 2i0b h ASP 66 Ca -0.39 0.11 -0.02 0.00 0.02 0.00 0.00 57.03 56.76 2i0b h ASP 66 Cb 1.18 0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.82 2i0b h ASP 66 CO 0.89 0.11 -0.17 0.58 -1.72 0.00 0.00 179.24 178.94 2i0b h VAL 67 N 0.47 0.00 -0.43 -1.35 2.07 -1.98 -3.39 116.25 111.65 2i0b h VAL 67 Ca 0.44 -0.48 0.00 0.00 0.82 0.00 0.00 66.70 67.48 2i0b h VAL 67 Cb 0.69 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.46 2i0b h VAL 67 CO -0.41 0.00 0.00 -0.46 0.02 0.00 0.00 177.57 176.72 2i0b n ASN 68 N -4.59 3.49 0.00 0.57 0.23 -1.24 -4.96 115.26 108.76 2i0b n ASN 68 Ca -0.06 -1.98 0.00 0.00 -0.53 0.00 0.00 54.58 52.01 2i0b n ASN 68 Cb 0.18 -0.28 0.00 0.00 -2.08 0.00 0.00 39.78 37.61 2i0b n ASN 68 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2i0b n GLY 69 N 1.47 0.34 3.78 4.83 0.00 -0.53 -4.98 105.19 110.09 2i0b n GLY 69 Ca 0.20 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.84 2i0b n GLY 69 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2i0b s GLN 70 N -0.82 4.56 0.43 1.61 -0.21 -1.26 -4.65 119.66 119.31 2i0b s GLN 70 Ca 0.00 1.24 -0.01 0.00 0.02 0.00 0.00 55.36 56.61 2i0b s GLN 70 Cb 0.00 -2.93 -0.02 0.00 1.00 0.00 0.00 33.01 31.06 2i0b s GLN 70 CO 0.00 0.37 0.67 -1.58 -2.12 0.00 0.00 175.29 172.63 2i0b s TRP 71 N -1.49 3.41 0.03 0.91 0.52 -1.26 -0.17 118.94 120.90 2i0b s TRP 71 Ca 0.46 0.45 0.00 0.00 0.02 0.00 0.00 56.10 57.03 2i0b s TRP 71 Cb -0.20 -2.18 -0.00 0.00 -1.15 0.00 0.00 33.47 29.94 2i0b s TRP 71 CO 0.25 -0.19 0.01 0.27 0.02 0.00 0.00 176.95 177.31 2i0b n ASN 72 N -2.05 1.06 0.00 2.95 0.23 -0.89 -4.69 115.26 111.88 2i0b n ASN 72 Ca -0.01 -1.17 0.00 0.00 -0.53 0.00 0.00 54.58 52.87 2i0b n ASN 72 Cb 0.56 0.08 0.00 0.00 -2.08 0.00 0.00 39.78 38.34 2i0b n ASN 72 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2i0b n GLY 73 N 2.31 0.57 0.24 4.83 0.00 -1.26 -1.69 105.19 110.19 2i0b n GLY 73 Ca -0.01 -0.83 0.01 0.00 0.00 0.00 0.00 46.02 45.20 2i0b n GLY 73 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 2i0b h MET 74 N 0.00 0.32 -0.15 1.61 2.86 -0.23 -0.84 114.93 118.50 2i0b h MET 74 Ca 0.00 -0.08 -0.00 0.00 -2.06 0.00 0.00 59.70 57.56 2i0b h MET 74 Cb 0.00 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.61 2i0b h MET 74 CO 0.00 0.45 0.10 0.28 1.06 0.00 0.00 176.91 178.80 2i0b h VAL 75 N 0.30 1.06 -0.36 -2.22 2.07 -1.48 -2.05 116.25 113.56 2i0b h VAL 75 Ca 0.06 -0.14 -0.05 0.00 0.82 0.00 0.00 66.70 67.39 2i0b h VAL 75 Cb 0.42 0.88 -0.02 0.00 -1.52 0.00 0.00 31.29 31.05 2i0b h VAL 75 CO 0.02 0.06 0.01 -0.09 0.02 0.00 0.00 177.57 177.59 2i0b h ARG 76 N 0.19 0.56 -0.99 1.57 9.65 -0.68 -1.36 114.38 123.32 2i0b h ARG 76 Ca 0.06 -0.12 0.05 0.00 -1.10 0.00 0.00 59.98 58.87 2i0b h ARG 76 Cb 0.01 -0.08 -0.06 0.00 -1.39 0.00 0.00 29.97 28.45 2i0b h ARG 76 CO -0.01 0.58 0.64 0.93 2.80 0.00 0.00 179.97 184.91 2i0b h GLU 77 N 0.54 1.16 -0.17 0.20 5.08 -0.55 0.01 114.58 120.85 2i0b h GLU 77 Ca 0.12 -0.07 -0.09 0.00 -1.00 0.00 0.00 59.36 58.32 2i0b h GLU 77 Cb 0.33 -0.26 -0.00 0.00 0.50 0.00 0.00 28.75 29.32 2i0b h GLU 77 CO 0.01 0.77 -0.25 -0.07 -1.00 0.00 0.00 179.01 178.47 2i0b h LEU 78 N 1.20 0.51 -1.25 1.33 3.38 -0.88 -0.47 115.31 119.12 2i0b h LEU 78 Ca 0.41 -0.52 0.07 0.00 0.09 0.00 0.00 57.88 57.93 2i0b h LEU 78 Cb 0.09 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 40.64 2i0b h LEU 78 CO -0.15 0.93 0.54 0.40 0.09 0.00 0.00 178.44 180.25 2i0b h ILE 79 N 0.11 1.03 -0.00 1.22 2.04 -0.92 -1.60 117.51 119.38 2i0b h ILE 79 Ca 0.02 -0.31 0.00 0.00 1.00 0.00 0.00 64.86 65.57 2i0b h ILE 79 Cb 0.82 0.07 0.00 0.00 -0.74 0.00 0.00 36.82 36.97 2i0b h ILE 79 CO 0.06 0.16 -0.06 0.47 0.00 0.00 0.00 178.15 178.78 2i0b n ASP 80 N -4.49 0.42 -1.47 1.72 8.00 -0.04 -4.91 116.55 115.78 2i0b n ASP 80 Ca 0.13 -0.72 -0.15 0.00 0.71 0.00 0.00 54.79 54.75 2i0b n ASP 80 Cb 0.23 -0.07 -0.04 0.00 -0.02 0.00 0.00 41.12 41.22 2i0b n ASP 80 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2i0b n HIS 81 N -0.88 -0.37 0.24 1.24 8.25 -0.60 -4.87 115.22 118.22 2i0b n HIS 81 Ca 0.17 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.76 2i0b n HIS 81 Cb 0.24 -2.95 0.41 0.00 1.12 0.00 0.00 29.99 28.81 2i0b n HIS 81 CO 0.00 0.00 0.00 0.87 0.64 0.00 0.00 176.34 177.85 2i0b h LYS 82 N 0.00 0.00 -4.39 -0.41 1.57 -1.35 -3.45 116.57 108.54 2i0b h LYS 82 Ca -0.34 0.00 -0.21 0.00 -1.87 0.00 0.00 60.65 58.23 2i0b h LYS 82 Cb 1.14 0.00 -0.19 0.00 0.08 0.00 0.00 32.23 33.26 2i0b h LYS 82 CO 0.45 0.08 -0.71 0.00 -0.57 0.00 0.00 179.45 178.70 2i0b s ALA 83 N -3.45 0.55 -0.04 3.86 0.00 -1.21 -4.92 121.76 116.55 2i0b s ALA 83 Ca 0.03 -0.93 0.07 0.00 0.00 0.00 0.00 51.96 51.14 2i0b s ALA 83 Cb 0.08 0.13 -0.24 0.00 0.00 0.00 0.00 23.12 23.09 2i0b s ALA 83 CO 0.62 -0.16 0.69 -0.44 0.00 0.00 0.00 175.76 176.47 2i0b h ASP 84 N 3.97 0.11 -5.07 0.00 3.32 -1.12 -3.43 116.42 114.20 2i0b h ASP 84 Ca -0.34 -0.21 -0.12 0.00 0.02 0.00 0.00 57.03 56.38 2i0b h ASP 84 Cb 1.19 -0.04 -0.17 0.00 0.22 0.00 0.00 39.33 40.53 2i0b h ASP 84 CO 0.50 1.19 -0.43 -0.76 -1.72 0.00 0.00 179.24 178.03 2i0b s LEU 85 N -6.39 1.47 -0.17 1.55 1.43 -1.15 -4.23 118.68 111.19 2i0b s LEU 85 Ca -0.08 -0.40 0.01 0.00 -1.03 0.00 0.00 54.13 52.63 2i0b s LEU 85 Cb 0.08 0.87 0.03 0.00 0.03 0.00 0.00 46.19 47.20 2i0b s LEU 85 CO 0.82 -0.54 -0.15 0.00 0.23 0.00 0.00 176.35 176.71 2i0b s ALA 86 N -2.55 2.05 -0.30 4.21 0.00 -0.11 -0.62 121.76 124.44 2i0b s ALA 86 Ca -0.05 -1.11 0.03 0.00 0.00 0.00 0.00 51.96 50.83 2i0b s ALA 86 Cb -0.01 -1.17 0.08 0.00 0.00 0.00 0.00 23.12 22.02 2i0b s ALA 86 CO -0.04 -0.52 -0.02 0.08 0.00 0.00 0.00 175.76 175.26 2i0b s VAL 87 N 1.39 2.13 0.16 0.00 1.01 -0.71 -1.55 120.40 122.84 2i0b s VAL 87 Ca 0.03 -1.97 -0.24 0.00 0.00 0.00 0.00 61.98 59.80 2i0b s VAL 87 Cb -0.14 -2.43 0.07 0.00 0.00 0.00 0.00 36.38 33.87 2i0b s VAL 87 CO -0.10 -0.35 0.99 0.00 0.00 0.00 0.00 175.10 175.63 2i0b s ALA 88 N 1.04 -1.64 -1.27 5.51 0.00 -1.26 -4.57 121.76 119.57 2i0b s ALA 88 Ca 0.02 0.01 -0.14 0.00 0.00 0.00 0.00 51.96 51.85 2i0b s ALA 88 Cb -0.19 0.66 -0.04 0.00 0.00 0.00 0.00 23.12 23.55 2i0b s ALA 88 CO -0.07 -1.05 2.28 -0.35 0.00 0.00 0.00 175.76 176.57 2i0b n PRO 89 N -0.53 2.61 -3.36 0.00 -0.04 -1.26 -4.66 135.00 127.75 2i0b n PRO 89 Ca -0.05 -2.23 -0.41 0.00 -0.04 0.00 0.00 63.50 60.76 2i0b n PRO 89 Cb 0.60 -3.03 -0.09 0.00 -0.04 0.00 0.00 33.50 30.94 2i0b n PRO 89 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2i0b s LEU 90 N 1.38 4.55 0.23 1.53 2.96 -1.26 -5.02 118.68 123.04 2i0b s LEU 90 Ca 0.53 -0.34 -0.30 0.00 -0.22 0.00 0.00 54.13 53.80 2i0b s LEU 90 Cb 0.14 -2.37 -0.10 0.00 0.50 0.00 0.00 46.19 44.36 2i0b s LEU 90 CO -0.03 -0.42 1.42 0.00 -1.32 0.00 0.00 176.35 176.00 2i0b s ALA 91 N 2.08 3.61 -0.37 5.97 0.00 -1.26 -2.30 121.76 129.49 2i0b s ALA 91 Ca 0.12 1.28 -0.27 0.00 0.00 0.00 0.00 51.96 53.09 2i0b s ALA 91 Cb -0.17 -3.54 0.02 0.00 0.00 0.00 0.00 23.12 19.43 2i0b s ALA 91 CO 0.12 -0.70 1.00 0.42 0.00 0.00 0.00 175.76 176.61 2i0b s ILE 92 N 0.14 4.50 0.07 0.00 1.01 -0.27 -4.91 121.20 121.74 2i0b s ILE 92 Ca 0.60 1.34 0.03 0.00 0.00 0.00 0.00 60.65 62.62 2i0b s ILE 92 Cb -0.41 -4.40 -0.03 0.00 0.01 0.00 0.00 42.46 37.63 2i0b s ILE 92 CO 0.41 -0.60 -0.10 0.42 0.00 0.00 0.00 174.94 175.07 2i0b s THR 93 N 3.68 0.81 0.23 2.92 -4.23 -1.26 -4.57 115.64 113.21 2i0b s THR 93 Ca 0.42 -1.40 -0.07 0.00 -1.18 0.00 0.00 61.69 59.46 2i0b s THR 93 Cb -0.11 -1.06 0.18 0.00 1.34 0.00 0.00 72.50 72.85 2i0b s THR 93 CO 0.20 -0.46 1.82 0.22 -0.54 0.00 0.00 174.62 175.86 2i0b h TYR 94 N 3.99 0.80 -0.53 3.99 3.20 -1.98 0.05 116.97 126.49 2i0b h TYR 94 Ca -0.37 0.03 -0.04 0.00 3.14 0.00 0.00 58.73 61.49 2i0b h TYR 94 Cb 1.19 -0.25 -0.03 0.00 1.54 0.00 0.00 36.73 39.19 2i0b h TYR 94 CO 0.63 0.37 0.17 -0.39 -1.64 0.00 0.00 178.16 177.30 2i0b h VAL 95 N 0.78 1.21 -0.22 1.81 -1.51 -2.00 -2.57 116.25 113.74 2i0b h VAL 95 Ca 0.35 -0.71 -0.19 0.00 -1.23 0.00 0.00 66.70 64.91 2i0b h VAL 95 Cb 0.24 0.63 0.00 0.00 -2.13 0.00 0.00 31.29 30.03 2i0b h VAL 95 CO -0.20 0.27 -0.63 0.03 -1.23 0.00 0.00 177.57 175.81 2i0b h ARG 96 N 0.77 0.78 -0.05 5.19 3.08 -1.79 -2.95 114.38 119.41 2i0b h ARG 96 Ca 0.18 -0.54 0.01 0.00 0.07 0.00 0.00 59.98 59.70 2i0b h ARG 96 Cb 0.22 0.08 -0.00 0.00 0.08 0.00 0.00 29.97 30.35 2i0b h ARG 96 CO -0.01 1.17 0.13 0.93 -1.07 0.00 0.00 179.97 181.12 2i0b h GLU 97 N 0.58 0.00 0.00 0.04 5.08 -0.61 0.00 114.58 119.67 2i0b h GLU 97 Ca -0.01 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 2i0b h GLU 97 Cb 1.23 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.48 2i0b h GLU 97 CO 0.13 0.00 -0.04 0.93 -1.00 0.00 0.00 179.01 179.03 2i0b h GLU 98 N 0.00 0.00 0.00 2.33 5.08 -1.31 -3.36 114.58 117.32 2i0b h GLU 98 Ca 0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 2i0b h GLU 98 Cb 0.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.54 2i0b h GLU 98 CO -0.00 0.04 -0.94 1.33 -1.00 0.00 0.00 179.01 178.44 2i0b n VAL 99 N -3.14 0.00 -4.23 3.13 0.24 -0.19 -5.07 118.33 109.07 2i0b n VAL 99 Ca 0.01 0.00 -0.13 0.00 -2.04 0.00 0.00 64.34 62.18 2i0b n VAL 99 Cb 0.37 0.32 -0.10 0.00 -1.47 0.00 0.00 33.84 32.96 2i0b n VAL 99 CO 0.00 0.00 0.00 0.27 -2.14 0.00 0.00 176.83 174.96 2i0b s ILE 100 N -1.89 0.42 0.09 1.34 -4.36 -0.21 -4.41 121.20 112.18 2i0b s ILE 100 Ca 0.00 -1.97 0.02 0.00 -0.26 0.00 0.00 60.65 58.44 2i0b s ILE 100 Cb 0.00 -2.29 -0.04 0.00 1.25 0.00 0.00 42.46 41.38 2i0b s ILE 100 CO 0.00 -0.28 0.14 -1.81 0.24 0.00 0.00 174.94 173.23 2i0b s ASP 101 N -3.18 5.82 0.09 4.36 1.01 -0.24 -4.18 116.67 120.35 2i0b s ASP 101 Ca 0.30 0.07 0.08 0.00 0.71 0.00 0.00 52.55 53.70 2i0b s ASP 101 Cb 0.07 -1.64 -0.03 0.00 1.01 0.00 0.00 42.92 42.32 2i0b s ASP 101 CO 0.07 0.15 -0.20 -0.36 0.21 0.00 0.00 175.17 175.04 2i0b s PHE 102 N -1.50 1.73 1.09 4.23 0.40 -1.26 -0.57 117.98 122.10 2i0b s PHE 102 Ca 0.31 -0.41 -0.16 0.00 -0.60 0.00 0.00 56.93 56.07 2i0b s PHE 102 Cb -0.12 -0.97 0.23 0.00 0.51 0.00 0.00 43.02 42.68 2i0b s PHE 102 CO 0.24 0.17 1.14 -1.54 0.70 0.00 0.00 175.22 175.93 2i0b s SER 103 N -1.74 1.94 0.83 1.36 1.04 -0.05 -4.95 113.70 112.13 2i0b s SER 103 Ca 0.06 0.75 -0.11 0.00 0.48 0.00 0.00 55.95 57.14 2i0b s SER 103 Cb -0.10 -1.12 0.09 0.00 0.10 0.00 0.00 66.02 65.00 2i0b s SER 103 CO 0.04 -3.51 1.10 -0.54 0.98 0.00 0.00 173.24 171.31 2i0b s LYS 104 N -5.35 1.75 0.33 4.02 -0.14 -1.26 -4.56 119.74 114.53 2i0b s LYS 104 Ca 0.69 1.18 -0.28 0.00 -1.36 0.00 0.00 55.97 56.19 2i0b s LYS 104 Cb -0.12 -1.84 -0.10 0.00 -1.68 0.00 0.00 37.83 34.10 2i0b s LYS 104 CO 0.56 -2.00 1.22 -1.25 -0.76 0.00 0.00 175.35 173.12 2i0b s PRO 105 N -4.85 4.38 0.00 -1.68 0.04 -1.26 -4.58 135.00 127.06 2i0b s PRO 105 Ca 0.63 2.03 0.23 0.00 0.04 0.00 0.00 61.00 63.92 2i0b s PRO 105 Cb -0.19 -3.03 0.05 0.00 0.04 0.00 0.00 34.50 31.37 2i0b s PRO 105 CO 0.57 -0.10 1.09 1.97 0.04 0.00 0.00 177.00 180.57 2i0b n PHE 106 N 0.77 0.01 -3.66 0.56 1.16 0.40 -4.94 117.46 111.76 2i0b n PHE 106 Ca 0.00 0.00 -0.15 0.00 -1.87 0.00 0.00 57.45 55.43 2i0b n PHE 106 Cb 0.44 -0.10 -0.08 0.00 -1.61 0.00 0.00 39.48 38.13 2i0b n PHE 106 CO 0.00 0.00 0.00 1.41 -1.87 0.00 0.00 176.76 176.30 2i0b s MET 107 N -3.01 0.82 0.22 3.97 0.00 -1.24 -5.01 119.30 115.06 2i0b s MET 107 Ca 0.09 0.03 0.11 0.00 0.00 0.00 0.00 55.69 55.92 2i0b s MET 107 Cb 0.17 0.38 -0.04 0.00 0.00 0.00 0.00 34.83 35.33 2i0b s MET 107 CO 0.81 -0.24 -0.16 0.95 0.00 0.00 0.00 175.02 176.38 2i0b s THR 108 N -1.20 2.76 0.05 10.11 -4.23 -1.26 -1.23 115.64 120.63 2i0b s THR 108 Ca -0.12 -2.01 -0.07 0.00 -1.18 0.00 0.00 61.69 58.31 2i0b s THR 108 Cb -0.03 -2.39 0.03 0.00 1.34 0.00 0.00 72.50 71.45 2i0b s THR 108 CO 0.06 -0.22 0.34 0.00 -0.54 0.00 0.00 174.62 174.27 2i0b n LEU 109 N -0.17 0.00 -3.73 4.79 -0.00 0.33 -4.87 117.00 113.36 2i0b n LEU 109 Ca -0.09 -0.41 -0.09 0.00 -0.00 0.00 0.00 56.01 55.41 2i0b n LEU 109 Cb 0.57 0.85 -0.03 0.00 -0.00 0.00 0.00 43.42 44.81 2i0b n LEU 109 CO 0.34 -0.14 0.35 -0.83 -0.00 0.00 0.00 177.39 177.12 2i0b s GLY 110 N -2.49 -0.16 0.22 1.47 0.00 -1.26 -1.20 107.32 103.91 2i0b s GLY 110 Ca 0.08 -0.15 -0.30 0.00 0.00 0.00 0.00 44.72 44.35 2i0b s GLY 110 CO 0.01 -0.15 1.15 -0.42 0.00 0.00 0.00 173.10 173.70 2i0b s ILE 111 N -3.87 3.55 0.00 0.90 1.01 -1.26 -0.02 121.20 121.51 2i0b s ILE 111 Ca 0.09 1.41 0.00 0.00 0.00 0.00 0.00 60.65 62.15 2i0b s ILE 111 Cb -0.03 -3.90 0.00 0.00 0.01 0.00 0.00 42.46 38.55 2i0b s ILE 111 CO -0.01 0.27 0.00 -0.24 0.00 0.00 0.00 174.94 174.96 2i0b n SER 112 N 1.94 0.00 -4.24 3.58 2.88 0.23 -0.20 113.62 117.80 2i0b n SER 112 Ca 0.02 -0.75 -0.32 0.00 -1.33 0.00 0.00 58.87 56.48 2i0b n SER 112 Cb 0.45 0.00 -0.17 0.00 -0.75 0.00 0.00 64.21 63.74 2i0b n SER 112 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 2i0b s ILE 113 N -1.94 2.15 -0.25 2.46 1.01 -1.23 -1.52 121.20 121.88 2i0b s ILE 113 Ca 0.00 -0.99 -0.11 0.00 0.00 0.00 0.00 60.65 59.54 2i0b s ILE 113 Cb 0.00 -1.82 -0.05 0.00 0.01 0.00 0.00 42.46 40.60 2i0b s ILE 113 CO 0.00 0.56 0.19 -0.22 0.00 0.00 0.00 174.94 175.47 2i0b s LEU 114 N 0.24 4.09 0.00 2.97 2.96 0.49 0.05 118.68 129.48 2i0b s LEU 114 Ca -0.15 0.12 -0.01 0.00 -0.22 0.00 0.00 54.13 53.86 2i0b s LEU 114 Cb -0.17 -2.15 0.00 0.00 0.50 0.00 0.00 46.19 44.38 2i0b s LEU 114 CO 0.08 0.02 0.09 0.00 -1.32 0.00 0.00 176.35 175.22 2i0b n TYR 115 N 4.51 -0.90 -3.19 5.38 9.36 -0.42 -0.96 117.16 130.94 2i0b n TYR 115 Ca -0.14 -0.30 -0.32 0.00 3.32 0.00 0.00 57.90 60.46 2i0b n TYR 115 Cb 0.52 0.11 -0.06 0.00 -0.63 0.00 0.00 39.34 39.28 2i0b n TYR 115 CO 0.00 0.00 0.00 1.03 0.22 0.00 0.00 176.86 178.11 2i0b s ARG 116 N -2.06 3.91 0.72 2.98 0.52 -1.26 -0.19 118.95 123.57 2i0b s ARG 116 Ca 0.03 0.52 -0.12 0.00 -0.52 0.00 0.00 55.73 55.64 2i0b s ARG 116 Cb -0.00 -2.49 0.03 0.00 0.52 0.00 0.00 34.95 33.01 2i0b s ARG 116 CO 0.02 0.18 1.09 0.15 0.02 0.00 0.00 175.30 176.77 2i0b s LYS 117 N -3.04 2.53 -0.78 3.54 1.02 -0.43 -4.24 119.74 118.35 2i0b s LYS 117 Ca 0.52 1.20 0.00 0.00 0.02 0.00 0.00 55.97 57.71 2i0b s LYS 117 Cb -0.10 -1.93 0.00 0.00 -0.52 0.00 0.00 37.83 35.28 2i0b s LYS 117 CO 0.20 -1.43 0.00 0.41 -0.92 0.00 0.00 175.35 173.61 2i0b n GLY 118 N -1.11 0.93 4.02 -3.33 0.00 -1.26 -5.04 105.19 99.40 2i0b n GLY 118 Ca 0.09 -0.58 -0.18 0.00 0.00 0.00 0.00 46.02 45.35 2i0b n GLY 118 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2i0b s THR 119 N -2.22 2.64 -1.89 2.61 -4.23 -1.26 -5.00 115.64 106.29 2i0b s THR 119 Ca 0.00 -0.98 0.12 0.00 -1.18 0.00 0.00 61.69 59.65 2i0b s THR 119 Cb 0.00 -2.66 0.36 0.00 1.34 0.00 0.00 72.50 71.55 2i0b s THR 119 CO 0.00 0.00 1.29 -0.81 -0.54 0.00 0.00 174.62 174.56 2i0b n PRO 120 N -2.04 2.02 -2.52 3.99 -0.04 -1.26 -4.85 135.00 130.31 2i0b n PRO 120 Ca 0.11 -1.46 -0.43 0.00 -0.04 0.00 0.00 63.50 61.68 2i0b n PRO 120 Cb 0.60 -1.36 -0.02 0.00 -0.04 0.00 0.00 33.50 32.68 2i0b n PRO 120 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2i0b s ILE 121 N -1.50 4.42 -0.22 0.52 -1.09 -1.26 -4.87 121.20 117.20 2i0b s ILE 121 Ca 0.27 1.71 0.03 0.00 -2.23 0.00 0.00 60.65 60.42 2i0b s ILE 121 Cb 0.15 -4.15 -0.00 0.00 -1.58 0.00 0.00 42.46 36.87 2i0b s ILE 121 CO 0.17 -0.21 0.32 0.47 -1.23 0.00 0.00 174.94 174.47 2i0b n ASP 122 N 6.62 0.62 -3.67 3.58 8.00 -1.26 -4.89 116.55 125.54 2i0b n ASP 122 Ca 0.13 -0.81 -0.01 0.00 0.71 0.00 0.00 54.79 54.81 2i0b n ASP 122 Cb 0.46 0.55 -0.01 0.00 -0.02 0.00 0.00 41.12 42.10 2i0b n ASP 122 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 2i0b s SER 123 N -0.78 -0.10 0.30 -2.24 1.04 -1.26 -3.51 113.70 107.15 2i0b s SER 123 Ca 0.02 -0.30 -0.01 0.00 0.48 0.00 0.00 55.95 56.14 2i0b s SER 123 Cb 0.02 0.33 0.48 0.00 0.10 0.00 0.00 66.02 66.95 2i0b s SER 123 CO 0.07 -0.62 1.96 0.00 0.98 0.00 0.00 173.24 175.63 2i0b h ALA 124 N 2.00 1.45 -0.70 5.32 0.00 -1.98 -1.87 119.26 123.48 2i0b h ALA 124 Ca -0.27 -0.05 0.11 0.00 0.00 0.00 0.00 54.91 54.70 2i0b h ALA 124 Cb 1.22 -0.31 -0.08 0.00 0.00 0.00 0.00 17.79 18.61 2i0b h ALA 124 CO 0.28 0.49 0.30 -0.44 0.00 0.00 0.00 179.25 179.87 2i0b h ASP 125 N 1.08 0.33 -0.36 0.00 3.32 -1.95 0.20 116.42 119.04 2i0b h ASP 125 Ca 0.32 0.08 -0.06 0.00 0.02 0.00 0.00 57.03 57.39 2i0b h ASP 125 Cb -0.04 0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.53 2i0b h ASP 125 CO -0.08 0.17 0.02 0.44 -1.72 0.00 0.00 179.24 178.07 2i0b h ASP 126 N 0.49 0.68 -0.16 6.45 3.32 -1.74 -2.02 116.42 123.44 2i0b h ASP 126 Ca 0.36 -0.14 -0.09 0.00 0.02 0.00 0.00 57.03 57.18 2i0b h ASP 126 Cb 0.47 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 39.84 2i0b h ASP 126 CO -0.33 0.73 -0.25 -0.07 -1.72 0.00 0.00 179.24 177.60 2i0b h LEU 127 N 0.68 0.49 -1.40 1.55 3.38 -0.99 -3.28 115.31 115.74 2i0b h LEU 127 Ca 0.14 -0.53 0.09 0.00 0.09 0.00 0.00 57.88 57.67 2i0b h LEU 127 Cb 0.38 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 40.94 2i0b h LEU 127 CO 0.01 0.93 0.49 0.00 0.09 0.00 0.00 178.44 179.96 2i0b h ALA 128 N 0.58 1.80 -0.08 1.53 0.00 -0.23 -2.36 119.26 120.49 2i0b h ALA 128 Ca 0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2i0b h ALA 128 Cb 0.83 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.46 2i0b h ALA 128 CO 0.06 0.05 0.00 0.36 0.00 0.00 0.00 179.25 179.72 2i0b n LYS 129 N -4.49 1.24 -4.22 0.00 -0.00 -0.80 -4.84 118.16 105.05 2i0b n LYS 129 Ca 0.12 -0.37 -0.14 0.00 -0.00 0.00 0.00 58.31 57.92 2i0b n LYS 129 Cb 0.32 -1.23 -0.10 0.00 -0.00 0.00 0.00 35.03 34.02 2i0b n LYS 129 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.40 178.54 2i0b s GLN 130 N -1.90 1.34 0.00 -1.58 1.03 -0.89 -5.07 119.66 112.60 2i0b s GLN 130 Ca 0.21 -1.73 0.00 0.00 0.04 0.00 0.00 55.36 53.88 2i0b s GLN 130 Cb 0.10 0.28 0.00 0.00 0.03 0.00 0.00 33.01 33.43 2i0b s GLN 130 CO 0.16 -0.46 0.04 0.25 -2.54 0.00 0.00 175.29 172.75 2i0b n THR 131 N -0.36 0.00 -0.08 3.63 -2.24 -1.26 -4.84 114.28 109.13 2i0b n THR 131 Ca 0.03 -0.21 -0.08 0.00 -2.27 0.00 0.00 64.05 61.52 2i0b n THR 131 Cb 0.65 1.13 0.08 0.00 -2.10 0.00 0.00 70.33 70.08 2i0b n THR 131 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 2i0b h LYS 132 N 0.00 0.76 -5.35 -0.78 1.57 -1.97 -3.38 116.57 107.43 2i0b h LYS 132 Ca 0.00 -0.33 -0.63 0.00 -1.87 0.00 0.00 60.65 57.82 2i0b h LYS 132 Cb 0.06 -0.02 -0.13 0.00 0.08 0.00 0.00 32.23 32.22 2i0b h LYS 132 CO 0.00 0.95 0.00 0.42 -0.57 0.00 0.00 179.45 180.25 2i0b s ILE 133 N -4.52 5.03 0.74 1.86 1.01 -1.26 -4.94 121.20 119.12 2i0b s ILE 133 Ca -0.09 0.72 -0.11 0.00 0.00 0.00 0.00 60.65 61.17 2i0b s ILE 133 Cb 0.13 -3.90 0.03 0.00 0.01 0.00 0.00 42.46 38.73 2i0b s ILE 133 CO 0.84 -0.04 1.08 -1.61 0.00 0.00 0.00 174.94 175.21 2i0b s GLU 134 N 2.39 2.59 0.03 2.79 2.02 -0.75 -4.87 118.70 122.90 2i0b s GLU 134 Ca 0.21 0.75 -0.24 0.00 0.02 0.00 0.00 54.97 55.71 2i0b s GLU 134 Cb -0.15 -1.97 0.06 0.00 0.10 0.00 0.00 34.13 32.17 2i0b s GLU 134 CO 0.11 -1.29 0.55 1.52 0.02 0.00 0.00 175.26 176.16 2i0b s TYR 135 N -3.13 -0.47 0.00 1.61 -0.85 -1.26 -0.96 117.35 112.29 2i0b s TYR 135 Ca 0.59 0.58 0.00 0.00 -0.52 0.00 0.00 57.07 57.72 2i0b s TYR 135 Cb -0.14 0.36 0.00 0.00 0.38 0.00 0.00 41.96 42.57 2i0b s TYR 135 CO 0.54 -0.64 0.00 0.41 -1.52 0.00 0.00 175.55 174.34 2i0b n GLY 136 N 0.48 2.06 3.82 5.49 0.00 -1.14 -4.72 105.19 111.17 2i0b n GLY 136 Ca -0.18 -0.57 -0.08 0.00 0.00 0.00 0.00 46.02 45.18 2i0b n GLY 136 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2i0b s ALA 137 N -1.00 -0.85 0.14 4.61 0.00 -1.17 -0.45 121.76 123.02 2i0b s ALA 137 Ca 0.00 -0.64 -0.30 0.00 0.00 0.00 0.00 51.96 51.02 2i0b s ALA 137 Cb 0.00 0.73 -0.07 0.00 0.00 0.00 0.00 23.12 23.78 2i0b s ALA 137 CO 0.00 -1.00 1.17 0.08 0.00 0.00 0.00 175.76 176.01 2i0b s VAL 138 N -2.79 3.83 0.23 0.00 1.01 -1.26 -0.84 120.40 120.57 2i0b s VAL 138 Ca 0.14 1.45 -0.30 0.00 0.00 0.00 0.00 61.98 63.28 2i0b s VAL 138 Cb -0.05 -3.93 -0.09 0.00 0.00 0.00 0.00 36.38 32.31 2i0b s VAL 138 CO 0.10 0.19 1.27 -0.70 0.00 0.00 0.00 175.10 175.97 2i0b s GLU 139 N 0.23 4.42 -1.27 2.72 2.12 0.14 -3.40 118.70 123.66 2i0b s GLU 139 Ca 0.54 2.03 -0.01 0.00 0.36 0.00 0.00 54.97 57.89 2i0b s GLU 139 Cb -0.31 -3.18 0.00 0.00 0.26 0.00 0.00 34.13 30.91 2i0b s GLU 139 CO 0.33 -0.17 0.19 -0.25 -0.54 0.00 0.00 175.26 174.82 2i0b n ASP 140 N 2.18 -4.83 -4.66 -1.70 8.00 -1.26 -4.81 116.55 109.47 2i0b n ASP 140 Ca 0.04 -0.10 -0.32 0.00 0.71 0.00 0.00 54.79 55.12 2i0b n ASP 140 Cb 0.43 -3.85 -0.08 0.00 -0.02 0.00 0.00 41.12 37.61 2i0b n ASP 140 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2i0b s GLY 141 N -2.50 2.99 0.33 0.44 0.00 -1.22 -1.43 107.32 105.93 2i0b s GLY 141 Ca 0.10 -0.44 0.04 0.00 0.00 0.00 0.00 44.72 44.41 2i0b s GLY 141 CO 0.12 -2.15 1.88 0.00 0.00 0.00 0.00 173.10 172.95 2i0b h ALA 142 N 1.40 1.37 -0.23 3.20 0.00 -1.88 -2.02 119.26 121.10 2i0b h ALA 142 Ca -0.43 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.22 2i0b h ALA 142 Cb 1.31 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 2i0b h ALA 142 CO 0.71 0.44 -0.14 1.15 0.00 0.00 0.00 179.25 181.42 2i0b h THR 143 N 0.54 1.31 -0.05 0.00 2.02 -1.95 0.15 112.91 114.94 2i0b h THR 143 Ca 0.12 -1.23 0.03 0.00 0.77 0.00 0.00 66.41 66.10 2i0b h THR 143 Cb 0.30 1.62 -0.04 0.00 -1.74 0.00 0.00 68.15 68.29 2i0b h THR 143 CO 0.01 0.38 -0.16 -0.03 0.37 0.00 0.00 175.52 176.09 2i0b h MET 144 N 0.21 -0.23 -0.95 6.66 -1.53 -1.69 -2.33 114.93 115.06 2i0b h MET 144 Ca 0.05 0.02 0.07 0.00 -3.44 0.00 0.00 59.70 56.39 2i0b h MET 144 Cb 0.65 0.05 -0.06 0.00 -0.55 0.00 0.00 31.60 31.69 2i0b h MET 144 CO 0.04 -0.15 0.62 1.15 0.14 0.00 0.00 176.91 178.70 2i0b h THR 145 N -0.24 1.06 0.04 -0.77 2.02 -1.15 0.11 112.91 113.98 2i0b h THR 145 Ca 0.07 -0.37 0.03 0.00 0.77 0.00 0.00 66.41 66.90 2i0b h THR 145 Cb 0.33 -0.12 -0.05 0.00 -1.74 0.00 0.00 68.15 66.58 2i0b h THR 145 CO -0.19 0.20 -0.35 0.15 0.37 0.00 0.00 175.52 175.70 2i0b h PHE 146 N 1.09 -0.97 -0.55 3.16 3.57 -0.20 -0.51 116.94 122.53 2i0b h PHE 146 Ca 0.42 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.90 2i0b h PHE 146 Cb 0.21 0.42 -0.03 0.00 2.79 0.00 0.00 35.95 39.35 2i0b h PHE 146 CO -0.00 -0.45 0.14 0.74 -2.23 0.00 0.00 178.31 176.51 2i0b h PHE 147 N -0.53 0.86 -0.66 0.41 -1.00 -0.77 0.02 116.94 115.27 2i0b h PHE 147 Ca 0.05 -0.08 -0.05 0.00 2.81 0.00 0.00 57.97 60.70 2i0b h PHE 147 Cb 0.60 -0.25 -0.03 0.00 3.61 0.00 0.00 35.95 39.88 2i0b h PHE 147 CO -0.35 0.71 0.22 -0.22 -1.61 0.00 0.00 178.31 177.06 2i0b h LYS 148 N 0.81 1.00 0.00 1.51 3.64 -0.52 -3.22 116.57 119.78 2i0b h LYS 148 Ca 0.18 -0.19 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2i0b h LYS 148 Cb 0.28 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 31.95 2i0b h LYS 148 CO -0.00 0.84 -1.43 1.63 -2.27 0.00 0.00 179.45 178.22 2i0b n LYS 149 N -4.28 0.47 -1.82 1.90 4.76 -0.23 -4.98 118.16 113.99 2i0b n LYS 149 Ca 0.05 -0.06 -0.40 0.00 -2.87 0.00 0.00 58.31 55.03 2i0b n LYS 149 Cb 0.21 -1.59 0.01 0.00 -1.84 0.00 0.00 35.03 31.81 2i0b n LYS 149 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2i0b s SER 150 N -4.32 6.14 0.00 4.39 0.15 -0.02 -4.91 113.70 115.13 2i0b s SER 150 Ca -0.01 2.97 0.18 0.00 0.70 0.00 0.00 55.95 59.78 2i0b s SER 150 Cb 0.14 -2.66 0.38 0.00 -1.71 0.00 0.00 66.02 62.16 2i0b s SER 150 CO 0.85 -1.00 1.30 0.29 1.20 0.00 0.00 173.24 175.88 2i0b n LYS 151 N 0.16 2.35 -2.20 5.44 4.76 -1.26 -4.39 118.16 123.02 2i0b n LYS 151 Ca 0.03 -2.12 -0.42 0.00 -2.87 0.00 0.00 58.31 52.93 2i0b n LYS 151 Cb 0.41 -1.41 -0.03 0.00 -1.84 0.00 0.00 35.03 32.16 2i0b n LYS 151 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2i0b s ILE 152 N -1.19 3.69 0.24 -0.18 -1.09 -1.26 -4.90 121.20 116.52 2i0b s ILE 152 Ca 0.32 1.06 -0.06 0.00 -2.23 0.00 0.00 60.65 59.74 2i0b s ILE 152 Cb 0.18 -3.68 0.21 0.00 -1.58 0.00 0.00 42.46 37.59 2i0b s ILE 152 CO 0.25 -0.01 1.70 0.77 -1.23 0.00 0.00 174.94 176.42 2i0b h SER 153 N 7.98 0.10 -0.71 3.58 4.64 -1.98 0.35 113.55 127.50 2i0b h SER 153 Ca -0.38 0.13 0.06 0.00 -0.47 0.00 0.00 61.79 61.13 2i0b h SER 153 Cb 1.18 0.15 -0.05 0.00 -0.31 0.00 0.00 62.40 63.36 2i0b h SER 153 CO 0.91 0.02 0.41 0.74 -0.87 0.00 0.00 176.83 178.04 2i0b h THR 154 N 0.32 1.00 0.03 2.95 2.02 -1.99 0.80 112.91 118.04 2i0b h THR 154 Ca 0.39 -0.26 -0.22 0.00 0.77 0.00 0.00 66.41 67.09 2i0b h THR 154 Cb 0.63 0.17 -0.02 0.00 -1.74 0.00 0.00 68.15 67.19 2i0b h THR 154 CO -0.45 0.14 -1.02 1.88 0.37 0.00 0.00 175.52 176.44 2i0b h TYR 155 N 0.76 0.13 -0.44 3.16 0.99 -1.54 -1.98 116.97 118.06 2i0b h TYR 155 Ca 0.31 -0.09 -0.12 0.00 2.00 0.00 0.00 58.73 60.83 2i0b h TYR 155 Cb 0.16 -0.01 -0.01 0.00 1.00 0.00 0.00 36.73 37.87 2i0b h TYR 155 CO -0.06 1.04 -0.18 0.22 -0.00 0.00 0.00 178.16 179.18 2i0b h ASP 156 N 0.03 0.92 -0.71 3.88 3.58 -0.75 -0.38 116.42 122.98 2i0b h ASP 156 Ca -0.04 -0.39 0.03 0.00 0.42 0.00 0.00 57.03 57.06 2i0b h ASP 156 Cb 1.75 -0.25 -0.05 0.00 1.72 0.00 0.00 39.33 42.50 2i0b h ASP 156 CO 0.14 1.10 0.44 0.50 -2.88 0.00 0.00 179.24 178.55 2i0b h LYS 157 N 0.73 0.83 -0.39 0.28 3.64 -0.74 -0.75 116.57 120.17 2i0b h LYS 157 Ca 0.10 -0.05 -0.11 0.00 -1.27 0.00 0.00 60.65 59.32 2i0b h LYS 157 Cb 0.74 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 32.35 2i0b h LYS 157 CO 0.06 0.55 -0.20 0.52 -2.27 0.00 0.00 179.45 178.11 2i0b h MET 158 N 0.86 0.76 -0.60 1.90 2.86 -1.09 -2.26 114.93 117.36 2i0b h MET 158 Ca 0.29 -0.29 -0.06 0.00 -2.06 0.00 0.00 59.70 57.58 2i0b h MET 158 Cb 0.04 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 31.63 2i0b h MET 158 CO -0.12 0.90 0.14 2.35 1.06 0.00 0.00 176.91 181.24 2i0b h TRP 159 N 0.67 1.01 -0.96 -0.22 2.91 -0.78 0.27 115.95 118.85 2i0b h TRP 159 Ca 0.10 -0.12 0.05 0.00 1.13 0.00 0.00 58.89 60.04 2i0b h TRP 159 Cb 0.69 -0.28 -0.06 0.00 -0.51 0.00 0.00 29.16 29.00 2i0b h TRP 159 CO 0.04 0.86 0.63 0.00 -1.03 0.00 0.00 178.44 178.93 2i0b h ALA 160 N 1.03 1.41 0.28 2.65 0.00 -0.88 0.11 119.26 123.86 2i0b h ALA 160 Ca 0.19 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 2i0b h ALA 160 Cb 0.36 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2i0b h ALA 160 CO 0.00 0.48 -0.14 0.35 0.00 0.00 0.00 179.25 179.95 2i0b h PHE 161 N 1.17 -0.35 -0.51 0.00 3.57 -1.06 -2.35 116.94 117.41 2i0b h PHE 161 Ca 0.39 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.91 2i0b h PHE 161 Cb 0.07 0.12 -0.03 0.00 2.79 0.00 0.00 35.95 38.90 2i0b h PHE 161 CO -0.00 -0.04 0.31 0.52 -2.23 0.00 0.00 178.31 176.87 2i0b h MET 162 N -0.67 0.61 -0.84 1.11 2.86 -0.67 -1.96 114.93 115.36 2i0b h MET 162 Ca -0.04 -0.04 0.02 0.00 -2.06 0.00 0.00 59.70 57.58 2i0b h MET 162 Cb 0.47 -0.14 -0.05 0.00 0.06 0.00 0.00 31.60 31.95 2i0b h MET 162 CO 0.06 0.40 0.55 1.03 1.06 0.00 0.00 176.91 180.02 2i0b h SER 163 N 0.63 0.93 0.52 1.22 0.87 -0.86 -0.94 113.55 115.92 2i0b h SER 163 Ca 0.20 -0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.75 2i0b h SER 163 Cb -0.00 -0.22 0.00 0.00 -0.44 0.00 0.00 62.40 61.74 2i0b h SER 163 CO -0.08 0.66 0.00 0.77 -0.53 0.00 0.00 176.83 177.65 2i0b h SER 164 N 1.10 0.00 -0.25 6.23 4.64 -0.79 -2.36 113.55 122.12 2i0b h SER 164 Ca 0.32 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.42 2i0b h SER 164 Cb -0.07 0.00 -0.28 0.00 -0.31 0.00 0.00 62.40 61.75 2i0b h SER 164 CO -0.09 0.00 -0.83 0.54 -0.87 0.00 0.00 176.83 175.58 2i0b n ARG 165 N -2.55 1.67 -0.24 4.77 1.74 -0.83 -4.91 116.66 116.30 2i0b n ARG 165 Ca 0.00 -3.20 0.04 0.00 -0.77 0.00 0.00 57.85 53.92 2i0b n ARG 165 Cb 0.18 -1.35 0.15 0.00 -1.02 0.00 0.00 32.46 30.42 2i0b n ARG 165 CO 0.00 0.00 0.00 -0.09 -1.52 0.00 0.00 177.63 176.02 2i0b h ARG 166 N 1.57 0.13 0.00 5.56 2.43 -0.63 0.29 114.38 123.73 2i0b h ARG 166 Ca -0.00 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.14 2i0b h ARG 166 Cb 1.41 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 30.93 2i0b h ARG 166 CO 0.23 0.09 -0.08 -0.56 -1.51 0.00 0.00 179.97 178.14 2i0b h GLN 167 N 0.14 0.00 0.01 0.20 3.07 -1.87 -1.77 115.11 114.89 2i0b h GLN 167 Ca 0.39 0.00 -0.35 0.00 0.09 0.00 0.00 58.65 58.77 2i0b h GLN 167 Cb 0.67 0.00 -0.05 0.00 0.08 0.00 0.00 27.48 28.18 2i0b h GLN 167 CO -0.60 0.08 -1.96 0.43 0.09 0.00 0.00 178.83 176.87 2i0b n SER 168 N -3.75 1.93 0.07 0.06 7.64 -0.10 -4.72 113.62 114.75 2i0b n SER 168 Ca -0.02 0.32 0.09 0.00 1.01 0.00 0.00 58.87 60.27 2i0b n SER 168 Cb 0.18 -0.85 -0.04 0.00 -1.01 0.00 0.00 64.21 62.49 2i0b n SER 168 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 2i0b n VAL 169 N -4.18 0.64 -3.18 0.44 0.24 -0.14 -4.69 118.33 107.46 2i0b n VAL 169 Ca -0.43 -0.57 -0.41 0.00 -2.04 0.00 0.00 64.34 60.90 2i0b n VAL 169 Cb 0.82 -0.36 -0.07 0.00 -1.47 0.00 0.00 33.84 32.77 2i0b n VAL 169 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2i0b s LEU 170 N -5.31 4.10 0.31 1.34 1.43 -0.67 -3.06 118.68 116.82 2i0b s LEU 170 Ca -0.02 0.48 0.07 0.00 -1.03 0.00 0.00 54.13 53.63 2i0b s LEU 170 Cb 0.10 -2.74 -0.03 0.00 0.03 0.00 0.00 46.19 43.55 2i0b s LEU 170 CO 0.81 -0.38 0.25 0.68 0.23 0.00 0.00 176.35 177.94 2i0b s VAL 171 N 2.44 3.82 -0.06 -1.59 -7.23 -0.02 -4.71 120.40 113.05 2i0b s VAL 171 Ca 0.23 -1.40 0.21 0.00 -1.81 0.00 0.00 61.98 59.20 2i0b s VAL 171 Cb -0.15 -3.24 0.19 0.00 0.56 0.00 0.00 36.38 33.74 2i0b s VAL 171 CO 0.10 -0.24 1.66 0.11 -0.31 0.00 0.00 175.10 176.42 2i0b h LYS 172 N 1.35 0.00 -3.27 4.82 1.57 -1.92 0.41 116.57 119.53 2i0b h LYS 172 Ca -0.46 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.31 2i0b h LYS 172 Cb 1.25 0.00 -0.10 0.00 0.08 0.00 0.00 32.23 33.46 2i0b h LYS 172 CO 0.59 0.28 0.05 -1.54 -0.57 0.00 0.00 179.45 178.27 2i0b s SER 173 N -6.28 -0.27 0.35 0.86 1.04 -1.26 -4.74 113.70 103.41 2i0b s SER 173 Ca 0.03 -0.49 0.03 0.00 0.48 0.00 0.00 55.95 55.99 2i0b s SER 173 Cb 0.08 0.60 0.65 0.00 0.10 0.00 0.00 66.02 67.45 2i0b s SER 173 CO 0.68 -1.09 2.01 0.78 0.98 0.00 0.00 173.24 176.60 2i0b h ASN 174 N 2.17 0.70 -0.34 7.02 2.35 -1.96 -2.02 115.58 123.49 2i0b h ASN 174 Ca -0.28 -0.02 0.02 0.00 -0.55 0.00 0.00 56.30 55.47 2i0b h ASN 174 Cb 1.26 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 39.43 2i0b h ASN 174 CO 0.36 0.52 0.19 -0.08 -1.65 0.00 0.00 177.43 176.76 2i0b h GLU 175 N 0.82 0.38 -0.35 0.81 4.57 -1.98 0.07 114.58 118.90 2i0b h GLU 175 Ca 0.22 -0.02 -0.02 0.00 -1.18 0.00 0.00 59.36 58.35 2i0b h GLU 175 Cb -0.07 -0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 28.41 2i0b h GLU 175 CO -0.05 0.25 0.11 1.49 -1.18 0.00 0.00 179.01 179.64 2i0b h GLU 176 N 0.39 0.51 -0.29 1.92 4.81 -1.82 -1.05 114.58 119.06 2i0b h GLU 176 Ca 0.14 -0.07 -0.15 0.00 -0.13 0.00 0.00 59.36 59.14 2i0b h GLU 176 Cb 0.02 -0.09 -0.00 0.00 0.63 0.00 0.00 28.75 29.30 2i0b h GLU 176 CO -0.07 0.45 -0.43 0.78 -0.73 0.00 0.00 179.01 179.01 2i0b h GLY 177 N 0.69 0.87 1.02 1.92 0.00 -0.73 -0.52 103.07 106.32 2i0b h GLY 177 Ca 0.12 -0.97 -0.04 0.00 0.00 0.00 0.00 47.33 46.45 2i0b h GLY 177 CO -0.01 0.87 0.29 -2.22 0.00 0.00 0.00 176.54 175.47 2i0b h ILE 178 N 0.56 1.24 -0.56 2.60 2.04 -0.74 -0.23 117.51 122.42 2i0b h ILE 178 Ca 0.03 -0.75 -0.09 0.00 1.00 0.00 0.00 64.86 65.04 2i0b h ILE 178 Cb 1.02 0.43 -0.02 0.00 -0.74 0.00 0.00 36.82 37.51 2i0b h ILE 178 CO 0.10 0.30 -0.01 1.56 0.00 0.00 0.00 178.15 180.10 2i0b h GLN 179 N 1.00 0.98 -0.82 2.37 1.08 -1.09 -1.26 115.11 117.36 2i0b h GLN 179 Ca 0.23 -0.30 0.01 0.00 -1.45 0.00 0.00 58.65 57.14 2i0b h GLN 179 Cb 0.20 -0.09 -0.04 0.00 -0.05 0.00 0.00 27.48 27.49 2i0b h GLN 179 CO -0.02 0.97 0.54 -0.09 -0.95 0.00 0.00 178.83 179.28 2i0b h ARG 180 N 0.90 1.09 -0.75 1.46 9.65 -0.69 0.16 114.38 126.19 2i0b h ARG 180 Ca 0.16 -0.07 -0.04 0.00 -1.10 0.00 0.00 59.98 58.93 2i0b h ARG 180 Cb 0.54 -0.24 -0.03 0.00 -1.39 0.00 0.00 29.97 28.85 2i0b h ARG 180 CO 0.03 0.73 0.29 0.28 2.80 0.00 0.00 179.97 184.10 2i0b h VAL 181 N 1.12 1.25 0.00 0.20 2.07 -0.38 -1.37 116.25 119.15 2i0b h VAL 181 Ca 0.30 -0.80 -0.11 0.00 0.82 0.00 0.00 66.70 66.92 2i0b h VAL 181 Cb -0.12 0.36 -0.02 0.00 -1.52 0.00 0.00 31.29 30.00 2i0b h VAL 181 CO -0.06 0.32 -0.50 -0.07 0.02 0.00 0.00 177.57 177.28 2i0b h LEU 182 N 1.09 0.00 -0.49 2.57 3.38 -0.53 -3.35 115.31 117.97 2i0b h LEU 182 Ca 0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.22 2i0b h LEU 182 Cb 0.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.96 2i0b h LEU 182 CO -0.02 0.50 -0.49 0.35 0.09 0.00 0.00 178.44 178.87 2i0b n THR 183 N -3.32 0.00 -3.99 0.22 -2.24 0.49 -5.04 114.28 100.38 2i0b n THR 183 Ca 0.01 -0.25 -0.13 0.00 -2.27 0.00 0.00 64.05 61.41 2i0b n THR 183 Cb 0.68 1.11 -0.03 0.00 -2.10 0.00 0.00 70.33 69.99 2i0b n THR 183 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2i0b n SER 184 N -0.66 -1.17 -4.41 3.42 3.41 -0.53 -5.06 113.62 108.62 2i0b n SER 184 Ca 0.05 -2.64 -0.45 0.00 -0.26 0.00 0.00 58.87 55.57 2i0b n SER 184 Cb 0.29 2.19 -0.03 0.00 -0.26 0.00 0.00 64.21 66.40 2i0b n SER 184 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2i0b s ASP 185 N -2.88 6.63 -0.12 4.04 2.15 -1.26 -4.68 116.67 120.55 2i0b s ASP 185 Ca 0.25 -2.18 -0.10 0.00 0.43 0.00 0.00 52.55 50.95 2i0b s ASP 185 Cb -0.01 -2.33 0.04 0.00 -0.30 0.00 0.00 42.92 40.31 2i0b s ASP 185 CO 0.18 -0.92 0.32 -0.47 -0.17 0.00 0.00 175.17 174.11 2i0b s TYR 186 N 1.92 -0.37 -0.07 -5.34 5.04 -1.26 -1.80 117.35 115.46 2i0b s TYR 186 Ca 0.26 0.89 -0.00 0.00 -2.44 0.00 0.00 57.07 55.78 2i0b s TYR 186 Cb -0.08 0.13 -0.03 0.00 0.35 0.00 0.00 41.96 42.32 2i0b s TYR 186 CO -0.08 -0.19 -0.04 0.00 -1.34 0.00 0.00 175.55 173.90 2i0b s ALA 187 N 0.41 3.13 -0.14 3.97 0.00 -0.13 -4.45 121.76 124.54 2i0b s ALA 187 Ca -0.02 -0.85 -0.02 0.00 0.00 0.00 0.00 51.96 51.07 2i0b s ALA 187 Cb -0.04 -1.35 -0.02 0.00 0.00 0.00 0.00 23.12 21.72 2i0b s ALA 187 CO -0.02 0.58 -0.09 0.12 0.00 0.00 0.00 175.76 176.35 2i0b s PHE 188 N -0.85 2.90 -0.33 0.00 5.36 -0.13 -2.90 117.98 122.03 2i0b s PHE 188 Ca 0.13 -0.53 -0.22 0.00 -0.96 0.00 0.00 56.93 55.36 2i0b s PHE 188 Cb -0.11 -1.90 -0.00 0.00 -0.34 0.00 0.00 43.02 40.67 2i0b s PHE 188 CO 0.02 -0.16 0.71 -0.51 -1.46 0.00 0.00 175.22 173.82 2i0b s LEU 189 N 0.40 4.15 0.15 6.12 1.43 0.40 -0.38 118.68 130.95 2i0b s LEU 189 Ca -0.08 0.42 -0.12 0.00 -1.03 0.00 0.00 54.13 53.33 2i0b s LEU 189 Cb -0.15 -2.93 0.01 0.00 0.03 0.00 0.00 46.19 43.15 2i0b s LEU 189 CO 0.04 -0.59 0.33 0.00 0.23 0.00 0.00 176.35 176.36 2i0b s MET 190 N 2.83 1.15 0.28 1.70 0.23 -0.58 -4.52 119.30 120.40 2i0b s MET 190 Ca 0.28 -1.02 -0.29 0.00 -1.03 0.00 0.00 55.69 53.63 2i0b s MET 190 Cb -0.14 0.41 -0.10 0.00 -1.53 0.00 0.00 34.83 33.47 2i0b s MET 190 CO 0.14 -0.43 1.21 -1.21 -2.03 0.00 0.00 175.02 172.69 2i0b s GLU 191 N -3.91 4.50 0.46 3.16 2.02 -1.26 -0.60 118.70 123.06 2i0b s GLU 191 Ca 0.12 1.99 0.12 0.00 0.02 0.00 0.00 54.97 57.22 2i0b s GLU 191 Cb 0.02 -3.15 1.03 0.00 0.10 0.00 0.00 34.13 32.14 2i0b s GLU 191 CO -0.04 -0.01 2.06 0.66 0.02 0.00 0.00 175.26 177.95 2i0b h SER 192 N 3.93 0.17 -0.52 -0.19 4.64 -0.77 -1.31 113.55 119.50 2i0b h SER 192 Ca -0.47 -0.01 -0.09 0.00 -0.47 0.00 0.00 61.79 60.74 2i0b h SER 192 Cb 1.22 -0.04 -0.02 0.00 -0.31 0.00 0.00 62.40 63.25 2i0b h SER 192 CO 0.68 0.19 -0.04 0.71 -0.87 0.00 0.00 176.83 177.50 2i0b h THR 193 N 0.19 1.27 -0.24 2.95 1.35 -1.89 -1.16 112.91 115.38 2i0b h THR 193 Ca 0.05 -1.16 -0.12 0.00 -0.55 0.00 0.00 66.41 64.63 2i0b h THR 193 Cb 0.09 0.96 -0.00 0.00 -1.73 0.00 0.00 68.15 67.48 2i0b h THR 193 CO -0.00 0.41 -0.32 0.74 -0.25 0.00 0.00 175.52 176.10 2i0b h THR 194 N 0.82 1.31 -0.82 6.82 2.02 -1.74 -2.90 112.91 118.43 2i0b h THR 194 Ca 0.14 -1.51 0.12 0.00 0.77 0.00 0.00 66.41 65.93 2i0b h THR 194 Cb 0.58 1.71 -0.08 0.00 -1.74 0.00 0.00 68.15 68.62 2i0b h THR 194 CO 0.03 0.47 0.43 0.40 0.37 0.00 0.00 175.52 177.23 2i0b h ILE 195 N 0.36 0.81 -0.75 3.11 2.04 -1.09 -1.42 117.51 120.57 2i0b h ILE 195 Ca 0.03 -0.23 0.08 0.00 1.00 0.00 0.00 64.86 65.73 2i0b h ILE 195 Cb 0.90 0.07 -0.06 0.00 -0.74 0.00 0.00 36.82 36.99 2i0b h ILE 195 CO 0.08 0.12 0.42 -0.33 0.00 0.00 0.00 178.15 178.44 2i0b h GLU 196 N 0.68 0.72 -0.08 2.37 5.08 -1.07 -0.45 114.58 121.82 2i0b h GLU 196 Ca 0.42 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.73 2i0b h GLU 196 Cb 0.50 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.59 2i0b h GLU 196 CO -0.31 0.48 0.03 0.35 -1.00 0.00 0.00 179.01 178.57 2i0b h PHE 197 N 0.74 0.13 -0.62 4.33 3.57 -1.12 -3.04 116.94 120.92 2i0b h PHE 197 Ca 0.35 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.81 2i0b h PHE 197 Cb 0.27 -0.04 -0.03 0.00 2.79 0.00 0.00 35.95 38.95 2i0b h PHE 197 CO -0.07 0.23 0.29 0.28 -2.23 0.00 0.00 178.31 176.81 2i0b h VAL 198 N -0.02 1.22 0.00 1.41 2.07 -0.90 -2.92 116.25 117.11 2i0b h VAL 198 Ca 0.03 -0.64 -0.01 0.00 0.82 0.00 0.00 66.70 66.90 2i0b h VAL 198 Cb 0.16 0.49 -0.00 0.00 -1.52 0.00 0.00 31.29 30.41 2i0b h VAL 198 CO -0.00 0.26 -0.04 0.71 0.02 0.00 0.00 177.57 178.52 2i0b h THR 199 N 0.86 0.08 0.00 2.57 1.35 -1.12 -1.65 112.91 115.00 2i0b h THR 199 Ca 0.21 -0.77 0.00 0.00 -0.55 0.00 0.00 66.41 65.30 2i0b h THR 199 Cb 0.14 1.71 0.00 0.00 -1.73 0.00 0.00 68.15 68.27 2i0b h THR 199 CO -0.02 0.04 0.00 0.00 -0.25 0.00 0.00 175.52 175.28 2i0b n GLN 200 N -3.13 0.00 -0.00 4.72 6.02 -1.11 -3.57 117.38 120.32 2i0b n GLN 200 Ca 0.02 0.04 0.02 0.00 -0.01 0.00 0.00 57.00 57.07 2i0b n GLN 200 Cb 0.40 -1.50 -0.03 0.00 1.02 0.00 0.00 30.24 30.13 2i0b n GLN 200 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2i0b n ARG 201 N -1.51 5.00 -3.62 -1.09 1.74 -0.75 -2.86 116.66 113.57 2i0b n ARG 201 Ca 0.06 -0.00 -0.29 0.00 -0.77 0.00 0.00 57.85 56.85 2i0b n ARG 201 Cb 0.31 -0.76 -0.13 0.00 -1.02 0.00 0.00 32.46 30.86 2i0b n ARG 201 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 2i0b s ASN 202 N -1.54 3.50 0.00 0.55 0.01 -0.70 -5.02 114.94 111.75 2i0b s ASN 202 Ca 0.01 -2.11 0.12 0.00 -0.71 0.00 0.00 52.86 50.17 2i0b s ASN 202 Cb 0.04 -0.71 0.55 0.00 0.41 0.00 0.00 41.25 41.53 2i0b s ASN 202 CO 0.19 -0.33 1.33 0.00 -1.51 0.00 0.00 177.10 176.78 2i0b n ASN 204 N -1.39 0.78 -4.86 0.00 6.94 -1.26 -4.90 115.26 110.58 2i0b n ASN 204 Ca 0.04 -0.63 -0.26 0.00 -0.02 0.00 0.00 54.58 53.71 2i0b n ASN 204 Cb 0.11 0.13 -0.04 0.00 -2.36 0.00 0.00 39.78 37.62 2i0b n ASN 204 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 2i0b s LEU 205 N -2.66 4.03 0.14 -4.53 1.43 -0.54 -1.32 118.68 115.23 2i0b s LEU 205 Ca 0.20 -0.00 -0.15 0.00 -1.03 0.00 0.00 54.13 53.15 2i0b s LEU 205 Cb 0.19 -2.62 0.03 0.00 0.03 0.00 0.00 46.19 43.81 2i0b s LEU 205 CO 0.57 0.06 0.41 0.28 0.23 0.00 0.00 176.35 177.91 2i0b s THR 206 N -1.74 0.06 0.22 5.49 -1.32 0.73 -4.77 115.64 114.31 2i0b s THR 206 Ca 0.32 -0.73 -0.27 0.00 -1.21 0.00 0.00 61.69 59.81 2i0b s THR 206 Cb -0.10 -1.34 -0.09 0.00 -1.51 0.00 0.00 72.50 69.46 2i0b s THR 206 CO 0.25 -0.28 0.86 -1.58 -2.21 0.00 0.00 174.62 171.67 2i0b s GLN 207 N -3.84 4.67 -0.15 7.08 0.74 -1.26 -1.30 119.66 125.60 2i0b s GLN 207 Ca 0.06 1.30 -0.01 0.00 0.05 0.00 0.00 55.36 56.76 2i0b s GLN 207 Cb 0.01 -3.18 -0.01 0.00 1.10 0.00 0.00 33.01 30.93 2i0b s GLN 207 CO -0.09 0.50 -0.12 0.42 -0.55 0.00 0.00 175.29 175.46 2i0b s ILE 208 N -1.25 3.03 0.01 -2.34 -1.09 0.11 -4.94 121.20 114.74 2i0b s ILE 208 Ca 0.40 -0.65 0.00 0.00 -2.23 0.00 0.00 60.65 58.17 2i0b s ILE 208 Cb -0.23 -2.30 0.00 0.00 -1.58 0.00 0.00 42.46 38.35 2i0b s ILE 208 CO 0.28 0.51 0.00 0.61 -1.23 0.00 0.00 174.94 175.11 2i0b n GLY 209 N 3.86 -1.81 0.00 6.18 0.00 -1.23 -3.56 105.19 108.63 2i0b n GLY 209 Ca -0.18 -1.32 0.00 0.00 0.00 0.00 0.00 46.02 44.52 2i0b n GLY 209 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2i0b n GLY 210 N -0.29 2.58 3.70 -0.02 0.00 -1.26 -4.87 105.19 105.03 2i0b n GLY 210 Ca 0.00 -1.90 -0.42 0.00 0.00 0.00 0.00 46.02 43.69 2i0b n GLY 210 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2i0b s LEU 211 N 0.00 4.30 0.18 0.99 1.02 -1.26 -4.59 118.68 119.33 2i0b s LEU 211 Ca 0.00 1.57 0.04 0.00 0.02 0.00 0.00 54.13 55.77 2i0b s LEU 211 Cb 0.00 -3.54 0.05 0.00 0.02 0.00 0.00 46.19 42.71 2i0b s LEU 211 CO 0.00 -0.35 1.42 0.40 0.02 0.00 0.00 176.35 177.84 2i0b h ILE 212 N 4.95 1.50 -1.98 -0.59 2.04 -0.92 -3.48 117.51 119.04 2i0b h ILE 212 Ca -0.36 -2.57 0.00 0.00 1.00 0.00 0.00 64.86 62.93 2i0b h ILE 212 Cb 1.18 2.42 0.00 0.00 -0.74 0.00 0.00 36.82 39.68 2i0b h ILE 212 CO 0.80 0.75 0.00 -0.90 0.00 0.00 0.00 178.15 178.80 2i0b n ASP 213 N -3.67 0.00 -3.78 1.72 5.75 -1.26 -4.95 116.55 110.36 2i0b n ASP 213 Ca -0.03 -0.98 -0.13 0.00 -0.01 0.00 0.00 54.79 53.64 2i0b n ASP 213 Cb 0.78 0.00 -0.14 0.00 -1.03 0.00 0.00 41.12 40.73 2i0b n ASP 213 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 2i0b s SER 214 N -0.95 -0.10 0.18 -1.12 1.04 -1.26 -4.29 113.70 107.19 2i0b s SER 214 Ca 0.00 0.26 -0.05 0.00 0.48 0.00 0.00 55.95 56.64 2i0b s SER 214 Cb 0.00 0.19 0.02 0.00 0.10 0.00 0.00 66.02 66.33 2i0b s SER 214 CO 0.00 -0.11 0.33 2.29 0.98 0.00 0.00 173.24 176.73 2i0b n LYS 215 N 3.76 0.48 -4.09 4.02 2.85 -0.34 -5.00 118.16 119.85 2i0b n LYS 215 Ca -0.21 -1.10 -0.10 0.00 -1.05 0.00 0.00 58.31 55.85 2i0b n LYS 215 Cb 0.54 1.28 -0.09 0.00 -0.65 0.00 0.00 35.03 36.12 2i0b n LYS 215 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 177.40 177.55 2i0b s GLY 216 N -1.97 0.84 -0.05 2.58 0.00 -1.26 -0.51 107.32 106.94 2i0b s GLY 216 Ca 0.09 -1.28 -0.04 0.00 0.00 0.00 0.00 44.72 43.49 2i0b s GLY 216 CO 0.07 -1.17 0.15 -0.19 0.00 0.00 0.00 173.10 171.95 2i0b s TYR 217 N -4.03 3.52 0.14 1.90 4.12 -0.36 -1.11 117.35 121.53 2i0b s TYR 217 Ca 0.23 0.40 -0.05 0.00 0.02 0.00 0.00 57.07 57.66 2i0b s TYR 217 Cb 0.06 -1.86 -0.02 0.00 -1.52 0.00 0.00 41.96 38.62 2i0b s TYR 217 CO 0.02 0.66 0.17 0.20 0.02 0.00 0.00 175.55 176.62 2i0b s GLY 218 N -1.54 0.65 -0.03 0.71 0.00 -0.98 -0.45 107.32 105.68 2i0b s GLY 218 Ca 0.22 -1.11 -0.30 0.00 0.00 0.00 0.00 44.72 43.52 2i0b s GLY 218 CO 0.12 -1.07 1.04 0.14 0.00 0.00 0.00 173.10 173.33 2i0b s VAL 219 N -3.99 4.66 0.14 1.40 1.01 -1.26 -4.44 120.40 117.92 2i0b s VAL 219 Ca 0.18 1.92 -0.13 0.00 0.00 0.00 0.00 61.98 63.95 2i0b s VAL 219 Cb 0.05 -4.23 -0.07 0.00 0.00 0.00 0.00 36.38 32.13 2i0b s VAL 219 CO -0.01 0.09 0.53 -0.83 0.00 0.00 0.00 175.10 174.88 2i0b s GLY 220 N 1.10 2.43 0.06 4.51 0.00 -0.60 -0.87 107.32 113.95 2i0b s GLY 220 Ca 0.52 -0.17 -0.00 0.00 0.00 0.00 0.00 44.72 45.06 2i0b s GLY 220 CO 0.25 0.09 -0.04 -0.51 0.00 0.00 0.00 173.10 172.89 2i0b s THR 221 N -1.47 0.31 0.72 0.90 -4.23 0.26 -0.93 115.64 111.19 2i0b s THR 221 Ca 0.37 -1.81 -0.15 0.00 -1.18 0.00 0.00 61.69 58.92 2i0b s THR 221 Cb -0.15 -1.53 0.03 0.00 1.34 0.00 0.00 72.50 72.20 2i0b s THR 221 CO 0.19 -0.97 1.19 -2.84 -0.54 0.00 0.00 174.62 171.65 2i0b s PRO 222 N -3.85 2.25 0.33 3.99 0.02 -1.26 -1.08 135.00 135.40 2i0b s PRO 222 Ca 0.07 1.69 -0.29 0.00 0.02 0.00 0.00 61.00 62.50 2i0b s PRO 222 Cb 0.07 -1.85 -0.12 0.00 0.02 0.00 0.00 34.50 32.62 2i0b s PRO 222 CO -0.09 -1.73 1.48 -1.33 -0.33 0.00 0.00 177.00 175.00 2i0b n MET 223 N -2.67 2.53 -0.70 5.54 2.81 -1.26 -2.35 117.12 121.03 2i0b n MET 223 Ca 0.13 0.89 0.00 0.00 -1.81 0.00 0.00 57.70 56.91 2i0b n MET 223 Cb 0.51 -2.61 0.00 0.00 -0.71 0.00 0.00 33.22 30.41 2i0b n MET 223 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2i0b n GLY 224 N 1.17 0.79 3.75 3.03 0.00 -1.26 -4.98 105.19 107.68 2i0b n GLY 224 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 2i0b n GLY 224 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2i0b s SER 225 N -2.72 6.67 0.54 1.61 0.15 -0.99 -4.87 113.70 114.09 2i0b s SER 225 Ca 0.00 2.67 0.33 0.00 0.70 0.00 0.00 55.95 59.65 2i0b s SER 225 Cb 0.00 -2.63 1.37 0.00 -1.71 0.00 0.00 66.02 63.05 2i0b s SER 225 CO 0.00 -0.67 1.99 1.55 1.20 0.00 0.00 173.24 177.31 2i0b h PRO 226 N 4.74 0.00 0.00 5.44 0.13 -1.95 -2.88 132.00 137.48 2i0b h PRO 226 Ca -0.46 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.63 2i0b h PRO 226 Cb 1.22 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.34 2i0b h PRO 226 CO 0.75 0.04 -0.15 1.88 -0.23 0.00 0.00 178.00 180.29 2i0b h TYR 227 N 0.00 0.00 0.10 1.56 -1.99 -1.97 -3.31 116.97 111.36 2i0b h TYR 227 Ca -0.00 0.00 0.01 0.00 2.00 0.00 0.00 58.73 60.74 2i0b h TYR 227 Cb 0.51 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.22 2i0b h TYR 227 CO 0.00 0.15 -0.14 -0.09 -0.00 0.00 0.00 178.16 178.08 2i0b h ARG 228 N 0.00 -0.27 -0.17 4.88 1.12 -1.90 0.22 114.38 118.27 2i0b h ARG 228 Ca -0.00 0.02 -0.09 0.00 -1.11 0.00 0.00 59.98 58.80 2i0b h ARG 228 Cb 0.61 0.06 -0.01 0.00 -0.01 0.00 0.00 29.97 30.61 2i0b h ARG 228 CO 0.02 -0.18 -0.27 -0.44 -3.11 0.00 0.00 179.97 175.99 2i0b h ASP 229 N -0.28 0.31 0.10 -3.80 3.32 -1.79 -1.29 116.42 112.99 2i0b h ASP 229 Ca 0.02 -0.10 -0.15 0.00 0.02 0.00 0.00 57.03 56.81 2i0b h ASP 229 Cb 0.29 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.75 2i0b h ASP 229 CO -0.06 0.59 -0.54 0.11 -1.72 0.00 0.00 179.24 177.61 2i0b h LYS 230 N 0.28 0.47 -0.24 3.56 1.57 -1.59 -2.03 116.57 118.59 2i0b h LYS 230 Ca 0.04 -0.29 -0.20 0.00 -1.87 0.00 0.00 60.65 58.33 2i0b h LYS 230 Cb 0.63 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.98 2i0b h LYS 230 CO 0.05 0.89 -0.64 0.82 -0.57 0.00 0.00 179.45 180.00 2i0b h ILE 231 N 0.36 1.27 -0.57 1.86 2.04 -0.64 -1.65 117.51 120.19 2i0b h ILE 231 Ca 0.01 -1.83 0.07 0.00 1.00 0.00 0.00 64.86 64.11 2i0b h ILE 231 Cb 1.06 1.77 -0.06 0.00 -0.74 0.00 0.00 36.82 38.86 2i0b h ILE 231 CO 0.10 0.59 0.25 0.74 0.00 0.00 0.00 178.15 179.82 2i0b h THR 232 N 0.62 0.86 -0.59 -0.27 2.02 -1.15 0.02 112.91 114.41 2i0b h THR 232 Ca -0.01 -0.16 -0.04 0.00 0.77 0.00 0.00 66.41 66.97 2i0b h THR 232 Cb 1.26 0.36 -0.03 0.00 -1.74 0.00 0.00 68.15 68.00 2i0b h THR 232 CO 0.14 0.08 0.20 -0.07 0.37 0.00 0.00 175.52 176.24 2i0b h LEU 233 N 0.46 0.85 -0.47 2.58 3.38 -1.18 -0.40 115.31 120.54 2i0b h LEU 233 Ca 0.27 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 2i0b h LEU 233 Cb 0.27 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 2i0b h LEU 233 CO -0.24 0.82 0.25 0.00 0.09 0.00 0.00 178.44 179.36 2i0b h ALA 234 N 1.06 0.60 -0.67 1.53 0.00 -0.94 -1.87 119.26 118.97 2i0b h ALA 234 Ca 0.19 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 2i0b h ALA 234 Cb 0.26 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 2i0b h ALA 234 CO -0.01 0.12 0.41 0.82 0.00 0.00 0.00 179.25 180.60 2i0b h ILE 235 N 0.61 1.19 -0.53 0.00 2.04 -0.76 0.67 117.51 120.73 2i0b h ILE 235 Ca 0.16 -0.40 -0.06 0.00 1.00 0.00 0.00 64.86 65.56 2i0b h ILE 235 Cb 0.05 0.25 -0.02 0.00 -0.74 0.00 0.00 36.82 36.36 2i0b h ILE 235 CO -0.03 0.19 0.09 -0.07 0.00 0.00 0.00 178.15 178.34 2i0b h LEU 236 N 0.91 0.79 0.03 1.44 3.38 -0.89 0.11 115.31 121.07 2i0b h LEU 236 Ca 0.24 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 58.05 2i0b h LEU 236 Cb -0.05 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.50 2i0b h LEU 236 CO -0.05 0.80 -0.01 0.50 0.09 0.00 0.00 178.44 179.77 2i0b h LYS 237 N 0.80 -0.03 -0.73 1.13 3.64 -0.94 -0.64 116.57 119.79 2i0b h LYS 237 Ca 0.17 0.00 0.09 0.00 -1.27 0.00 0.00 60.65 59.64 2i0b h LYS 237 Cb 0.35 0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 32.11 2i0b h LYS 237 CO 0.01 0.26 0.38 -0.07 -2.27 0.00 0.00 179.45 177.75 2i0b h LEU 238 N -0.33 0.50 0.11 5.20 3.38 -0.68 -1.47 115.31 122.03 2i0b h LEU 238 Ca -0.00 0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 2i0b h LEU 238 Cb 0.31 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.03 2i0b h LEU 238 CO 0.01 0.29 -0.05 -0.61 0.09 0.00 0.00 178.44 178.16 2i0b h GLN 239 N 0.64 -0.14 0.00 1.13 4.15 -0.64 -1.22 115.11 119.02 2i0b h GLN 239 Ca 0.36 0.01 -0.05 0.00 0.77 0.00 0.00 58.65 59.74 2i0b h GLN 239 Cb 0.36 0.03 -0.01 0.00 0.21 0.00 0.00 27.48 28.08 2i0b h GLN 239 CO -0.26 -0.02 -0.23 1.49 -1.93 0.00 0.00 178.83 177.88 2i0b h GLU 240 N -0.23 0.00 -0.00 1.69 4.81 -0.91 -1.40 114.58 118.54 2i0b h GLU 240 Ca -0.01 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 2i0b h GLU 240 Cb 0.19 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.57 2i0b h GLU 240 CO 0.02 0.23 -0.02 1.04 -0.73 0.00 0.00 179.01 179.55 2i0b n GLN 241 N -3.84 0.97 -0.73 1.92 6.02 -0.57 -4.91 117.38 116.24 2i0b n GLN 241 Ca -0.02 -0.19 0.00 0.00 -0.01 0.00 0.00 57.00 56.79 2i0b n GLN 241 Cb 0.32 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.08 2i0b n GLN 241 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2i0b n GLY 242 N 1.11 1.15 0.23 1.08 0.00 -0.53 -4.92 105.19 103.31 2i0b n GLY 242 Ca 0.20 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.19 2i0b n GLY 242 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2i0b h LYS 243 N 3.17 0.43 -0.37 1.61 1.57 -1.44 -1.90 116.57 119.65 2i0b h LYS 243 Ca 0.00 -0.18 -0.15 0.00 -1.87 0.00 0.00 60.65 58.45 2i0b h LYS 243 Cb 0.00 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.28 2i0b h LYS 243 CO 0.00 0.70 -0.36 -0.07 -0.57 0.00 0.00 179.45 179.15 2i0b h LEU 244 N 0.38 0.92 -0.08 2.94 3.38 -1.84 -0.66 115.31 120.36 2i0b h LEU 244 Ca 0.05 -0.41 -0.00 0.00 0.09 0.00 0.00 57.88 57.61 2i0b h LEU 244 Cb 0.74 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 41.23 2i0b h LEU 244 CO 0.06 1.18 0.04 -0.74 0.09 0.00 0.00 178.44 179.07 2i0b h HIS 245 N 0.72 0.11 -0.85 1.13 2.76 -1.83 -1.52 115.15 115.66 2i0b h HIS 245 Ca 0.06 -0.00 0.04 0.00 -2.20 0.00 0.00 60.37 58.27 2i0b h HIS 245 Cb 0.94 -0.03 -0.05 0.00 1.55 0.00 0.00 27.41 29.81 2i0b h HIS 245 CO 0.06 0.16 0.54 0.52 -1.30 0.00 0.00 177.93 177.91 2i0b h MET 246 N 0.02 1.00 -0.74 5.26 2.86 -1.25 -1.55 114.93 120.53 2i0b h MET 246 Ca 0.03 -0.06 -0.00 0.00 -2.06 0.00 0.00 59.70 57.60 2i0b h MET 246 Cb 0.10 -0.23 -0.04 0.00 0.06 0.00 0.00 31.60 31.49 2i0b h MET 246 CO -0.00 0.66 0.45 0.52 1.06 0.00 0.00 176.91 179.60 2i0b h MET 247 N 1.03 1.01 -0.40 1.72 2.07 -0.92 0.11 114.93 119.56 2i0b h MET 247 Ca 0.35 -0.09 -0.04 0.00 -2.07 0.00 0.00 59.70 57.84 2i0b h MET 247 Cb 0.06 -0.21 -0.02 0.00 -1.87 0.00 0.00 31.60 29.56 2i0b h MET 247 CO -0.13 0.72 0.08 -0.22 1.07 0.00 0.00 176.91 178.42 2i0b h LYS 248 N 1.02 0.65 -0.25 1.72 3.64 -0.92 -2.68 116.57 119.74 2i0b h LYS 248 Ca 0.27 -0.17 -0.04 0.00 -1.27 0.00 0.00 60.65 59.43 2i0b h LYS 248 Cb -0.03 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.69 2i0b h LYS 248 CO -0.05 0.69 -0.04 0.93 -2.27 0.00 0.00 179.45 178.72 2i0b h GLU 249 N 0.51 0.38 -0.53 1.90 4.39 -0.86 -0.39 114.58 119.98 2i0b h GLU 249 Ca 0.12 -0.08 -0.08 0.00 0.34 0.00 0.00 59.36 59.66 2i0b h GLU 249 Cb 0.35 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 28.92 2i0b h GLU 249 CO 0.01 0.44 -0.00 -0.22 -1.16 0.00 0.00 179.01 178.08 2i0b h LYS 250 N 0.37 0.91 0.00 2.33 3.64 -0.49 -2.20 116.57 121.13 2i0b h LYS 250 Ca 0.08 -0.26 -0.02 0.00 -1.27 0.00 0.00 60.65 59.18 2i0b h LYS 250 Cb 0.31 -0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 32.03 2i0b h LYS 250 CO 0.01 0.90 -1.77 0.91 -2.27 0.00 0.00 179.45 177.24 2i0b n TRP 251 N -4.20 0.25 0.10 1.91 7.02 -1.02 -4.05 117.44 117.46 2i0b n TRP 251 Ca 0.03 0.08 0.11 0.00 -1.02 0.00 0.00 57.50 56.69 2i0b n TRP 251 Cb 0.32 -0.64 -0.01 0.00 -2.42 0.00 0.00 31.31 28.56 2i0b n TRP 251 CO 0.00 0.00 0.00 0.91 -2.02 0.00 0.00 177.69 176.58 2i0b n TRP 252 N -2.39 0.96 -3.42 -5.99 8.01 -0.19 -4.84 117.44 109.58 2i0b n TRP 252 Ca -0.04 0.28 -0.27 0.00 -1.31 0.00 0.00 57.50 56.16 2i0b n TRP 252 Cb 0.59 -0.96 0.02 0.00 -2.01 0.00 0.00 31.31 28.95 2i0b n TRP 252 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.69 177.22 2i0b n ARG 253 N -2.68 -1.48 -0.43 -0.99 5.12 -0.83 -4.50 116.66 110.88 2i0b n ARG 253 Ca -0.01 0.90 -0.06 0.00 -1.93 0.00 0.00 57.85 56.75 2i0b n ARG 253 Cb 0.57 -1.82 -0.06 0.00 -1.16 0.00 0.00 32.46 29.99 2i0b n ARG 253 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2i0b n GLY 254 N -0.89 1.92 0.03 -0.13 0.00 -1.26 -3.42 105.19 101.43 2i0b n GLY 254 Ca -0.19 -0.51 -0.04 0.00 0.00 0.00 0.00 46.02 45.28 2i0b n GLY 254 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2i0b n ASN 255 N 2.95 3.35 -4.37 1.61 5.15 -1.26 -5.04 115.26 117.65 2i0b n ASN 255 Ca 0.19 -0.01 -0.31 0.00 -0.60 0.00 0.00 54.58 53.85 2i0b n ASN 255 Cb 0.35 0.52 0.19 0.00 -0.53 0.00 0.00 39.78 40.31 2i0b n ASN 255 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2i0b n GLY 256 N 2.68 -2.20 2.62 8.20 0.00 -1.22 -5.15 105.19 110.12 2i0b n GLY 256 Ca -0.12 -0.89 0.00 0.00 0.00 0.00 0.00 46.02 45.01 2i0b n GLY 256 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32