#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i4c s ARG 2 N 0.00 3.78 -0.29 3.17 0.52 -1.26 -1.93 118.95 122.95 3i4c s ARG 2 Ca 0.00 0.55 -0.16 0.00 -0.52 0.00 0.00 55.73 55.60 3i4c s ARG 2 Cb 0.00 -2.33 0.13 0.00 0.52 0.00 0.00 34.95 33.27 3i4c s ARG 2 CO 0.00 -0.12 0.91 0.00 0.02 0.00 0.00 175.30 176.11 3i4c s ALA 3 N -2.49 -2.17 -0.22 2.13 0.00 -0.85 -2.57 121.76 115.59 3i4c s ALA 3 Ca 0.52 2.25 -0.17 0.00 0.00 0.00 0.00 51.96 54.56 3i4c s ALA 3 Cb -0.10 -1.63 -0.03 0.00 0.00 0.00 0.00 23.12 21.35 3i4c s ALA 3 CO 0.33 -0.35 0.47 0.08 0.00 0.00 0.00 175.76 176.29 3i4c s VAL 4 N 1.37 5.13 0.18 0.00 1.01 0.13 -0.55 120.40 127.67 3i4c s VAL 4 Ca -0.09 0.83 0.06 0.00 0.00 0.00 0.00 61.98 62.78 3i4c s VAL 4 Cb -0.04 -3.79 -0.05 0.00 0.00 0.00 0.00 36.38 32.50 3i4c s VAL 4 CO -0.16 0.17 -0.12 -0.13 0.00 0.00 0.00 175.10 174.87 3i4c s ARG 5 N 1.78 1.21 -0.43 2.72 0.52 -0.18 -3.65 118.95 120.92 3i4c s ARG 5 Ca 0.21 -1.53 -0.21 0.00 -0.52 0.00 0.00 55.73 53.68 3i4c s ARG 5 Cb -0.15 -0.87 0.02 0.00 0.52 0.00 0.00 34.95 34.47 3i4c s ARG 5 CO 0.09 0.12 0.68 -1.17 0.02 0.00 0.00 175.30 175.04 3i4c s LEU 6 N -3.25 4.40 -0.16 2.53 2.96 -0.04 -0.39 118.68 124.74 3i4c s LEU 6 Ca 0.20 -0.21 0.19 0.00 -0.22 0.00 0.00 54.13 54.09 3i4c s LEU 6 Cb 0.01 -2.80 -0.27 0.00 0.50 0.00 0.00 46.19 43.64 3i4c s LEU 6 CO 0.04 -0.79 0.15 1.33 -1.32 0.00 0.00 176.35 175.77 3i4c n VAL 7 N 5.89 1.09 0.19 1.68 0.24 -1.26 -2.08 118.33 124.07 3i4c n VAL 7 Ca -0.01 -0.78 0.00 0.00 -2.04 0.00 0.00 64.34 61.52 3i4c n VAL 7 Cb 0.48 -0.37 0.00 0.00 -1.47 0.00 0.00 33.84 32.48 3i4c n VAL 7 CO 0.00 0.00 0.00 1.21 -2.14 0.00 0.00 176.83 175.90 3i4c n GLU 8 N -2.64 0.00 -0.86 7.34 2.13 -1.26 -4.66 120.64 120.69 3i4c n GLU 8 Ca -0.27 0.00 -0.29 0.00 0.66 0.00 0.00 57.16 57.27 3i4c n GLU 8 Cb 1.03 0.00 0.02 0.00 0.27 0.00 0.00 31.44 32.76 3i4c n GLU 8 CO 0.00 0.00 0.00 -0.35 -0.41 0.00 0.00 177.13 176.37 3i4c n PRO 12 N -3.48 0.00 -2.22 5.31 -0.04 -1.26 -5.06 135.00 128.26 3i4c n PRO 12 Ca 0.00 0.00 -0.38 0.00 -0.04 0.00 0.00 63.50 63.08 3i4c n PRO 12 Cb 0.00 -0.76 -0.01 0.00 -0.04 0.00 0.00 33.50 32.69 3i4c n PRO 12 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3i4c s LEU 13 N 4.95 4.05 -0.09 1.53 1.43 -1.26 -4.93 118.68 124.35 3i4c s LEU 13 Ca 0.37 2.37 0.03 0.00 -1.03 0.00 0.00 54.13 55.87 3i4c s LEU 13 Cb -0.26 -4.18 -0.01 0.00 0.03 0.00 0.00 46.19 41.77 3i4c s LEU 13 CO 0.57 -0.92 -0.19 -0.55 0.23 0.00 0.00 176.35 175.49 3i4c s SER 14 N -1.25 3.53 -0.65 2.29 0.15 0.48 -4.85 113.70 113.41 3i4c s SER 14 Ca 0.62 -0.41 -0.28 0.00 0.70 0.00 0.00 55.95 56.58 3i4c s SER 14 Cb -0.30 -1.24 0.03 0.00 -1.71 0.00 0.00 66.02 62.79 3i4c s SER 14 CO 0.37 0.21 1.28 -0.22 1.20 0.00 0.00 173.24 176.09 3i4c s LEU 15 N 0.05 3.31 0.45 3.45 2.96 -1.26 -1.00 118.68 126.63 3i4c s LEU 15 Ca -0.08 -0.10 0.08 0.00 -0.22 0.00 0.00 54.13 53.82 3i4c s LEU 15 Cb -0.15 -2.87 0.02 0.00 0.50 0.00 0.00 46.19 43.69 3i4c s LEU 15 CO 0.05 -1.70 0.58 -1.10 -1.32 0.00 0.00 176.35 172.87 3i4c s GLN 16 N 5.44 2.70 -0.58 1.98 -0.21 0.29 -4.92 119.66 124.35 3i4c s GLN 16 Ca 0.42 -1.35 0.04 0.00 0.02 0.00 0.00 55.36 54.48 3i4c s GLN 16 Cb -0.08 -2.69 0.16 0.00 1.00 0.00 0.00 33.01 31.40 3i4c s GLN 16 CO 0.21 -0.36 0.38 -2.00 -2.12 0.00 0.00 175.29 171.40 3i4c s GLU 17 N -4.38 1.96 0.45 2.91 2.56 -1.26 -2.01 118.70 118.93 3i4c s GLU 17 Ca 0.55 -2.81 0.06 0.00 0.00 0.00 0.00 54.97 52.77 3i4c s GLU 17 Cb -0.08 -2.94 0.02 0.00 2.00 0.00 0.00 34.13 33.12 3i4c s GLU 17 CO 0.33 -1.24 0.62 0.96 -0.56 0.00 0.00 175.26 175.37 3i4c s ILE 18 N -0.71 2.91 0.66 -3.70 -4.36 -0.81 -4.78 121.20 110.40 3i4c s ILE 18 Ca 0.23 -0.91 -0.11 0.00 -0.26 0.00 0.00 60.65 59.60 3i4c s ILE 18 Cb -0.11 -3.00 -0.02 0.00 1.25 0.00 0.00 42.46 40.59 3i4c s ILE 18 CO -0.11 0.00 1.05 -0.83 0.24 0.00 0.00 174.94 175.29 3i4c s GLY 19 N -4.37 1.65 -0.39 6.27 0.00 -1.26 0.36 107.32 109.58 3i4c s GLY 19 Ca 0.56 -0.13 -0.22 0.00 0.00 0.00 0.00 44.72 44.93 3i4c s GLY 19 CO 0.34 0.17 0.70 0.14 0.00 0.00 0.00 173.10 174.46 3i4c s VAL 20 N -3.20 4.79 0.68 1.40 1.01 -1.26 -4.70 120.40 119.12 3i4c s VAL 20 Ca 0.56 0.53 -0.17 0.00 0.00 0.00 0.00 61.98 62.91 3i4c s VAL 20 Cb -0.12 -4.18 -0.03 0.00 0.00 0.00 0.00 36.38 32.06 3i4c s VAL 20 CO 0.54 -0.47 0.78 -2.65 0.00 0.00 0.00 175.10 173.29 3i4c n PRO 21 N 6.31 0.51 -3.84 2.72 -0.02 -1.26 -4.99 135.00 134.43 3i4c n PRO 21 Ca 0.00 0.22 -0.36 0.00 -2.02 0.00 0.00 63.50 61.34 3i4c n PRO 21 Cb 0.48 -2.03 -0.13 0.00 -0.02 0.00 0.00 33.50 31.80 3i4c n PRO 21 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 3i4c s LYS 22 N -2.91 3.44 0.15 -0.52 2.20 -1.26 -5.02 119.74 115.81 3i4c s LYS 22 Ca 0.71 -0.60 -0.31 0.00 -0.36 0.00 0.00 55.97 55.41 3i4c s LYS 22 Cb -0.37 -3.16 -0.10 0.00 -1.51 0.00 0.00 37.83 32.69 3i4c s LYS 22 CO 0.52 -0.22 1.58 -1.25 -0.36 0.00 0.00 175.35 175.62 3i4c s PRO 23 N 1.53 4.21 0.01 4.03 0.04 -1.26 -5.02 135.00 138.54 3i4c s PRO 23 Ca 0.06 2.35 0.04 0.00 0.04 0.00 0.00 61.00 63.48 3i4c s PRO 23 Cb -0.15 -3.24 -0.01 0.00 0.04 0.00 0.00 34.50 31.13 3i4c s PRO 23 CO -0.00 -0.63 -0.13 -1.59 0.04 0.00 0.00 177.00 174.69 3i4c s LYS 24 N 1.43 0.95 7.76 4.56 -2.85 -1.26 -4.47 119.74 125.86 3i4c s LYS 24 Ca 0.71 -0.58 0.00 0.00 -1.00 0.00 0.00 55.97 55.10 3i4c s LYS 24 Cb -0.43 -0.93 0.00 0.00 -2.06 0.00 0.00 37.83 34.41 3i4c s LYS 24 CO 0.31 0.24 0.00 0.41 0.10 0.00 0.00 175.35 176.42 3i4c n GLY 25 N 2.37 3.21 0.10 0.59 0.00 -1.26 -2.34 105.19 107.85 3i4c n GLY 25 Ca -0.16 -0.16 0.14 0.00 0.00 0.00 0.00 46.02 45.85 3i4c n GLY 25 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3i4c n PRO 26 N 13.25 0.65 -1.31 1.61 -0.04 -1.26 -1.42 135.00 146.48 3i4c n PRO 26 Ca 0.00 -0.20 -0.33 0.00 -0.04 0.00 0.00 63.50 62.93 3i4c n PRO 26 Cb 0.00 -1.50 0.10 0.00 -0.04 0.00 0.00 33.50 32.07 3i4c n PRO 26 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 3i4c s GLN 27 N -2.48 1.99 -0.02 0.54 -0.21 -0.99 -1.67 119.66 116.82 3i4c s GLN 27 Ca 0.29 1.67 0.01 0.00 0.02 0.00 0.00 55.36 57.35 3i4c s GLN 27 Cb 0.20 -1.82 0.01 0.00 1.00 0.00 0.00 33.01 32.40 3i4c s GLN 27 CO 0.47 -1.93 -0.04 0.08 -2.12 0.00 0.00 175.29 171.75 3i4c s VAL 28 N -2.17 0.40 -0.25 1.09 1.01 -0.48 -0.98 120.40 119.01 3i4c s VAL 28 Ca 0.72 -0.11 -0.11 0.00 0.00 0.00 0.00 61.98 62.47 3i4c s VAL 28 Cb -0.27 -0.40 -0.05 0.00 0.00 0.00 0.00 36.38 35.66 3i4c s VAL 28 CO 0.48 0.16 0.19 -0.22 0.00 0.00 0.00 175.10 175.71 3i4c s LEU 29 N 0.51 4.08 -0.08 3.92 2.96 0.14 -0.52 118.68 129.69 3i4c s LEU 29 Ca -0.06 0.09 0.03 0.00 -0.22 0.00 0.00 54.13 53.97 3i4c s LEU 29 Cb -0.09 -2.14 -0.02 0.00 0.50 0.00 0.00 46.19 44.43 3i4c s LEU 29 CO -0.00 0.01 -0.16 -0.63 -1.32 0.00 0.00 176.35 174.24 3i4c s ILE 30 N 1.37 2.84 -0.51 6.68 1.01 0.12 -0.04 121.20 132.67 3i4c s ILE 30 Ca 0.08 -0.78 -0.22 0.00 0.00 0.00 0.00 60.65 59.73 3i4c s ILE 30 Cb -0.15 -2.12 0.04 0.00 0.01 0.00 0.00 42.46 40.24 3i4c s ILE 30 CO 0.07 0.57 0.80 -0.75 0.00 0.00 0.00 174.94 175.63 3i4c s LYS 31 N -0.26 3.28 0.11 2.79 2.20 0.99 -1.10 119.74 127.75 3i4c s LYS 31 Ca 0.01 -0.41 -0.31 0.00 -0.36 0.00 0.00 55.97 54.89 3i4c s LYS 31 Cb -0.13 -4.04 -0.11 0.00 -1.51 0.00 0.00 37.83 32.05 3i4c s LYS 31 CO 0.03 -1.31 1.84 0.28 -0.36 0.00 0.00 175.35 175.83 3i4c n VAL 32 N 6.00 0.39 0.15 4.02 0.31 -0.64 -1.72 118.33 126.83 3i4c n VAL 32 Ca -0.01 -0.07 0.04 0.00 -0.01 0.00 0.00 64.34 64.30 3i4c n VAL 32 Cb 0.47 -2.11 -0.06 0.00 -0.91 0.00 0.00 33.84 31.23 3i4c n VAL 32 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3i4c n GLU 33 N 5.74 1.70 -3.66 5.55 1.02 -0.64 -4.45 120.64 125.91 3i4c n GLU 33 Ca 0.18 -0.05 -0.08 0.00 -0.02 0.00 0.00 57.16 57.19 3i4c n GLU 33 Cb 0.37 -1.10 -0.08 0.00 -0.02 0.00 0.00 31.44 30.61 3i4c n GLU 33 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3i4c s ALA 34 N -2.33 -1.65 -0.34 0.62 0.00 -0.75 -4.61 121.76 112.70 3i4c s ALA 34 Ca -0.01 2.17 0.00 0.00 0.00 0.00 0.00 51.96 54.12 3i4c s ALA 34 Cb 0.06 -1.31 0.11 0.00 0.00 0.00 0.00 23.12 21.98 3i4c s ALA 34 CO 0.37 -0.38 0.13 0.00 0.00 0.00 0.00 175.76 175.88 3i4c s ALA 35 N 1.65 1.79 0.63 0.00 0.00 0.21 -2.56 121.76 123.48 3i4c s ALA 35 Ca -0.10 -1.97 -0.18 0.00 0.00 0.00 0.00 51.96 49.72 3i4c s ALA 35 Cb -0.06 -1.72 -0.02 0.00 0.00 0.00 0.00 23.12 21.32 3i4c s ALA 35 CO -0.18 -1.77 1.19 0.20 0.00 0.00 0.00 175.76 175.20 3i4c s GLY 36 N 1.25 2.58 -0.06 0.00 0.00 -0.59 -0.63 107.32 109.86 3i4c s GLY 36 Ca 0.12 0.92 0.03 0.00 0.00 0.00 0.00 44.72 45.78 3i4c s GLY 36 CO -0.17 1.31 -0.13 0.14 0.00 0.00 0.00 173.10 174.24 3i4c s VAL 37 N -1.77 1.21 0.26 1.40 1.01 -0.14 -4.33 120.40 118.03 3i4c s VAL 37 Ca 0.75 -0.54 0.02 0.00 0.00 0.00 0.00 61.98 62.22 3i4c s VAL 37 Cb -0.29 -1.08 -0.04 0.00 0.00 0.00 0.00 36.38 34.97 3i4c s VAL 37 CO 0.36 0.37 0.18 0.00 0.00 0.00 0.00 175.10 176.01 3i4c h HIS 39 N 2.40 0.00 0.00 0.00 2.76 -1.98 0.15 115.15 118.48 3i4c h HIS 39 Ca -0.32 0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 57.84 3i4c h HIS 39 Cb 1.24 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 30.20 3i4c h HIS 39 CO 0.87 0.00 -0.05 0.77 -1.30 0.00 0.00 177.93 178.22 3i4c h SER 40 N 0.00 0.00 1.24 3.26 0.02 -2.00 -0.01 113.55 116.05 3i4c h SER 40 Ca 0.27 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.22 3i4c h SER 40 Cb 1.38 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.92 3i4c h SER 40 CO -0.00 0.05 0.00 0.44 -1.14 0.00 0.00 176.83 176.17 3i4c h ASP 41 N 0.00 0.00 -0.08 3.07 3.32 -1.10 -1.13 116.42 120.49 3i4c h ASP 41 Ca -0.00 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.92 3i4c h ASP 41 Cb 0.09 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.65 3i4c h ASP 41 CO 0.01 0.00 -0.46 0.58 -1.72 0.00 0.00 179.24 177.65 3i4c h VAL 42 N 0.00 1.39 -0.82 -1.35 2.07 -1.11 -1.48 116.25 114.95 3i4c h VAL 42 Ca 0.00 -1.83 -0.02 0.00 0.82 0.00 0.00 66.70 65.67 3i4c h VAL 42 Cb 0.62 2.29 -0.04 0.00 -1.52 0.00 0.00 31.29 32.64 3i4c h VAL 42 CO 0.00 0.54 0.42 0.45 0.02 0.00 0.00 177.57 179.00 3i4c h HIS 43 N 0.01 1.16 0.16 1.57 3.86 -1.30 -1.65 115.15 118.94 3i4c h HIS 43 Ca -0.03 -0.04 0.00 0.00 -1.16 0.00 0.00 60.37 59.13 3i4c h HIS 43 Cb 1.11 -0.36 -0.01 0.00 1.06 0.00 0.00 27.41 29.21 3i4c h HIS 43 CO 0.12 0.82 -0.15 0.52 0.86 0.00 0.00 177.93 180.11 3i4c h MET 44 N 1.15 -0.32 0.00 2.45 2.07 -1.13 -1.40 114.93 117.76 3i4c h MET 44 Ca 0.29 0.02 -0.00 0.00 -2.07 0.00 0.00 59.70 57.93 3i4c h MET 44 Cb 0.08 0.07 -0.00 0.00 -1.87 0.00 0.00 31.60 29.88 3i4c h MET 44 CO -0.04 -0.21 -0.02 -0.09 1.07 0.00 0.00 176.91 177.62 3i4c h ARG 45 N -0.33 0.00 0.00 1.72 2.43 -0.96 -0.09 114.38 117.16 3i4c h ARG 45 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3i4c h ARG 45 Cb 0.31 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.86 3i4c h ARG 45 CO -0.03 0.02 -0.31 1.04 -1.51 0.00 0.00 179.97 179.17 3i4c n GLN 46 N -3.84 0.12 0.00 0.20 6.02 -0.65 -4.93 117.38 114.30 3i4c n GLN 46 Ca -0.03 0.06 0.00 0.00 -0.01 0.00 0.00 57.00 57.02 3i4c n GLN 46 Cb 0.11 -1.60 0.00 0.00 1.02 0.00 0.00 30.24 29.77 3i4c n GLN 46 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3i4c n GLY 47 N 1.43 2.59 1.28 1.08 0.00 -0.05 -5.01 105.19 106.51 3i4c n GLY 47 Ca 0.05 -0.32 -0.10 0.00 0.00 0.00 0.00 46.02 45.65 3i4c n GLY 47 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 3i4c n ARG 48 N 0.00 -0.73 0.03 1.61 -4.01 -1.18 -1.58 116.66 110.79 3i4c n ARG 48 Ca 0.00 -0.67 0.00 0.00 -1.04 0.00 0.00 57.85 56.14 3i4c n ARG 48 Cb 0.00 -0.49 0.00 0.00 -3.04 0.00 0.00 32.46 28.93 3i4c n ARG 48 CO 0.00 0.00 0.00 0.34 -3.04 0.00 0.00 177.63 174.93 3i4c n PHE 49 N -2.78 -2.08 0.00 2.89 7.35 -1.26 -4.12 117.46 117.46 3i4c n PHE 49 Ca 0.06 0.18 0.00 0.00 -0.76 0.00 0.00 57.45 56.93 3i4c n PHE 49 Cb 0.20 0.76 0.00 0.00 0.35 0.00 0.00 39.48 40.79 3i4c n PHE 49 CO 0.00 0.00 0.00 0.44 -0.76 0.00 0.00 176.76 176.44 3i4c n ILE 54 N -2.63 0.00 -0.01 -2.13 -5.35 -0.62 -5.16 119.36 103.46 3i4c n ILE 54 Ca 0.00 0.00 -0.14 0.00 -0.27 0.00 0.00 62.75 62.34 3i4c n ILE 54 Cb 0.00 0.00 -0.03 0.00 -1.74 0.00 0.00 39.64 37.87 3i4c n ILE 54 CO 0.00 0.00 0.00 0.58 -1.76 0.00 0.00 176.55 175.37 3i4c h VAL 55 N 0.00 1.30 -0.29 7.28 2.07 -1.83 0.74 116.25 125.52 3i4c h VAL 55 Ca 0.00 -1.95 -0.19 0.00 0.82 0.00 0.00 66.70 65.38 3i4c h VAL 55 Cb 0.00 1.93 0.00 0.00 -1.52 0.00 0.00 31.29 31.70 3i4c h VAL 55 CO 0.00 0.61 -0.55 -0.33 0.02 0.00 0.00 177.57 177.32 3i4c h GLU 56 N 0.49 0.87 0.00 1.57 4.39 -1.96 -3.31 114.58 116.63 3i4c h GLU 56 Ca -0.03 -0.55 -0.24 0.00 0.34 0.00 0.00 59.36 58.88 3i4c h GLU 56 Cb 1.31 0.07 -0.04 0.00 -0.10 0.00 0.00 28.75 29.99 3i4c h GLU 56 CO 0.14 1.18 -1.81 -0.25 -1.16 0.00 0.00 179.01 177.11 3i4c n ASP 57 N -4.00 1.17 0.00 1.42 8.00 -1.24 -4.65 116.55 117.25 3i4c n ASP 57 Ca -0.04 0.16 0.07 0.00 0.71 0.00 0.00 54.79 55.68 3i4c n ASP 57 Cb 0.63 -0.41 0.40 0.00 -0.02 0.00 0.00 41.12 41.72 3i4c n ASP 57 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3i4c n LEU 58 N -3.59 0.00 -1.98 0.64 4.77 0.18 -4.87 117.00 112.14 3i4c n LEU 58 Ca -0.28 0.00 -0.19 0.00 -0.03 0.00 0.00 56.01 55.51 3i4c n LEU 58 Cb 0.71 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.77 3i4c n LEU 58 CO 0.03 0.00 -0.23 0.61 -1.33 0.00 0.00 177.39 176.47 3i4c n GLY 59 N 0.62 0.15 3.73 -0.72 0.00 -0.79 -4.76 105.19 103.42 3i4c n GLY 59 Ca 0.10 -0.09 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 3i4c n GLY 59 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3i4c s VAL 60 N -2.89 3.61 -0.33 1.61 1.01 -0.75 -4.96 120.40 117.70 3i4c s VAL 60 Ca 0.00 1.27 0.01 0.00 0.00 0.00 0.00 61.98 63.27 3i4c s VAL 60 Cb 0.00 -3.81 0.10 0.00 0.00 0.00 0.00 36.38 32.67 3i4c s VAL 60 CO 0.00 0.17 0.08 -0.54 0.00 0.00 0.00 175.10 174.81 3i4c s LYS 61 N 0.22 1.05 0.47 2.72 1.02 -1.26 -4.24 119.74 119.72 3i4c s LYS 61 Ca 0.56 -1.45 -0.24 0.00 0.02 0.00 0.00 55.97 54.86 3i4c s LYS 61 Cb -0.33 -2.51 -0.07 0.00 -0.52 0.00 0.00 37.83 34.40 3i4c s LYS 61 CO 0.34 -0.98 1.42 -0.51 -0.92 0.00 0.00 175.35 174.70 3i4c s LEU 62 N 1.27 4.06 0.52 3.17 1.02 -1.26 -4.37 118.68 123.08 3i4c s LEU 62 Ca 0.11 2.90 -0.08 0.00 0.02 0.00 0.00 54.13 57.07 3i4c s LEU 62 Cb -0.18 -4.01 -0.04 0.00 0.02 0.00 0.00 46.19 41.98 3i4c s LEU 62 CO -0.17 -1.27 0.87 -2.16 0.02 0.00 0.00 176.35 173.64 3i4c s PRO 63 N -2.55 3.60 -0.10 1.29 0.04 -1.26 -5.09 135.00 130.93 3i4c s PRO 63 Ca 0.63 0.43 -0.09 0.00 0.04 0.00 0.00 61.00 62.02 3i4c s PRO 63 Cb -0.43 -2.27 0.03 0.00 0.04 0.00 0.00 34.50 31.86 3i4c s PRO 63 CO 0.55 -0.31 0.26 0.54 0.04 0.00 0.00 177.00 178.07 3i4c s VAL 64 N -2.85 -0.00 -0.13 -0.36 0.11 -0.88 -4.97 120.40 111.32 3i4c s VAL 64 Ca 0.51 0.00 -0.29 0.00 -2.93 0.00 0.00 61.98 59.27 3i4c s VAL 64 Cb -0.11 -0.37 -0.01 0.00 -1.53 0.00 0.00 36.38 34.37 3i4c s VAL 64 CO 0.46 0.00 1.07 -0.89 -3.33 0.00 0.00 175.10 172.42 3i4c s THR 65 N 0.17 4.62 1.01 5.04 2.01 -1.26 -0.86 115.64 126.37 3i4c s THR 65 Ca -0.00 1.91 -0.17 0.00 0.31 0.00 0.00 61.69 63.74 3i4c s THR 65 Cb -0.02 -4.23 0.24 0.00 0.01 0.00 0.00 72.50 68.50 3i4c s THR 65 CO 0.00 -0.05 1.27 0.18 -0.69 0.00 0.00 174.62 175.33 3i4c n LEU 66 N 5.49 0.00 0.00 4.42 4.32 -1.24 0.13 117.00 130.12 3i4c n LEU 66 Ca 0.10 -1.38 0.00 0.00 -0.02 0.00 0.00 56.01 54.71 3i4c n LEU 66 Cb 0.47 -1.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.27 3i4c n LEU 66 CO 0.53 -1.57 0.00 0.61 -1.22 0.00 0.00 177.39 175.74 3i4c n GLY 67 N -3.79 0.66 1.05 -0.72 0.00 -1.25 -0.69 105.19 100.46 3i4c n GLY 67 Ca 0.16 -0.68 0.10 0.00 0.00 0.00 0.00 46.02 45.61 3i4c n GLY 67 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 3i4c n HIS 68 N 0.00 0.50 -3.81 1.61 1.44 -1.25 -0.39 115.22 113.32 3i4c n HIS 68 Ca 0.00 -0.29 -0.34 0.00 -2.01 0.00 0.00 57.72 55.08 3i4c n HIS 68 Cb 0.00 -0.00 -0.11 0.00 0.12 0.00 0.00 29.99 29.99 3i4c n HIS 68 CO 0.00 0.00 0.00 -1.21 -2.81 0.00 0.00 176.34 172.32 3i4c s GLU 69 N -1.32 2.29 -0.13 -1.40 2.02 -1.26 -4.58 118.70 114.32 3i4c s GLU 69 Ca 0.36 -2.49 -0.03 0.00 0.02 0.00 0.00 54.97 52.83 3i4c s GLU 69 Cb 0.20 -3.57 -0.03 0.00 0.10 0.00 0.00 34.13 30.84 3i4c s GLU 69 CO 0.28 -1.14 -0.02 0.42 0.02 0.00 0.00 175.26 174.83 3i4c s ILE 70 N -0.01 4.11 -0.20 -1.63 1.01 -1.26 -1.55 121.20 121.67 3i4c s ILE 70 Ca 0.16 -0.30 -0.17 0.00 0.00 0.00 0.00 60.65 60.34 3i4c s ILE 70 Cb -0.22 -2.78 0.05 0.00 0.01 0.00 0.00 42.46 39.53 3i4c s ILE 70 CO -0.03 0.53 0.52 0.00 0.00 0.00 0.00 174.94 175.96 3i4c s ALA 71 N -0.10 -1.29 0.00 9.38 0.00 -1.06 -1.58 121.76 127.11 3i4c s ALA 71 Ca 0.03 1.52 0.00 0.00 0.00 0.00 0.00 51.96 53.51 3i4c s ALA 71 Cb -0.13 -0.89 0.00 0.00 0.00 0.00 0.00 23.12 22.11 3i4c s ALA 71 CO 0.02 -0.25 0.00 0.41 0.00 0.00 0.00 175.76 175.94 3i4c n GLY 72 N 3.01 -1.11 3.82 0.00 0.00 -0.44 -1.61 105.19 108.85 3i4c n GLY 72 Ca -0.15 -0.79 -0.36 0.00 0.00 0.00 0.00 46.02 44.72 3i4c n GLY 72 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3i4c s LYS 73 N -0.14 3.60 -0.08 1.61 2.20 -0.70 -0.62 119.74 125.61 3i4c s LYS 73 Ca 0.00 -0.18 -0.30 0.00 -0.36 0.00 0.00 55.97 55.13 3i4c s LYS 73 Cb 0.00 -3.21 -0.05 0.00 -1.51 0.00 0.00 37.83 33.06 3i4c s LYS 73 CO 0.00 0.64 1.62 0.42 -0.36 0.00 0.00 175.35 177.67 3i4c s ILE 74 N -0.63 3.65 -0.17 5.43 1.01 0.56 -0.01 121.20 131.04 3i4c s ILE 74 Ca 0.13 0.78 -0.19 0.00 0.00 0.00 0.00 60.65 61.37 3i4c s ILE 74 Cb -0.12 -3.52 -0.22 0.00 0.01 0.00 0.00 42.46 38.61 3i4c s ILE 74 CO 0.02 -0.09 0.36 -0.08 0.00 0.00 0.00 174.94 175.15 3i4c h GLU 75 N 9.59 0.09 -2.43 2.79 4.57 -0.78 0.19 114.58 128.60 3i4c h GLU 75 Ca -0.38 -0.16 -0.08 0.00 -1.18 0.00 0.00 59.36 57.56 3i4c h GLU 75 Cb 1.17 0.06 -0.21 0.00 -0.16 0.00 0.00 28.75 29.61 3i4c h GLU 75 CO 0.96 1.07 -0.03 -2.00 -1.18 0.00 0.00 179.01 177.83 3i4c s GLU 76 N -2.40 0.79 0.23 1.92 2.12 -1.02 -4.82 118.70 115.51 3i4c s GLU 76 Ca -0.25 0.35 0.11 0.00 0.36 0.00 0.00 54.97 55.53 3i4c s GLU 76 Cb 0.05 0.37 -0.05 0.00 0.26 0.00 0.00 34.13 34.77 3i4c s GLU 76 CO 0.66 -0.19 -0.17 0.14 -0.54 0.00 0.00 175.26 175.16 3i4c s VAL 77 N -0.63 2.68 0.77 3.70 -7.23 -1.26 0.28 120.40 118.70 3i4c s VAL 77 Ca -0.07 -2.07 -0.11 0.00 -1.81 0.00 0.00 61.98 57.92 3i4c s VAL 77 Cb -0.03 -2.35 0.05 0.00 0.56 0.00 0.00 36.38 34.62 3i4c s VAL 77 CO 0.05 -0.23 1.09 -0.83 -0.31 0.00 0.00 175.10 174.86 3i4c s GLY 78 N -3.08 1.64 0.32 2.32 0.00 -0.15 -4.89 107.32 103.48 3i4c s GLY 78 Ca 0.26 -0.09 0.26 0.00 0.00 0.00 0.00 44.72 45.14 3i4c s GLY 78 CO 0.14 0.30 1.77 1.29 0.00 0.00 0.00 173.10 176.60 3i4c h ASP 79 N -1.01 0.00 0.28 1.64 2.03 -1.82 -2.20 116.42 115.34 3i4c h ASP 79 Ca -0.46 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.84 3i4c h ASP 79 Cb 1.25 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.75 3i4c h ASP 79 CO 0.58 0.00 -0.93 -0.62 -1.03 0.00 0.00 179.24 177.23 3i4c n GLU 80 N -2.40 0.14 -1.82 4.15 1.02 -0.51 -4.93 120.64 116.29 3i4c n GLU 80 Ca 0.01 -0.01 -0.41 0.00 -0.02 0.00 0.00 57.16 56.73 3i4c n GLU 80 Cb 0.22 -1.54 -0.01 0.00 -0.02 0.00 0.00 31.44 30.09 3i4c n GLU 80 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3i4c s VAL 81 N -3.10 2.14 -0.01 2.62 1.01 -0.83 -4.78 120.40 117.45 3i4c s VAL 81 Ca 0.06 0.13 0.02 0.00 0.00 0.00 0.00 61.98 62.19 3i4c s VAL 81 Cb 0.16 -3.08 0.00 0.00 0.00 0.00 0.00 36.38 33.46 3i4c s VAL 81 CO 0.80 0.02 -0.06 -0.69 0.00 0.00 0.00 175.10 175.17 3i4c s VAL 82 N -0.30 0.54 0.00 2.92 1.01 -1.26 -4.82 120.40 118.49 3i4c s VAL 82 Ca 0.60 -0.26 0.00 0.00 0.00 0.00 0.00 61.98 62.32 3i4c s VAL 82 Cb -0.47 -0.48 0.00 0.00 0.00 0.00 0.00 36.38 35.44 3i4c s VAL 82 CO 0.51 0.17 0.00 0.61 0.00 0.00 0.00 175.10 176.39 3i4c n GLY 83 N 3.14 0.78 3.00 4.51 0.00 -1.26 -5.02 105.19 110.33 3i4c n GLY 83 Ca -0.16 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.74 3i4c n GLY 83 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3i4c s TYR 84 N -3.04 0.43 0.14 1.61 1.51 -1.26 -5.11 117.35 111.64 3i4c s TYR 84 Ca 0.00 -0.37 0.05 0.00 -1.01 0.00 0.00 57.07 55.74 3i4c s TYR 84 Cb 0.00 -0.27 -0.04 0.00 -0.11 0.00 0.00 41.96 41.53 3i4c s TYR 84 CO 0.00 -0.09 -0.11 -1.12 -1.11 0.00 0.00 175.55 173.12 3i4c s SER 85 N -1.08 1.85 0.36 2.29 0.01 -1.26 -5.01 113.70 110.86 3i4c s SER 85 Ca -0.08 -0.96 -0.27 0.00 1.31 0.00 0.00 55.95 55.94 3i4c s SER 85 Cb -0.07 -0.03 -0.12 0.00 0.21 0.00 0.00 66.02 66.01 3i4c s SER 85 CO -0.00 -0.28 1.25 1.17 0.41 0.00 0.00 173.24 175.79 3i4c n LYS 86 N -0.03 2.00 0.00 12.44 4.81 -1.26 -1.65 118.16 134.46 3i4c n LYS 86 Ca -0.11 0.70 0.00 0.00 -0.87 0.00 0.00 58.31 58.03 3i4c n LYS 86 Cb 0.60 -2.29 0.00 0.00 0.02 0.00 0.00 35.03 33.36 3i4c n LYS 86 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3i4c n GLY 87 N 0.83 3.38 3.77 3.14 0.00 0.66 -4.94 105.19 112.04 3i4c n GLY 87 Ca 0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 3i4c n GLY 87 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3i4c s ASP 88 N -0.68 6.41 -0.18 1.61 1.01 -0.66 -4.58 116.67 119.60 3i4c s ASP 88 Ca 0.00 2.79 -0.15 0.00 0.71 0.00 0.00 52.55 55.91 3i4c s ASP 88 Cb 0.00 -2.65 -0.04 0.00 1.01 0.00 0.00 42.92 41.24 3i4c s ASP 88 CO 0.00 -0.80 0.33 -0.22 0.21 0.00 0.00 175.17 174.69 3i4c s LEU 89 N -2.19 4.20 0.10 1.23 2.96 -1.26 -0.33 118.68 123.39 3i4c s LEU 89 Ca 0.54 0.49 -0.01 0.00 -0.22 0.00 0.00 54.13 54.93 3i4c s LEU 89 Cb -0.41 -2.42 -0.04 0.00 0.50 0.00 0.00 46.19 43.81 3i4c s LEU 89 CO 0.55 0.02 0.01 0.68 -1.32 0.00 0.00 176.35 176.28 3i4c s VAL 90 N 0.87 0.22 0.26 1.68 -7.23 0.21 -0.32 120.40 116.09 3i4c s VAL 90 Ca 0.17 -1.87 0.11 0.00 -1.81 0.00 0.00 61.98 58.58 3i4c s VAL 90 Cb -0.14 -1.80 -0.05 0.00 0.56 0.00 0.00 36.38 34.95 3i4c s VAL 90 CO 0.06 -0.72 -0.13 0.00 -0.31 0.00 0.00 175.10 174.00 3i4c s ALA 91 N -3.95 2.90 -0.01 1.32 0.00 -0.52 -1.33 121.76 120.17 3i4c s ALA 91 Ca 0.16 -1.76 0.03 0.00 0.00 0.00 0.00 51.96 50.39 3i4c s ALA 91 Cb 0.07 -0.47 -0.01 0.00 0.00 0.00 0.00 23.12 22.71 3i4c s ALA 91 CO -0.04 0.29 -0.11 0.08 0.00 0.00 0.00 175.76 175.99 3i4c s VAL 92 N -2.35 0.89 -0.44 0.00 1.01 -0.61 -1.52 120.40 117.37 3i4c s VAL 92 Ca 0.30 -0.47 -0.23 0.00 0.00 0.00 0.00 61.98 61.57 3i4c s VAL 92 Cb -0.06 -0.75 0.02 0.00 0.00 0.00 0.00 36.38 35.59 3i4c s VAL 92 CO 0.16 0.26 0.78 0.21 0.00 0.00 0.00 175.10 176.51 3i4c s ASN 93 N -0.19 6.42 0.45 3.32 2.47 0.06 -4.55 114.94 122.92 3i4c s ASN 93 Ca 0.03 -0.08 0.29 0.00 0.42 0.00 0.00 52.86 53.51 3i4c s ASN 93 Cb -0.05 -2.38 0.96 0.00 -1.45 0.00 0.00 41.25 38.32 3i4c s ASN 93 CO -0.00 -0.90 1.82 1.55 -3.72 0.00 0.00 177.10 175.85 3i4c h PRO 94 N 8.94 0.00 -4.90 0.43 0.13 -1.84 -3.43 132.00 131.32 3i4c h PRO 94 Ca -0.25 0.00 -0.69 0.00 -0.87 0.00 0.00 66.00 64.19 3i4c h PRO 94 Cb 1.09 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 32.03 3i4c h PRO 94 CO 0.96 0.00 -0.09 -1.17 -0.23 0.00 0.00 178.00 177.47 3i4c s LEU 95 N -5.85 4.94 -0.18 1.56 2.96 -1.26 -1.34 118.68 119.51 3i4c s LEU 95 Ca 0.04 -0.80 0.01 0.00 -0.22 0.00 0.00 54.13 53.16 3i4c s LEU 95 Cb 0.08 -2.43 0.04 0.00 0.50 0.00 0.00 46.19 44.38 3i4c s LEU 95 CO 0.57 -0.73 -0.11 -1.10 -1.32 0.00 0.00 176.35 173.66 3i4c s GLN 96 N 2.34 2.09 0.60 1.98 -0.21 0.37 -4.76 119.66 122.08 3i4c s GLN 96 Ca 0.14 -0.75 -0.17 0.00 0.02 0.00 0.00 55.36 54.60 3i4c s GLN 96 Cb -0.18 -2.31 -0.03 0.00 1.00 0.00 0.00 33.01 31.49 3i4c s GLN 96 CO 0.13 -0.37 1.11 0.20 -2.12 0.00 0.00 175.29 174.24 3i4c s GLY 97 N 1.43 2.35 0.45 3.09 0.00 -1.26 -0.19 107.32 113.19 3i4c s GLY 97 Ca 0.01 0.64 0.25 0.00 0.00 0.00 0.00 44.72 45.62 3i4c s GLY 97 CO -0.09 0.99 1.77 1.05 0.00 0.00 0.00 173.10 176.82 3i4c h GLU 98 N 0.57 0.00 0.00 2.90 -0.00 -1.91 -3.46 114.58 112.67 3i4c h GLU 98 Ca -0.48 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 58.88 3i4c h GLU 98 Cb 1.25 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 30.00 3i4c h GLU 98 CO 0.56 0.14 0.00 0.41 -0.00 0.00 0.00 179.01 180.12 3i4c n GLY 99 N 0.48 2.85 0.08 1.06 0.00 -1.26 -4.92 105.19 103.48 3i4c n GLY 99 Ca 0.01 -0.13 -0.11 0.00 0.00 0.00 0.00 46.02 45.79 3i4c n GLY 99 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 3i4c h ASN 100 N 0.15 0.16 -3.89 1.61 -1.24 -1.94 -3.37 115.58 107.06 3i4c h ASN 100 Ca 0.00 -0.20 -0.47 0.00 0.71 0.00 0.00 56.30 56.34 3i4c h ASN 100 Cb 0.00 -0.05 0.17 0.00 0.73 0.00 0.00 38.32 39.17 3i4c h ASN 100 CO 0.00 1.16 0.19 0.00 -1.29 0.00 0.00 177.43 177.49 3i4c h TYR 102 N -1.88 -0.01 -0.37 0.00 3.20 -1.98 -1.10 116.97 114.84 3i4c h TYR 102 Ca -0.52 0.03 -0.06 0.00 3.14 0.00 0.00 58.73 61.32 3i4c h TYR 102 Cb 1.30 0.07 -0.02 0.00 1.54 0.00 0.00 36.73 39.62 3i4c h TYR 102 CO 0.38 -0.08 -0.01 1.88 -1.64 0.00 0.00 178.16 178.68 3i4c h TYR 103 N 0.12 0.61 -0.38 -3.82 0.05 -1.87 -1.31 116.97 110.37 3i4c h TYR 103 Ca 0.21 -0.07 -0.14 0.00 0.05 0.00 0.00 58.73 58.78 3i4c h TYR 103 Cb 0.30 -0.17 -0.01 0.00 1.01 0.00 0.00 36.73 37.87 3i4c h TYR 103 CO -0.28 0.59 -0.33 0.00 -1.05 0.00 0.00 178.16 177.10 3i4c h ARG 105 N 0.69 0.66 -0.25 0.00 3.08 -0.60 -2.55 114.38 115.41 3i4c h ARG 105 Ca 0.07 -0.18 0.00 0.00 0.07 0.00 0.00 59.98 59.94 3i4c h ARG 105 Cb 0.91 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.89 3i4c h ARG 105 CO 0.08 0.71 0.00 0.44 -1.07 0.00 0.00 179.97 180.13 3i4c n ILE 106 N -4.21 0.33 -0.82 2.04 -5.35 -0.55 -4.91 119.36 105.89 3i4c n ILE 106 Ca 0.02 -0.38 0.00 0.00 -0.27 0.00 0.00 62.75 62.11 3i4c n ILE 106 Cb 0.31 0.25 0.00 0.00 -1.74 0.00 0.00 39.64 38.46 3i4c n ILE 106 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3i4c n GLY 107 N 1.05 0.50 2.71 3.28 0.00 -0.96 -4.97 105.19 106.80 3i4c n GLY 107 Ca 0.13 -0.81 -0.29 0.00 0.00 0.00 0.00 46.02 45.04 3i4c n GLY 107 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3i4c n GLU 108 N -2.82 3.45 0.33 1.61 -0.58 0.14 -4.87 120.64 117.90 3i4c n GLU 108 Ca 0.00 -4.58 0.21 0.00 -0.42 0.00 0.00 57.16 52.36 3i4c n GLU 108 Cb 0.00 -2.26 1.11 0.00 -0.57 0.00 0.00 31.44 29.72 3i4c n GLU 108 CO 0.00 0.00 0.00 1.05 -0.48 0.00 0.00 177.13 177.70 3i4c h GLU 109 N 2.89 0.00 0.00 3.49 4.11 -1.83 -0.17 114.58 123.07 3i4c h GLU 109 Ca 0.27 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.70 3i4c h GLU 109 Cb 0.64 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.89 3i4c h GLU 109 CO 0.91 0.00 0.00 1.12 0.07 0.00 0.00 179.01 181.11 3i4c h HIS 110 N 0.00 0.00 -0.52 2.06 2.07 -1.86 -0.58 115.15 116.32 3i4c h HIS 110 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 3i4c h HIS 110 Cb 0.16 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.14 3i4c h HIS 110 CO 0.00 0.00 0.00 1.28 -3.07 0.00 0.00 177.93 176.14 3i4c n LEU 111 N -2.63 5.24 -4.61 6.12 4.77 -0.08 -4.97 117.00 120.84 3i4c n LEU 111 Ca 0.00 -2.89 -0.42 0.00 -0.03 0.00 0.00 56.01 52.68 3i4c n LEU 111 Cb 0.19 -0.64 0.01 0.00 -2.33 0.00 0.00 43.42 40.65 3i4c n LEU 111 CO 0.20 0.66 0.59 0.00 -1.33 0.00 0.00 177.39 177.51 3i4c h ASP 113 N 1.60 0.00 -1.60 0.00 3.32 -1.95 -3.35 116.42 114.44 3i4c h ASP 113 Ca -0.44 0.00 -0.48 0.00 0.02 0.00 0.00 57.03 56.13 3i4c h ASP 113 Cb 1.34 0.00 -0.33 0.00 0.22 0.00 0.00 39.33 40.56 3i4c h ASP 113 CO 0.57 0.32 -0.94 -1.20 -1.72 0.00 0.00 179.24 176.27 3i4c n SER 114 N -4.09 -0.71 -4.82 6.45 7.64 -1.26 -5.07 113.62 111.76 3i4c n SER 114 Ca -0.02 -2.78 -0.31 0.00 1.01 0.00 0.00 58.87 56.77 3i4c n SER 114 Cb 0.37 -0.02 0.04 0.00 -1.01 0.00 0.00 64.21 63.59 3i4c n SER 114 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 3i4c s PRO 115 N -0.53 2.99 -0.36 1.43 0.04 -1.26 -4.17 135.00 133.13 3i4c s PRO 115 Ca 0.34 0.99 -0.12 0.00 0.04 0.00 0.00 61.00 62.25 3i4c s PRO 115 Cb 0.16 -2.00 0.01 0.00 0.04 0.00 0.00 34.50 32.71 3i4c s PRO 115 CO -0.15 -1.06 0.21 0.50 0.04 0.00 0.00 177.00 176.54 3i4c s ARG 116 N -4.90 3.09 -0.32 4.56 6.06 0.73 -4.97 118.95 123.20 3i4c s ARG 116 Ca 0.59 -0.91 0.03 0.00 -2.50 0.00 0.00 55.73 52.94 3i4c s ARG 116 Cb -0.14 -3.74 0.09 0.00 0.06 0.00 0.00 34.95 31.21 3i4c s ARG 116 CO 0.52 -0.59 0.01 -0.46 -2.50 0.00 0.00 175.30 172.28 3i4c s TRP 117 N 1.62 3.62 0.11 5.12 -0.11 -1.26 -0.47 118.94 127.57 3i4c s TRP 117 Ca 0.04 -2.78 -0.33 0.00 1.22 0.00 0.00 56.10 54.24 3i4c s TRP 117 Cb -0.18 -2.65 -0.13 0.00 -1.50 0.00 0.00 33.47 29.01 3i4c s TRP 117 CO 0.08 -0.93 1.71 1.28 -4.62 0.00 0.00 176.95 174.47 3i4c n LEU 118 N 4.32 3.50 0.00 5.86 4.77 -0.45 -0.85 117.00 134.15 3i4c n LEU 118 Ca -0.01 1.04 0.00 0.00 -0.03 0.00 0.00 56.01 57.00 3i4c n LEU 118 Cb 0.42 -1.46 0.00 0.00 -2.33 0.00 0.00 43.42 40.05 3i4c n LEU 118 CO 0.22 -0.08 0.00 0.61 -1.33 0.00 0.00 177.39 176.82 3i4c n GLY 119 N 3.85 1.13 1.05 -0.72 0.00 0.16 -3.84 105.19 106.83 3i4c n GLY 119 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 3i4c n GLY 119 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3i4c n ILE 120 N -2.00 1.08 -0.97 -0.61 2.08 -0.03 -3.84 119.36 115.07 3i4c n ILE 120 Ca 0.00 0.36 0.05 0.00 0.56 0.00 0.00 62.75 63.72 3i4c n ILE 120 Cb 0.00 -1.51 0.07 0.00 -0.75 0.00 0.00 39.64 37.45 3i4c n ILE 120 CO 0.00 0.00 0.00 -0.46 0.56 0.00 0.00 176.55 176.65 3i4c n ASN 121 N -3.37 1.62 -3.76 4.38 0.23 -0.42 -4.83 115.26 109.10 3i4c n ASN 121 Ca 0.00 -2.44 -0.13 0.00 -0.53 0.00 0.00 54.58 51.48 3i4c n ASN 121 Cb 0.00 -0.24 -0.09 0.00 -2.08 0.00 0.00 39.78 37.36 3i4c n ASN 121 CO 0.00 0.00 0.00 0.12 -0.93 0.00 0.00 177.26 176.45 3i4c s PHE 122 N -1.64 -0.21 0.17 -2.53 5.36 -1.12 -4.75 117.98 113.27 3i4c s PHE 122 Ca 0.15 0.36 -0.33 0.00 -0.96 0.00 0.00 56.93 56.15 3i4c s PHE 122 Cb 0.14 0.10 -0.14 0.00 -0.34 0.00 0.00 43.02 42.77 3i4c s PHE 122 CO 0.01 -0.35 1.54 -0.25 -1.46 0.00 0.00 175.22 174.72 3i4c n ASP 123 N 1.57 2.99 0.00 6.13 8.00 -1.26 0.37 116.55 134.36 3i4c n ASP 123 Ca -0.20 1.09 0.00 0.00 0.71 0.00 0.00 54.79 56.39 3i4c n ASP 123 Cb 0.56 -1.42 0.00 0.00 -0.02 0.00 0.00 41.12 40.24 3i4c n ASP 123 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3i4c n GLY 124 N 3.16 2.45 0.32 0.44 0.00 0.35 -4.04 105.19 107.87 3i4c n GLY 124 Ca 0.16 -1.95 0.14 0.00 0.00 0.00 0.00 46.02 44.38 3i4c n GLY 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i4c n ALA 125 N -3.00 2.68 -0.82 4.61 0.00 0.48 -4.46 120.51 120.00 3i4c n ALA 125 Ca 0.00 -0.38 -0.19 0.00 0.00 0.00 0.00 53.44 52.88 3i4c n ALA 125 Cb 0.00 -1.25 -0.07 0.00 0.00 0.00 0.00 19.45 18.14 3i4c n ALA 125 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3i4c n TYR 126 N -0.26 0.92 -3.83 0.00 4.02 0.13 -4.71 117.16 113.43 3i4c n TYR 126 Ca 0.19 -1.74 -0.07 0.00 -0.01 0.00 0.00 57.90 56.27 3i4c n TYR 126 Cb 0.30 -1.61 0.00 0.00 -0.02 0.00 0.00 39.34 38.01 3i4c n TYR 126 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3i4c s ALA 127 N 2.37 -1.15 0.23 -0.72 0.00 -1.26 -0.69 121.76 120.54 3i4c s ALA 127 Ca 0.48 -0.43 0.09 0.00 0.00 0.00 0.00 51.96 52.10 3i4c s ALA 127 Cb 0.17 0.73 0.21 0.00 0.00 0.00 0.00 23.12 24.23 3i4c s ALA 127 CO -0.02 -1.02 1.52 0.93 0.00 0.00 0.00 175.76 177.17 3i4c h GLU 128 N 2.00 0.03 -4.28 0.00 5.08 -1.78 -3.42 114.58 112.21 3i4c h GLU 128 Ca -0.26 -0.02 -0.18 0.00 -1.00 0.00 0.00 59.36 57.89 3i4c h GLU 128 Cb 1.24 0.01 -0.18 0.00 0.50 0.00 0.00 28.75 30.32 3i4c h GLU 128 CO 0.33 0.73 -0.70 0.71 -1.00 0.00 0.00 179.01 179.08 3i4c s TYR 129 N -3.40 0.53 -0.06 4.33 2.02 -1.26 -1.63 117.35 117.88 3i4c s TYR 129 Ca -0.01 -0.79 -0.10 0.00 -0.37 0.00 0.00 57.07 55.80 3i4c s TYR 129 Cb 0.12 -0.35 0.02 0.00 -0.40 0.00 0.00 41.96 41.35 3i4c s TYR 129 CO 0.78 -0.23 0.25 0.54 -1.57 0.00 0.00 175.55 175.31 3i4c s VAL 130 N -2.71 0.03 -0.17 0.71 0.11 -0.26 -4.90 120.40 113.21 3i4c s VAL 130 Ca -0.02 -0.24 -0.12 0.00 -2.93 0.00 0.00 61.98 58.68 3i4c s VAL 130 Cb -0.01 -0.43 -0.05 0.00 -1.53 0.00 0.00 36.38 34.36 3i4c s VAL 130 CO -0.05 -0.13 0.21 -0.63 -3.33 0.00 0.00 175.10 171.17 3i4c s ILE 131 N -0.48 5.36 -0.35 7.04 -1.09 -1.26 -0.70 121.20 129.72 3i4c s ILE 131 Ca -0.06 0.37 -0.11 0.00 -2.23 0.00 0.00 60.65 58.62 3i4c s ILE 131 Cb -0.04 -3.54 0.01 0.00 -1.58 0.00 0.00 42.46 37.31 3i4c s ILE 131 CO 0.01 0.44 0.20 -0.69 -1.23 0.00 0.00 174.94 173.67 3i4c s VAL 132 N 0.24 4.74 0.29 2.92 1.01 0.32 -4.95 120.40 124.97 3i4c s VAL 132 Ca 0.13 -0.58 0.03 0.00 0.00 0.00 0.00 61.98 61.55 3i4c s VAL 132 Cb -0.12 -3.53 0.33 0.00 0.00 0.00 0.00 36.38 33.06 3i4c s VAL 132 CO 0.02 -0.09 1.63 -0.65 0.00 0.00 0.00 175.10 176.00 3i4c h PRO 133 N 8.43 0.15 -3.50 2.72 0.11 -1.91 -1.28 132.00 136.72 3i4c h PRO 133 Ca -0.29 -0.01 -0.26 0.00 0.11 0.00 0.00 66.00 65.55 3i4c h PRO 133 Cb 1.13 -0.03 -0.31 0.00 0.11 0.00 0.00 31.00 31.89 3i4c h PRO 133 CO 0.65 0.10 -0.68 -1.58 -0.21 0.00 0.00 178.00 176.27 3i4c s HIS 134 N -5.93 -0.04 0.67 0.65 2.46 -1.26 -3.09 115.29 108.74 3i4c s HIS 134 Ca -0.12 0.20 0.41 0.00 0.47 0.00 0.00 55.06 56.03 3i4c s HIS 134 Cb 0.27 -0.12 2.26 0.00 -0.13 0.00 0.00 32.58 34.86 3i4c s HIS 134 CO 0.77 -0.08 2.28 0.10 -2.47 0.00 0.00 174.74 175.34 3i4c h TYR 135 N 6.88 0.00 0.00 3.88 -0.00 -1.55 -2.58 116.97 123.59 3i4c h TYR 135 Ca -0.38 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.35 3i4c h TYR 135 Cb 1.15 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.88 3i4c h TYR 135 CO 0.46 0.00 0.00 0.36 -0.00 0.00 0.00 178.16 178.98 3i4c n LYS 136 N -3.06 0.17 -0.07 0.10 2.85 -1.26 -2.00 118.16 114.89 3i4c n LYS 136 Ca -0.03 0.52 0.10 0.00 -1.05 0.00 0.00 58.31 57.86 3i4c n LYS 136 Cb 0.14 -1.91 0.41 0.00 -0.65 0.00 0.00 35.03 33.01 3i4c n LYS 136 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 3i4c n TYR 137 N -2.25 0.17 -3.25 5.58 4.01 -0.97 -4.90 117.16 115.54 3i4c n TYR 137 Ca 0.01 -0.09 -0.19 0.00 -0.16 0.00 0.00 57.90 57.47 3i4c n TYR 137 Cb 0.14 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.18 3i4c n TYR 137 CO 0.00 0.00 0.00 -1.64 -0.46 0.00 0.00 176.86 174.76 3i4c s MET 138 N -1.83 3.02 -0.07 -0.72 -1.94 -0.85 -0.76 119.30 116.15 3i4c s MET 138 Ca 0.32 -0.97 -0.03 0.00 -1.71 0.00 0.00 55.69 53.30 3i4c s MET 138 Cb 0.17 -2.75 0.04 0.00 2.01 0.00 0.00 34.83 34.30 3i4c s MET 138 CO 0.26 -0.10 0.14 -0.47 -0.01 0.00 0.00 175.02 174.83 3i4c s TYR 139 N -2.30 -0.12 -0.02 -0.03 6.14 -0.58 -4.95 117.35 115.49 3i4c s TYR 139 Ca 0.48 0.52 -0.30 0.00 0.64 0.00 0.00 57.07 58.41 3i4c s TYR 139 Cb -0.10 -0.30 -0.05 0.00 0.42 0.00 0.00 41.96 41.93 3i4c s TYR 139 CO 0.33 -0.25 1.45 0.21 0.64 0.00 0.00 175.55 177.94 3i4c s LYS 140 N 2.20 4.25 0.11 4.97 2.20 -1.26 -1.43 119.74 130.78 3i4c s LYS 140 Ca 0.03 2.01 -0.22 0.00 -0.36 0.00 0.00 55.97 57.43 3i4c s LYS 140 Cb -0.12 -3.66 -0.07 0.00 -1.51 0.00 0.00 37.83 32.46 3i4c s LYS 140 CO -0.05 -0.65 0.66 -0.51 -0.36 0.00 0.00 175.35 174.44 3i4c s LEU 141 N 2.80 4.55 0.00 5.43 1.43 0.56 -4.94 118.68 128.51 3i4c s LEU 141 Ca 0.65 1.42 0.00 0.00 -1.03 0.00 0.00 54.13 55.18 3i4c s LEU 141 Cb -0.32 -3.07 0.00 0.00 0.03 0.00 0.00 46.19 42.83 3i4c s LEU 141 CO 0.26 0.24 0.00 -1.14 0.23 0.00 0.00 176.35 175.95 3i4c n ARG 142 N 1.64 0.24 -0.13 1.70 0.63 -1.26 -4.67 116.66 114.82 3i4c n ARG 142 Ca -0.08 0.00 -0.18 0.00 -0.92 0.00 0.00 57.85 56.67 3i4c n ARG 142 Cb 0.50 -0.81 -0.12 0.00 0.45 0.00 0.00 32.46 32.48 3i4c n ARG 142 CO 0.00 0.00 0.00 -2.13 -2.51 0.00 0.00 177.63 172.99 3i4c n ARG 143 N -2.04 0.65 -3.12 -0.14 0.63 -1.26 -5.00 116.66 106.38 3i4c n ARG 143 Ca 0.00 0.15 -0.32 0.00 -0.92 0.00 0.00 57.85 56.76 3i4c n ARG 143 Cb 0.31 -1.52 -0.05 0.00 0.45 0.00 0.00 32.46 31.64 3i4c n ARG 143 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 3i4c s LEU 144 N -6.49 4.03 0.47 6.15 1.43 -1.26 -5.10 118.68 117.91 3i4c s LEU 144 Ca -0.34 1.19 0.05 0.00 -1.03 0.00 0.00 54.13 54.00 3i4c s LEU 144 Cb 0.09 -4.00 0.02 0.00 0.03 0.00 0.00 46.19 42.32 3i4c s LEU 144 CO 0.61 -0.23 0.65 0.54 0.23 0.00 0.00 176.35 178.16 3i4c s ASN 145 N -2.49 5.55 0.23 2.29 2.20 -1.26 -4.87 114.94 116.58 3i4c s ASN 145 Ca 0.52 -0.18 -0.07 0.00 -0.94 0.00 0.00 52.86 52.19 3i4c s ASN 145 Cb -0.10 -0.86 0.36 0.00 -2.00 0.00 0.00 41.25 38.64 3i4c s ASN 145 CO 0.21 -0.88 1.74 0.00 -2.94 0.00 0.00 177.10 175.23 3i4c h ALA 146 N 0.42 0.92 -0.63 3.54 0.00 -1.92 -2.01 119.26 119.58 3i4c h ALA 146 Ca -0.42 0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.59 3i4c h ALA 146 Cb 1.28 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 19.10 3i4c h ALA 146 CO 0.49 -0.18 0.39 0.28 0.00 0.00 0.00 179.25 180.24 3i4c h VAL 147 N 0.44 1.17 -0.10 0.00 2.07 -1.93 -0.85 116.25 117.06 3i4c h VAL 147 Ca 0.36 -0.36 -0.09 0.00 0.82 0.00 0.00 66.70 67.42 3i4c h VAL 147 Cb 0.48 0.29 -0.01 0.00 -1.52 0.00 0.00 31.29 30.53 3i4c h VAL 147 CO -0.35 0.17 -0.36 -0.33 0.02 0.00 0.00 177.57 176.72 3i4c h GLU 148 N 0.85 0.21 0.13 1.57 5.08 -1.83 -3.33 114.58 117.27 3i4c h GLU 148 Ca 0.23 -0.09 -0.32 0.00 -1.00 0.00 0.00 59.36 58.18 3i4c h GLU 148 Cb -0.06 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.18 3i4c h GLU 148 CO -0.05 0.55 -1.60 0.00 -1.00 0.00 0.00 179.01 176.91 3i4c h ALA 149 N 1.44 0.26 -0.68 3.43 0.00 -0.99 -3.40 119.26 119.32 3i4c h ALA 149 Ca 0.02 -1.13 0.13 0.00 0.00 0.00 0.00 54.91 53.93 3i4c h ALA 149 Cb 0.73 0.34 -0.13 0.00 0.00 0.00 0.00 17.79 18.73 3i4c h ALA 149 CO 0.06 1.12 -0.18 0.00 0.00 0.00 0.00 179.25 180.25 3i4c h ALA 150 N 0.40 0.43 0.00 0.00 0.00 -1.27 0.36 119.26 119.18 3i4c h ALA 150 Ca -0.27 0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 3i4c h ALA 150 Cb 2.04 0.53 -0.00 0.00 0.00 0.00 0.00 17.79 20.35 3i4c h ALA 150 CO 0.16 -0.43 -0.05 -1.35 0.00 0.00 0.00 179.25 177.59 3i4c h PRO 151 N -0.01 0.00 0.00 0.00 0.11 -1.78 -2.31 132.00 128.02 3i4c h PRO 151 Ca 0.32 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.41 3i4c h PRO 151 Cb 0.50 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.61 3i4c h PRO 151 CO -0.70 0.05 -0.11 -0.07 -0.21 0.00 0.00 178.00 176.97 3i4c h LEU 152 N 0.00 0.00 0.00 2.35 4.07 -1.15 -1.16 115.31 119.42 3i4c h LEU 152 Ca -0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 3i4c h LEU 152 Cb 0.16 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.90 3i4c h LEU 152 CO 0.01 0.11 0.00 0.35 -1.08 0.00 0.00 178.44 177.82 3i4c n THR 153 N -3.38 0.57 0.00 0.22 -2.24 -0.87 -1.79 114.28 106.79 3i4c n THR 153 Ca -0.01 0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.91 3i4c n THR 153 Cb 0.29 -0.80 0.00 0.00 -2.10 0.00 0.00 70.33 67.72 3i4c n THR 153 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3i4c h SER 155 N 0.00 0.33 0.07 0.00 0.02 -1.44 -1.24 113.55 111.28 3i4c h SER 155 Ca 0.00 -0.07 -0.00 0.00 -0.84 0.00 0.00 61.79 60.87 3i4c h SER 155 Cb 0.00 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 62.45 3i4c h SER 155 CO 0.00 0.48 -0.03 1.23 -1.14 0.00 0.00 176.83 177.37 3i4c h GLY 156 N 0.82 -0.09 1.00 -3.77 0.00 -1.44 -1.20 103.07 98.38 3i4c h GLY 156 Ca 0.07 0.03 0.00 0.00 0.00 0.00 0.00 47.33 47.43 3i4c h GLY 156 CO 0.02 -0.03 0.15 -2.22 0.00 0.00 0.00 176.54 174.46 3i4c h ILE 157 N -0.43 1.06 0.03 2.60 2.04 -1.24 -0.13 117.51 121.45 3i4c h ILE 157 Ca -0.01 -0.12 0.03 0.00 1.00 0.00 0.00 64.86 65.76 3i4c h ILE 157 Cb 0.37 0.72 -0.04 0.00 -0.74 0.00 0.00 36.82 37.14 3i4c h ILE 157 CO 0.02 0.06 -0.21 0.74 0.00 0.00 0.00 178.15 178.75 3i4c h THR 158 N 0.31 0.51 -0.44 -0.27 2.02 -1.21 -1.51 112.91 112.32 3i4c h THR 158 Ca 0.09 0.00 -0.09 0.00 0.77 0.00 0.00 66.41 67.17 3i4c h THR 158 Cb -0.03 0.51 -0.02 0.00 -1.74 0.00 0.00 68.15 66.87 3i4c h THR 158 CO -0.02 0.00 -0.11 0.74 0.37 0.00 0.00 175.52 176.50 3i4c h THR 159 N -0.36 1.26 -0.49 3.16 2.02 -1.12 -1.43 112.91 115.95 3i4c h THR 159 Ca 0.05 -1.17 0.01 0.00 0.77 0.00 0.00 66.41 66.07 3i4c h THR 159 Cb 0.42 1.04 -0.03 0.00 -1.74 0.00 0.00 68.15 67.84 3i4c h THR 159 CO -0.17 0.40 0.32 0.22 0.37 0.00 0.00 175.52 176.66 3i4c h TYR 160 N 0.71 0.61 -0.41 3.16 5.03 -0.73 -1.07 116.97 124.28 3i4c h TYR 160 Ca 0.12 0.02 -0.13 0.00 2.58 0.00 0.00 58.73 61.32 3i4c h TYR 160 Cb 0.59 -0.20 -0.01 0.00 1.55 0.00 0.00 36.73 38.65 3i4c h TYR 160 CO 0.03 0.38 -0.24 -0.09 -1.32 0.00 0.00 178.16 176.91 3i4c h ARG 161 N 0.65 0.85 -0.70 1.82 2.43 -1.11 -2.33 114.38 115.99 3i4c h ARG 161 Ca 0.18 -0.36 -0.00 0.00 -0.81 0.00 0.00 59.98 58.99 3i4c h ARG 161 Cb -0.06 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.43 3i4c h ARG 161 CO -0.05 1.00 0.42 0.00 -1.51 0.00 0.00 179.97 179.83 3i4c h ALA 162 N 0.99 0.89 -0.58 2.80 0.00 -0.81 -0.46 119.26 122.09 3i4c h ALA 162 Ca 0.09 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 3i4c h ALA 162 Cb 0.78 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 3i4c h ALA 162 CO 0.06 0.37 0.24 0.28 0.00 0.00 0.00 179.25 180.20 3i4c h VAL 163 N 0.95 1.22 -0.77 0.00 2.07 -1.05 -2.39 116.25 116.28 3i4c h VAL 163 Ca 0.25 -0.69 0.01 0.00 0.82 0.00 0.00 66.70 67.10 3i4c h VAL 163 Cb -0.03 0.59 -0.04 0.00 -1.52 0.00 0.00 31.29 30.29 3i4c h VAL 163 CO -0.05 0.27 0.51 0.03 0.02 0.00 0.00 177.57 178.35 3i4c h ARG 164 N 0.80 1.01 0.00 1.57 3.08 -0.86 -1.38 114.38 118.61 3i4c h ARG 164 Ca 0.19 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.18 3i4c h ARG 164 Cb 0.19 -0.23 0.00 0.00 0.08 0.00 0.00 29.97 30.01 3i4c h ARG 164 CO -0.02 0.67 0.00 0.87 -1.07 0.00 0.00 179.97 180.42 3i4c h LYS 165 N 1.04 0.00 0.00 0.04 1.57 -0.66 -2.11 116.57 116.44 3i4c h LYS 165 Ca 0.29 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.07 3i4c h LYS 165 Cb -0.11 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.20 3i4c h LYS 165 CO -0.07 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 178.81 3i4c n ALA 166 N -1.87 1.90 -3.82 3.86 0.00 -0.52 -4.92 120.51 115.13 3i4c n ALA 166 Ca 0.00 -0.03 -0.31 0.00 0.00 0.00 0.00 53.44 53.10 3i4c n ALA 166 Cb 0.18 -1.35 0.02 0.00 0.00 0.00 0.00 19.45 18.29 3i4c n ALA 166 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3i4c n SER 167 N -1.73 -3.33 -4.88 0.00 7.64 -0.80 -4.79 113.62 105.73 3i4c n SER 167 Ca 0.04 -1.04 -0.30 0.00 1.01 0.00 0.00 58.87 58.58 3i4c n SER 167 Cb 0.25 -3.08 -0.01 0.00 -1.01 0.00 0.00 64.21 60.36 3i4c n SER 167 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3i4c s LEU 168 N -6.76 3.59 0.25 -3.43 1.43 -1.26 -5.06 118.68 107.43 3i4c s LEU 168 Ca 0.30 1.18 -0.21 0.00 -1.03 0.00 0.00 54.13 54.37 3i4c s LEU 168 Cb -0.12 -4.14 0.03 0.00 0.03 0.00 0.00 46.19 41.99 3i4c s LEU 168 CO 0.88 -0.60 0.68 1.51 0.23 0.00 0.00 176.35 179.06 3i4c s ASP 169 N -3.72 -0.33 0.59 2.29 1.47 -1.26 -4.99 116.67 110.72 3i4c s ASP 169 Ca 0.52 -0.46 0.30 0.00 1.18 0.00 0.00 52.55 54.08 3i4c s ASP 169 Cb -0.10 0.69 1.64 0.00 -0.34 0.00 0.00 42.92 44.81 3i4c s ASP 169 CO 0.41 -1.25 1.91 -0.65 0.68 0.00 0.00 175.17 176.28 3i4c h PRO 170 N 2.01 0.00 -0.01 2.11 0.11 -1.75 -1.13 132.00 133.34 3i4c h PRO 170 Ca -0.23 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.88 3i4c h PRO 170 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 3i4c h PRO 170 CO 0.27 0.00 -0.16 0.25 -0.21 0.00 0.00 178.00 178.16 3i4c n THR 171 N -2.76 0.00 -3.65 -1.15 -2.24 -1.26 -4.76 114.28 98.45 3i4c n THR 171 Ca -0.02 -0.20 -0.21 0.00 -2.27 0.00 0.00 64.05 61.35 3i4c n THR 171 Cb 0.28 0.54 -0.03 0.00 -2.10 0.00 0.00 70.33 69.02 3i4c n THR 171 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3i4c s LYS 172 N -2.28 2.58 -0.03 -0.78 1.02 -0.43 -5.03 119.74 114.80 3i4c s LYS 172 Ca 0.30 -1.47 0.03 0.00 0.02 0.00 0.00 55.97 54.85 3i4c s LYS 172 Cb 0.20 -2.40 0.00 0.00 -0.52 0.00 0.00 37.83 35.11 3i4c s LYS 172 CO 0.44 -0.10 -0.12 0.99 -0.92 0.00 0.00 175.35 175.64 3i4c s THR 173 N -2.42 0.98 0.02 2.17 2.01 -1.26 -1.24 115.64 115.90 3i4c s THR 173 Ca 0.46 -0.47 0.05 0.00 0.31 0.00 0.00 61.69 62.04 3i4c s THR 173 Cb -0.04 -0.86 -0.03 0.00 0.01 0.00 0.00 72.50 71.58 3i4c s THR 173 CO 0.27 0.30 -0.13 -0.22 -0.69 0.00 0.00 174.62 174.14 3i4c s LEU 174 N 0.12 2.83 -0.14 4.42 2.96 0.68 -1.03 118.68 128.52 3i4c s LEU 174 Ca -0.03 -0.30 0.00 0.00 -0.22 0.00 0.00 54.13 53.58 3i4c s LEU 174 Cb -0.09 -1.64 -0.01 0.00 0.50 0.00 0.00 46.19 44.95 3i4c s LEU 174 CO 0.01 0.27 -0.14 -0.22 -1.32 0.00 0.00 176.35 174.95 3i4c s LEU 175 N -1.39 2.58 -0.24 -0.68 2.96 -0.43 -0.27 118.68 121.21 3i4c s LEU 175 Ca 0.15 -0.40 -0.05 0.00 -0.22 0.00 0.00 54.13 53.61 3i4c s LEU 175 Cb -0.11 -1.58 -0.01 0.00 0.50 0.00 0.00 46.19 44.99 3i4c s LEU 175 CO 0.06 0.12 0.00 -0.69 -1.32 0.00 0.00 176.35 174.52 3i4c s VAL 176 N 0.60 3.63 0.19 1.68 1.01 0.04 -1.07 120.40 126.49 3i4c s VAL 176 Ca -0.08 -0.50 -0.28 0.00 0.00 0.00 0.00 61.98 61.11 3i4c s VAL 176 Cb -0.16 -2.72 -0.08 0.00 0.00 0.00 0.00 36.38 33.43 3i4c s VAL 176 CO 0.03 0.33 0.87 -0.69 0.00 0.00 0.00 175.10 175.64 3i4c s VAL 177 N 1.50 4.24 -1.31 2.92 1.01 -0.56 -1.61 120.40 126.59 3i4c s VAL 177 Ca 0.05 1.93 -0.06 0.00 0.00 0.00 0.00 61.98 63.90 3i4c s VAL 177 Cb -0.15 -4.25 0.01 0.00 0.00 0.00 0.00 36.38 31.99 3i4c s VAL 177 CO -0.01 0.49 1.11 0.61 0.00 0.00 0.00 175.10 177.30 3i4c n GLY 178 N 1.63 -0.48 0.16 4.51 0.00 0.47 -4.42 105.19 107.07 3i4c n GLY 178 Ca -0.03 0.20 0.12 0.00 0.00 0.00 0.00 46.02 46.31 3i4c n GLY 178 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i4c h ALA 179 N 0.97 1.00 -0.02 4.61 0.00 -1.22 -2.66 119.26 121.95 3i4c h ALA 179 Ca -0.58 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.33 3i4c h ALA 179 Cb 1.36 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.15 3i4c h ALA 179 CO 0.54 0.00 -0.10 0.41 0.00 0.00 0.00 179.25 180.10 3i4c n GLY 180 N -0.88 0.19 3.97 0.00 0.00 -1.24 -2.20 105.19 105.02 3i4c n GLY 180 Ca -0.00 -0.53 -0.26 0.00 0.00 0.00 0.00 46.02 45.22 3i4c n GLY 180 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3i4c s GLY 181 N -2.14 1.77 0.11 -0.02 0.00 -1.00 -4.76 107.32 101.29 3i4c s GLY 181 Ca 0.30 -1.59 -0.27 0.00 0.00 0.00 0.00 44.72 43.16 3i4c s GLY 181 CO 0.38 -0.91 1.63 -1.33 0.00 0.00 0.00 173.10 172.87 3i4c h GLY 182 N -1.03 -0.53 1.05 0.20 0.00 -1.92 -0.09 103.07 100.74 3i4c h GLY 182 Ca -0.39 0.34 -0.09 0.00 0.00 0.00 0.00 47.33 47.19 3i4c h GLY 182 CO 0.37 -0.23 -0.01 1.41 0.00 0.00 0.00 176.54 178.08 3i4c h LEU 183 N -0.49 0.96 0.03 3.11 4.07 -1.95 -2.80 115.31 118.24 3i4c h LEU 183 Ca 0.04 -0.31 0.00 0.00 0.08 0.00 0.00 57.88 57.69 3i4c h LEU 183 Cb 0.53 -0.26 -0.00 0.00 1.08 0.00 0.00 40.66 42.01 3i4c h LEU 183 CO -0.18 1.04 -0.03 1.23 -1.08 0.00 0.00 178.44 179.41 3i4c h GLY 184 N 0.86 -0.06 1.42 0.83 0.00 -1.61 -0.16 103.07 104.35 3i4c h GLY 184 Ca 0.16 0.03 -0.04 0.00 0.00 0.00 0.00 47.33 47.48 3i4c h GLY 184 CO 0.03 -0.03 0.13 -0.91 0.00 0.00 0.00 176.54 175.76 3i4c h THR 185 N -0.07 1.21 -0.47 4.70 1.35 -0.53 -0.66 112.91 118.44 3i4c h THR 185 Ca 0.00 -0.72 -0.03 0.00 -0.55 0.00 0.00 66.41 65.10 3i4c h THR 185 Cb 0.06 0.69 -0.02 0.00 -1.73 0.00 0.00 68.15 67.15 3i4c h THR 185 CO -0.01 0.27 0.16 -0.03 -0.25 0.00 0.00 175.52 175.66 3i4c h MET 186 N 0.72 0.72 -0.53 4.72 -1.53 -1.19 -0.04 114.93 117.80 3i4c h MET 186 Ca 0.16 -0.15 -0.02 0.00 -3.44 0.00 0.00 59.70 56.26 3i4c h MET 186 Cb 0.25 -0.11 -0.02 0.00 -0.55 0.00 0.00 31.60 31.16 3i4c h MET 186 CO -0.01 0.67 0.26 0.00 0.14 0.00 0.00 176.91 177.98 3i4c h ALA 187 N 1.01 0.69 -0.21 0.39 0.00 -0.53 -0.67 119.26 119.94 3i4c h ALA 187 Ca 0.15 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3i4c h ALA 187 Cb 0.24 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 3i4c h ALA 187 CO -0.01 0.25 0.14 0.28 0.00 0.00 0.00 179.25 179.90 3i4c h VAL 188 N 0.71 1.06 -0.46 0.00 2.07 -0.85 0.09 116.25 118.86 3i4c h VAL 188 Ca 0.18 -0.11 -0.01 0.00 0.82 0.00 0.00 66.70 67.59 3i4c h VAL 188 Cb 0.11 0.76 -0.02 0.00 -1.52 0.00 0.00 31.29 30.62 3i4c h VAL 188 CO -0.02 0.05 0.26 1.56 0.02 0.00 0.00 177.57 179.44 3i4c h GLN 189 N 0.28 0.63 -0.36 1.57 4.20 -0.75 -0.14 115.11 120.54 3i4c h GLN 189 Ca 0.08 -0.07 -0.04 0.00 0.06 0.00 0.00 58.65 58.69 3i4c h GLN 189 Cb -0.03 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 27.61 3i4c h GLN 189 CO -0.02 0.48 0.09 0.82 -0.67 0.00 0.00 178.83 179.53 3i4c h ILE 190 N 0.60 1.22 -0.77 2.54 2.04 -0.94 -0.56 117.51 121.65 3i4c h ILE 190 Ca 0.16 -0.76 -0.04 0.00 1.00 0.00 0.00 64.86 65.22 3i4c h ILE 190 Cb 0.02 1.03 -0.03 0.00 -0.74 0.00 0.00 36.82 37.10 3i4c h ILE 190 CO -0.03 0.26 0.31 0.00 0.00 0.00 0.00 178.15 178.70 3i4c h ALA 191 N 0.93 1.10 -0.64 1.87 0.00 -0.81 0.30 119.26 122.02 3i4c h ALA 191 Ca 0.11 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.77 3i4c h ALA 191 Cb 0.30 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 3i4c h ALA 191 CO 0.00 0.64 0.13 -0.22 0.00 0.00 0.00 179.25 179.80 3i4c h LYS 192 N 1.11 1.02 0.00 0.00 1.63 -0.76 -2.34 116.57 117.23 3i4c h LYS 192 Ca 0.26 -0.25 -0.11 0.00 -0.85 0.00 0.00 60.65 59.70 3i4c h LYS 192 Cb 0.20 -0.13 -0.02 0.00 -0.60 0.00 0.00 32.23 31.68 3i4c h LYS 192 CO -0.02 0.92 -0.55 0.00 -3.45 0.00 0.00 179.45 176.35 3i4c h ALA 193 N 1.17 0.66 -0.01 5.00 0.00 -0.54 -3.40 119.26 122.15 3i4c h ALA 193 Ca 0.20 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.63 3i4c h ALA 193 Cb 0.38 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.10 3i4c h ALA 193 CO 0.01 0.65 -0.05 1.33 0.00 0.00 0.00 179.25 181.19 3i4c n VAL 194 N -3.21 0.00 0.00 0.00 0.24 0.04 -4.92 118.33 110.48 3i4c n VAL 194 Ca 0.02 -0.48 0.00 0.00 -2.04 0.00 0.00 64.34 61.84 3i4c n VAL 194 Cb 0.74 1.09 0.00 0.00 -1.47 0.00 0.00 33.84 34.20 3i4c n VAL 194 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 3i4c n SER 195 N 0.00 3.35 0.00 -1.34 3.41 -0.89 -5.01 113.62 113.14 3i4c n SER 195 Ca 0.03 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.64 3i4c n SER 195 Cb 0.12 0.21 0.00 0.00 -0.26 0.00 0.00 64.21 64.28 3i4c n SER 195 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3i4c n GLY 196 N 2.59 1.07 3.81 5.00 0.00 -1.26 -3.64 105.19 112.77 3i4c n GLY 196 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 3i4c n GLY 196 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i4c s ALA 197 N -3.41 2.71 0.19 4.61 0.00 -1.25 -4.33 121.76 120.27 3i4c s ALA 197 Ca 0.00 0.20 -0.30 0.00 0.00 0.00 0.00 51.96 51.86 3i4c s ALA 197 Cb 0.00 -3.20 -0.08 0.00 0.00 0.00 0.00 23.12 19.85 3i4c s ALA 197 CO 0.00 -1.05 1.03 0.99 0.00 0.00 0.00 175.76 176.72 3i4c s THR 198 N -2.81 4.02 -0.16 0.00 2.01 -0.37 -4.90 115.64 113.42 3i4c s THR 198 Ca 0.60 1.82 -0.00 0.00 0.31 0.00 0.00 61.69 64.42 3i4c s THR 198 Cb -0.15 -4.16 -0.01 0.00 0.01 0.00 0.00 72.50 68.20 3i4c s THR 198 CO 0.48 0.35 -0.13 -0.63 -0.69 0.00 0.00 174.62 174.00 3i4c s ILE 199 N -0.53 2.86 -0.17 1.82 1.01 -1.26 -0.23 121.20 124.71 3i4c s ILE 199 Ca 0.46 -0.70 -0.01 0.00 0.00 0.00 0.00 60.65 60.39 3i4c s ILE 199 Cb -0.27 -2.22 -0.01 0.00 0.01 0.00 0.00 42.46 39.97 3i4c s ILE 199 CO 0.34 0.50 -0.11 -0.63 0.00 0.00 0.00 174.94 175.05 3i4c s ILE 200 N 0.80 3.05 -0.10 2.92 1.01 0.63 -0.63 121.20 128.89 3i4c s ILE 200 Ca -0.05 -0.63 -0.00 0.00 0.00 0.00 0.00 60.65 59.97 3i4c s ILE 200 Cb -0.15 -2.32 -0.03 0.00 0.01 0.00 0.00 42.46 39.97 3i4c s ILE 200 CO 0.00 0.49 -0.08 -0.83 0.00 0.00 0.00 174.94 174.52 3i4c s GLY 201 N 0.87 1.65 -0.01 6.18 0.00 0.33 -0.78 107.32 115.56 3i4c s GLY 201 Ca -0.03 -0.89 0.06 0.00 0.00 0.00 0.00 44.72 43.86 3i4c s GLY 201 CO 0.00 -0.44 -0.18 0.54 0.00 0.00 0.00 173.10 173.01 3i4c s VAL 202 N -0.29 1.44 0.17 1.40 0.11 -0.64 -0.38 120.40 122.22 3i4c s VAL 202 Ca 0.04 -0.81 -0.03 0.00 -2.93 0.00 0.00 61.98 58.24 3i4c s VAL 202 Cb -0.13 -1.21 0.01 0.00 -1.53 0.00 0.00 36.38 33.53 3i4c s VAL 202 CO 0.03 0.39 0.29 -0.67 -3.33 0.00 0.00 175.10 171.80 3i4c n ASP 203 N 2.57 -0.82 -0.05 3.54 -0.08 -0.64 -0.39 116.55 120.68 3i4c n ASP 203 Ca -0.15 -1.82 0.01 0.00 -1.51 0.00 0.00 54.79 51.32 3i4c n ASP 203 Cb 0.54 1.44 0.01 0.00 2.34 0.00 0.00 41.12 45.45 3i4c n ASP 203 CO 0.00 0.00 0.00 1.33 0.12 0.00 0.00 177.20 178.65 3i4c n VAL 204 N -0.26 0.11 -4.56 5.18 0.24 -1.26 -0.88 118.33 116.90 3i4c n VAL 204 Ca -0.02 -0.55 -0.23 0.00 -2.04 0.00 0.00 64.34 61.50 3i4c n VAL 204 Cb 0.27 0.97 -0.14 0.00 -1.47 0.00 0.00 33.84 33.47 3i4c n VAL 204 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 3i4c s ARG 205 N -0.19 1.18 0.24 7.34 0.52 -1.26 -4.49 118.95 122.30 3i4c s ARG 205 Ca 0.01 -0.77 -0.04 0.00 -0.52 0.00 0.00 55.73 54.41 3i4c s ARG 205 Cb 0.01 -1.21 0.43 0.00 0.52 0.00 0.00 34.95 34.70 3i4c s ARG 205 CO 0.01 0.31 1.76 0.93 0.02 0.00 0.00 175.30 178.33 3i4c h GLU 206 N 5.13 0.53 -0.15 3.54 5.08 -1.99 0.11 114.58 126.83 3i4c h GLU 206 Ca -0.39 -0.03 -0.12 0.00 -1.00 0.00 0.00 59.36 57.82 3i4c h GLU 206 Cb 1.17 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.29 3i4c h GLU 206 CO 0.45 0.35 -0.42 1.05 -1.00 0.00 0.00 179.01 179.44 3i4c h GLU 207 N 0.54 0.35 -0.33 2.33 -0.00 -1.99 -1.05 114.58 114.43 3i4c h GLU 207 Ca 0.40 -0.17 -0.12 0.00 -0.00 0.00 0.00 59.36 59.47 3i4c h GLU 207 Cb 0.54 0.00 -0.01 0.00 -0.00 0.00 0.00 28.75 29.28 3i4c h GLU 207 CO -0.34 0.71 -0.26 0.00 -0.00 0.00 0.00 179.01 179.12 3i4c h ALA 208 N 1.27 0.48 -0.85 1.06 0.00 -1.52 -1.12 119.26 118.57 3i4c h ALA 208 Ca 0.02 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.53 3i4c h ALA 208 Cb 0.87 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.51 3i4c h ALA 208 CO 0.07 0.48 0.50 0.28 0.00 0.00 0.00 179.25 180.58 3i4c h VAL 209 N 0.54 1.24 -0.33 0.00 2.07 -0.66 -1.31 116.25 117.81 3i4c h VAL 209 Ca 0.06 -0.56 -0.11 0.00 0.82 0.00 0.00 66.70 66.91 3i4c h VAL 209 Cb 0.83 0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.65 3i4c h VAL 209 CO 0.07 0.26 -0.26 -0.08 0.02 0.00 0.00 177.57 177.58 3i4c h GLU 210 N 1.18 0.67 -0.26 1.57 4.57 -1.02 -2.45 114.58 118.84 3i4c h GLU 210 Ca 0.30 -0.28 -0.08 0.00 -1.18 0.00 0.00 59.36 58.13 3i4c h GLU 210 Cb -0.01 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.53 3i4c h GLU 210 CO -0.05 0.86 -0.18 0.00 -1.18 0.00 0.00 179.01 178.46 3i4c h ALA 211 N 1.13 1.22 -0.47 2.92 0.00 -0.66 -1.50 119.26 121.90 3i4c h ALA 211 Ca 0.08 -0.30 -0.10 0.00 0.00 0.00 0.00 54.91 54.59 3i4c h ALA 211 Cb 0.74 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 3i4c h ALA 211 CO 0.06 0.51 -0.11 0.00 0.00 0.00 0.00 179.25 179.70 3i4c h ALA 212 N 1.40 0.92 -0.05 0.00 0.00 -0.94 -1.16 119.26 119.43 3i4c h ALA 212 Ca 0.07 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.64 3i4c h ALA 212 Cb 0.56 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 3i4c h ALA 212 CO 0.04 0.63 0.01 -0.22 0.00 0.00 0.00 179.25 179.71 3i4c h LYS 213 N 0.77 0.08 0.00 0.00 1.63 -0.99 -2.46 116.57 115.60 3i4c h LYS 213 Ca 0.13 -0.02 -0.01 0.00 -0.85 0.00 0.00 60.65 59.90 3i4c h LYS 213 Cb 0.63 -0.01 -0.00 0.00 -0.60 0.00 0.00 32.23 32.24 3i4c h LYS 213 CO 0.04 0.28 -0.05 0.00 -3.45 0.00 0.00 179.45 176.27 3i4c h ARG 214 N -0.15 0.00 0.00 1.90 3.08 -1.13 -0.73 114.38 117.36 3i4c h ARG 214 Ca 0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.06 3i4c h ARG 214 Cb 0.24 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.29 3i4c h ARG 214 CO 0.00 0.05 0.00 0.00 -1.07 0.00 0.00 179.97 178.95 3i4c h ALA 215 N 1.95 1.00 0.00 0.04 0.00 -0.76 -3.47 119.26 118.02 3i4c h ALA 215 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3i4c h ALA 215 Cb 0.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.96 3i4c h ALA 215 CO 0.01 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.67 3i4c n GLY 216 N 0.74 0.93 3.75 0.00 0.00 -0.28 -3.94 105.19 106.39 3i4c n GLY 216 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 3i4c n GLY 216 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i4c s ALA 217 N -1.86 3.72 0.22 4.61 0.00 -1.00 -4.89 121.76 122.56 3i4c s ALA 217 Ca 0.00 1.53 0.01 0.00 0.00 0.00 0.00 51.96 53.51 3i4c s ALA 217 Cb 0.00 -3.63 0.20 0.00 0.00 0.00 0.00 23.12 19.69 3i4c s ALA 217 CO 0.00 -0.95 1.54 -0.44 0.00 0.00 0.00 175.76 175.91 3i4c h ASP 218 N 4.84 0.41 -4.46 0.00 3.32 -1.23 -3.45 116.42 115.86 3i4c h ASP 218 Ca -0.47 -0.23 -0.23 0.00 0.02 0.00 0.00 57.03 56.12 3i4c h ASP 218 Cb 1.22 -0.12 -0.24 0.00 0.22 0.00 0.00 39.33 40.41 3i4c h ASP 218 CO 0.79 0.90 -0.72 -0.31 -1.72 0.00 0.00 179.24 178.18 3i4c s TYR 219 N -3.87 0.33 0.07 4.55 2.02 -0.70 -5.02 117.35 114.73 3i4c s TYR 219 Ca -0.05 -0.33 0.05 0.00 -0.37 0.00 0.00 57.07 56.37 3i4c s TYR 219 Cb 0.12 -0.21 -0.03 0.00 -0.40 0.00 0.00 41.96 41.44 3i4c s TYR 219 CO 0.81 -0.09 -0.14 0.14 -1.57 0.00 0.00 175.55 174.71 3i4c s VAL 220 N -0.88 1.07 -0.03 0.71 -7.23 -1.26 -0.51 120.40 112.27 3i4c s VAL 220 Ca -0.08 -1.29 0.02 0.00 -1.81 0.00 0.00 61.98 58.82 3i4c s VAL 220 Cb -0.06 -1.04 0.01 0.00 0.56 0.00 0.00 36.38 35.85 3i4c s VAL 220 CO -0.00 -0.24 -0.06 -0.63 -0.31 0.00 0.00 175.10 173.86 3i4c s ILE 221 N -1.28 0.61 -0.57 -0.62 1.01 0.49 -4.93 121.20 115.92 3i4c s ILE 221 Ca -0.03 -0.24 -0.12 0.00 0.00 0.00 0.00 60.65 60.26 3i4c s ILE 221 Cb -0.10 -0.57 0.14 0.00 0.01 0.00 0.00 42.46 41.94 3i4c s ILE 221 CO 0.02 0.21 0.48 0.21 0.00 0.00 0.00 174.94 175.87 3i4c s ASN 222 N 0.41 6.05 0.17 3.58 3.84 -1.26 -1.62 114.94 126.12 3i4c s ASN 222 Ca -0.06 -2.04 0.13 0.00 0.21 0.00 0.00 52.86 51.10 3i4c s ASN 222 Cb -0.10 -2.12 0.67 0.00 -0.55 0.00 0.00 41.25 39.16 3i4c s ASN 222 CO 0.00 -0.73 1.40 0.00 -2.79 0.00 0.00 177.10 174.98 3i4c n ALA 223 N 4.82 1.10 0.34 1.71 0.00 -0.06 -0.78 120.51 127.63 3i4c n ALA 223 Ca -0.06 0.10 0.12 0.00 0.00 0.00 0.00 53.44 53.60 3i4c n ALA 223 Cb 0.41 -1.19 0.14 0.00 0.00 0.00 0.00 19.45 18.81 3i4c n ALA 223 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 3i4c h SER 224 N 0.00 0.00 0.00 0.00 0.02 -1.79 -3.40 113.55 108.39 3i4c h SER 224 Ca 0.00 -0.06 -0.33 0.00 -0.84 0.00 0.00 61.79 60.55 3i4c h SER 224 Cb 0.04 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 62.53 3i4c h SER 224 CO 0.00 0.03 -2.11 0.23 -1.14 0.00 0.00 176.83 173.84 3i4c n MET 225 N -2.56 0.43 -4.17 3.45 2.81 0.04 -5.03 117.12 112.09 3i4c n MET 225 Ca 0.03 0.18 -0.26 0.00 -1.81 0.00 0.00 57.70 55.83 3i4c n MET 225 Cb 0.50 -1.22 -0.07 0.00 -0.71 0.00 0.00 33.22 31.72 3i4c n MET 225 CO 0.00 0.00 0.00 -0.65 1.51 0.00 0.00 175.97 176.83 3i4c s GLN 226 N -2.37 2.54 -0.21 0.03 1.11 -0.39 -5.05 119.66 115.32 3i4c s GLN 226 Ca -0.28 -1.06 -0.29 0.00 0.01 0.00 0.00 55.36 53.75 3i4c s GLN 226 Cb 0.10 -2.43 -0.03 0.00 -1.01 0.00 0.00 33.01 29.65 3i4c s GLN 226 CO 0.36 0.46 1.57 0.34 0.01 0.00 0.00 175.29 178.03 3i4c s ASP 227 N -3.04 6.46 0.19 5.90 2.15 -1.26 -4.29 116.67 122.78 3i4c s ASP 227 Ca 0.29 1.63 -0.12 0.00 0.43 0.00 0.00 52.55 54.78 3i4c s ASP 227 Cb -0.09 -2.53 0.17 0.00 -0.30 0.00 0.00 42.92 40.17 3i4c s ASP 227 CO 0.20 -1.19 1.79 1.55 -0.17 0.00 0.00 175.17 177.35 3i4c h PRO 228 N 10.38 0.54 -0.85 4.34 0.13 -1.89 -2.28 132.00 142.36 3i4c h PRO 228 Ca -0.33 -0.03 -0.03 0.00 -0.87 0.00 0.00 66.00 64.74 3i4c h PRO 228 Cb 1.15 -0.12 -0.04 0.00 0.13 0.00 0.00 31.00 32.12 3i4c h PRO 228 CO 1.00 0.35 0.43 -0.07 -0.23 0.00 0.00 178.00 179.48 3i4c h LEU 229 N 0.55 1.10 -0.59 1.56 3.38 -1.97 -0.74 115.31 118.60 3i4c h LEU 229 Ca 0.25 -0.12 -0.10 0.00 0.09 0.00 0.00 57.88 58.00 3i4c h LEU 229 Cb 0.16 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 3i4c h LEU 229 CO -0.17 0.91 -0.03 0.00 0.09 0.00 0.00 178.44 179.24 3i4c h ALA 230 N 1.26 0.80 -0.55 1.53 0.00 -1.90 -1.01 119.26 119.39 3i4c h ALA 230 Ca 0.30 -0.32 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 3i4c h ALA 230 Cb 0.09 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 3i4c h ALA 230 CO -0.04 0.67 0.05 0.93 0.00 0.00 0.00 179.25 180.85 3i4c h GLU 231 N 0.96 0.94 -0.66 0.00 4.39 -1.06 -1.04 114.58 118.12 3i4c h GLU 231 Ca 0.16 -0.28 -0.01 0.00 0.34 0.00 0.00 59.36 59.58 3i4c h GLU 231 Cb 0.60 -0.10 -0.03 0.00 -0.10 0.00 0.00 28.75 29.12 3i4c h GLU 231 CO 0.04 0.93 0.39 0.82 -1.16 0.00 0.00 179.01 180.02 3i4c h ILE 232 N 0.83 1.19 -0.84 3.13 2.04 -0.92 0.17 117.51 123.12 3i4c h ILE 232 Ca 0.16 -0.45 -0.02 0.00 1.00 0.00 0.00 64.86 65.56 3i4c h ILE 232 Cb 0.47 0.30 -0.04 0.00 -0.74 0.00 0.00 36.82 36.81 3i4c h ILE 232 CO 0.02 0.20 0.45 -0.09 0.00 0.00 0.00 178.15 178.73 3i4c h ARG 233 N 0.89 1.17 0.11 2.37 2.43 -0.88 -0.78 114.38 119.70 3i4c h ARG 233 Ca 0.23 -0.14 -0.01 0.00 -0.81 0.00 0.00 59.98 59.26 3i4c h ARG 233 Cb -0.01 -0.23 0.00 0.00 -0.42 0.00 0.00 29.97 29.32 3i4c h ARG 233 CO -0.04 0.86 -0.05 -0.09 -1.51 0.00 0.00 179.97 179.14 3i4c h ARG 234 N 1.17 -0.14 -0.91 0.20 2.43 -0.42 0.61 114.38 117.32 3i4c h ARG 234 Ca 0.29 0.01 0.05 0.00 -0.81 0.00 0.00 59.98 59.52 3i4c h ARG 234 Cb 0.04 0.03 -0.06 0.00 -0.42 0.00 0.00 29.97 29.57 3i4c h ARG 234 CO -0.05 0.13 0.58 0.82 -1.51 0.00 0.00 179.97 179.95 3i4c h ILE 235 N -0.41 1.10 -0.44 1.20 2.04 -0.79 -2.11 117.51 118.10 3i4c h ILE 235 Ca -0.01 -0.38 0.00 0.00 1.00 0.00 0.00 64.86 65.47 3i4c h ILE 235 Cb 0.34 -0.09 0.00 0.00 -0.74 0.00 0.00 36.82 36.33 3i4c h ILE 235 CO 0.02 0.20 0.00 0.35 0.00 0.00 0.00 178.15 178.72 3i4c n THR 236 N -4.54 0.59 -3.72 -0.27 -2.24 -0.31 -4.94 114.28 98.84 3i4c n THR 236 Ca 0.13 -0.62 -0.23 0.00 -2.27 0.00 0.00 64.05 61.06 3i4c n THR 236 Cb 0.14 0.37 0.04 0.00 -2.10 0.00 0.00 70.33 68.78 3i4c n THR 236 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3i4c n GLU 237 N 0.88 -5.23 -0.47 -0.78 1.02 -0.04 -2.24 120.64 113.78 3i4c n GLU 237 Ca 0.16 0.64 0.00 0.00 -0.02 0.00 0.00 57.16 57.94 3i4c n GLU 237 Cb 0.41 -5.30 0.00 0.00 -0.02 0.00 0.00 31.44 26.53 3i4c n GLU 237 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 3i4c n SER 238 N -3.02 0.00 0.08 1.62 7.64 0.20 -4.87 113.62 115.27 3i4c n SER 238 Ca -0.23 0.00 -0.12 0.00 1.01 0.00 0.00 58.87 59.53 3i4c n SER 238 Cb 0.65 -0.41 -0.06 0.00 -1.01 0.00 0.00 64.21 63.37 3i4c n SER 238 CO 0.00 0.00 0.00 0.50 -3.01 0.00 0.00 175.04 172.53 3i4c h LYS 239 N 2.02 0.28 0.00 1.43 3.64 -1.69 -3.50 116.57 118.75 3i4c h LYS 239 Ca 0.00 -0.36 0.00 0.00 -1.27 0.00 0.00 60.65 59.02 3i4c h LYS 239 Cb 0.00 0.11 0.00 0.00 -0.41 0.00 0.00 32.23 31.93 3i4c h LYS 239 CO 0.00 1.08 0.00 0.41 -2.27 0.00 0.00 179.45 178.67 3i4c n GLY 240 N 1.10 -0.24 3.89 5.01 0.00 -1.26 -3.95 105.19 109.74 3i4c n GLY 240 Ca -0.06 -1.88 -0.32 0.00 0.00 0.00 0.00 46.02 43.76 3i4c n GLY 240 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3i4c s VAL 241 N -1.06 5.16 -0.75 1.61 -7.23 0.37 -4.49 120.40 114.00 3i4c s VAL 241 Ca 0.00 0.12 0.26 0.00 -1.81 0.00 0.00 61.98 60.56 3i4c s VAL 241 Cb 0.00 -3.62 0.28 0.00 0.56 0.00 0.00 36.38 33.60 3i4c s VAL 241 CO 0.00 0.10 1.79 0.47 -0.31 0.00 0.00 175.10 177.14 3i4c n ASP 242 N 0.28 0.70 -3.51 4.85 8.00 -0.20 0.03 116.55 126.70 3i4c n ASP 242 Ca -0.04 0.57 -0.16 0.00 0.71 0.00 0.00 54.79 55.88 3i4c n ASP 242 Cb 0.52 -0.76 -0.05 0.00 -0.02 0.00 0.00 41.12 40.81 3i4c n ASP 242 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3i4c s ALA 243 N -3.10 -1.76 -0.04 2.24 0.00 -1.17 -1.40 121.76 116.53 3i4c s ALA 243 Ca 0.11 1.19 0.02 0.00 0.00 0.00 0.00 51.96 53.28 3i4c s ALA 243 Cb 0.13 0.10 0.01 0.00 0.00 0.00 0.00 23.12 23.36 3i4c s ALA 243 CO 0.57 -0.44 -0.08 0.08 0.00 0.00 0.00 175.76 175.89 3i4c s VAL 244 N -1.69 0.75 -0.22 0.00 1.01 -0.03 -1.31 120.40 118.90 3i4c s VAL 244 Ca -0.07 -0.30 -0.02 0.00 0.00 0.00 0.00 61.98 61.58 3i4c s VAL 244 Cb -0.00 -0.69 0.01 0.00 0.00 0.00 0.00 36.38 35.70 3i4c s VAL 244 CO 0.05 0.25 -0.09 -0.63 0.00 0.00 0.00 175.10 174.68 3i4c s ILE 245 N 0.45 2.82 -0.48 2.22 1.01 -0.23 0.21 121.20 127.20 3i4c s ILE 245 Ca -0.07 -0.85 -0.00 0.00 0.00 0.00 0.00 60.65 59.72 3i4c s ILE 245 Cb -0.11 -2.33 0.13 0.00 0.01 0.00 0.00 42.46 40.15 3i4c s ILE 245 CO 0.01 0.34 0.26 -0.62 0.00 0.00 0.00 174.94 174.93 3i4c s ASP 246 N 1.36 5.00 -0.11 3.58 -1.08 0.25 -1.49 116.67 124.18 3i4c s ASP 246 Ca 0.03 -2.47 -0.21 0.00 -0.52 0.00 0.00 52.55 49.38 3i4c s ASP 246 Cb -0.15 -1.77 -0.04 0.00 -1.46 0.00 0.00 42.92 39.50 3i4c s ASP 246 CO -0.06 -0.41 0.60 -0.76 0.52 0.00 0.00 175.17 175.06 3i4c s LEU 247 N 0.49 4.27 -0.99 -1.34 1.43 -1.26 -1.19 118.68 120.10 3i4c s LEU 247 Ca 0.13 0.98 -0.03 0.00 -1.03 0.00 0.00 54.13 54.18 3i4c s LEU 247 Cb -0.22 -2.90 -0.04 0.00 0.03 0.00 0.00 46.19 43.07 3i4c s LEU 247 CO -0.04 -0.09 0.85 -3.20 0.23 0.00 0.00 176.35 174.10 3i4c n ASN 248 N 3.92 -4.59 -4.64 2.29 2.85 0.99 -4.92 115.26 111.17 3i4c n ASN 248 Ca -0.04 -0.60 -0.32 0.00 -0.11 0.00 0.00 54.58 53.51 3i4c n ASN 248 Cb 0.51 -4.67 0.15 0.00 1.24 0.00 0.00 39.78 37.01 3i4c n ASN 248 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3i4c n TYR 249 N -3.32 0.63 -4.36 1.20 0.18 -1.17 -5.05 117.16 105.26 3i4c n TYR 249 Ca -0.14 0.38 -0.20 0.00 1.88 0.00 0.00 57.90 59.83 3i4c n TYR 249 Cb 0.62 -1.99 -0.09 0.00 -0.38 0.00 0.00 39.34 37.50 3i4c n TYR 249 CO 0.00 0.00 0.00 -1.54 -2.08 0.00 0.00 176.86 173.24 3i4c s SER 250 N -2.44 1.75 0.29 9.48 1.04 -1.26 -4.65 113.70 117.90 3i4c s SER 250 Ca 0.67 -1.58 -0.01 0.00 0.48 0.00 0.00 55.95 55.51 3i4c s SER 250 Cb -0.24 0.40 0.42 0.00 0.10 0.00 0.00 66.02 66.69 3i4c s SER 250 CO 0.58 -0.89 1.85 -0.08 0.98 0.00 0.00 173.24 175.67 3i4c h GLU 251 N 2.14 0.85 0.04 4.02 4.81 -1.94 -2.47 114.58 122.03 3i4c h GLU 251 Ca -0.33 -0.15 -0.00 0.00 -0.13 0.00 0.00 59.36 58.74 3i4c h GLU 251 Cb 1.25 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 30.50 3i4c h GLU 251 CO 0.52 0.73 -0.02 -0.22 -0.73 0.00 0.00 179.01 179.30 3i4c h LYS 252 N 0.82 -0.05 -0.87 1.92 1.63 -1.99 -2.93 116.57 115.10 3i4c h LYS 252 Ca 0.19 0.00 0.03 0.00 -0.85 0.00 0.00 60.65 60.02 3i4c h LYS 252 Cb 0.24 0.01 -0.05 0.00 -0.60 0.00 0.00 32.23 31.83 3i4c h LYS 252 CO -0.01 0.34 0.56 1.79 -3.45 0.00 0.00 179.45 178.68 3i4c h THR 253 N -0.45 1.16 0.00 1.00 1.35 -1.93 -1.46 112.91 112.58 3i4c h THR 253 Ca -0.01 -0.38 -0.03 0.00 -0.55 0.00 0.00 66.41 65.45 3i4c h THR 253 Cb 0.41 -0.05 -0.00 0.00 -1.73 0.00 0.00 68.15 66.78 3i4c h THR 253 CO 0.01 0.20 -0.14 -0.07 -0.25 0.00 0.00 175.52 175.28 3i4c h LEU 254 N 1.11 0.00 0.00 3.87 3.38 -1.49 -1.45 115.31 120.73 3i4c h LEU 254 Ca 0.34 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.30 3i4c h LEU 254 Cb -0.03 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 3i4c h LEU 254 CO -0.11 0.14 -0.82 0.77 0.09 0.00 0.00 178.44 178.51 3i4c h SER 255 N 0.00 0.00 0.00 -0.43 4.64 -1.11 -3.40 113.55 113.25 3i4c h SER 255 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3i4c h SER 255 Cb 0.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 3i4c h SER 255 CO 0.02 0.03 -0.88 0.52 -0.87 0.00 0.00 176.83 175.65 3i4c n VAL 256 N -2.78 1.34 0.28 0.95 0.31 -0.71 -4.75 118.33 112.98 3i4c n VAL 256 Ca 0.00 0.18 0.14 0.00 -0.01 0.00 0.00 64.34 64.66 3i4c n VAL 256 Cb 0.56 -2.24 0.84 0.00 -0.91 0.00 0.00 33.84 32.08 3i4c n VAL 256 CO 0.00 0.00 0.00 1.88 -1.32 0.00 0.00 176.83 177.39 3i4c h TYR 257 N -0.88 0.00 0.00 3.52 0.05 -1.54 -2.09 116.97 116.04 3i4c h TYR 257 Ca 0.00 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.78 3i4c h TYR 257 Cb 0.88 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.62 3i4c h TYR 257 CO -0.38 0.05 -0.01 -1.35 -1.05 0.00 0.00 178.16 175.43 3i4c h PRO 258 N 0.00 0.00 0.00 4.88 0.11 -1.78 0.94 132.00 136.16 3i4c h PRO 258 Ca -0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 3i4c h PRO 258 Cb 0.14 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.25 3i4c h PRO 258 CO 0.01 0.01 0.00 1.63 -0.21 0.00 0.00 178.00 179.43 3i4c n LYS 259 N -3.19 0.17 0.00 1.05 5.02 -0.78 -2.15 118.16 118.28 3i4c n LYS 259 Ca -0.02 0.40 0.13 0.00 -2.02 0.00 0.00 58.31 56.80 3i4c n LYS 259 Cb 0.12 -1.82 0.44 0.00 -0.02 0.00 0.00 35.03 33.75 3i4c n LYS 259 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3i4c n ALA 260 N -1.74 2.99 -1.83 7.82 0.00 0.33 -4.93 120.51 123.15 3i4c n ALA 260 Ca 0.02 -0.37 -0.41 0.00 0.00 0.00 0.00 53.44 52.69 3i4c n ALA 260 Cb 0.22 -1.19 -0.03 0.00 0.00 0.00 0.00 19.45 18.45 3i4c n ALA 260 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3i4c s LEU 261 N -2.50 4.46 0.78 0.00 1.43 -0.91 -0.48 118.68 121.46 3i4c s LEU 261 Ca 0.25 2.49 -0.08 0.00 -1.03 0.00 0.00 54.13 55.77 3i4c s LEU 261 Cb 0.19 -3.63 0.11 0.00 0.03 0.00 0.00 46.19 42.89 3i4c s LEU 261 CO 0.51 -0.42 1.10 0.00 0.23 0.00 0.00 176.35 177.77 3i4c s ALA 262 N -0.81 2.99 0.41 4.21 0.00 0.10 -4.66 121.76 124.00 3i4c s ALA 262 Ca 0.50 -1.14 -0.27 0.00 0.00 0.00 0.00 51.96 51.05 3i4c s ALA 262 Cb -0.37 -2.55 -0.10 0.00 0.00 0.00 0.00 23.12 20.11 3i4c s ALA 262 CO 0.46 -1.65 1.43 0.15 0.00 0.00 0.00 175.76 176.14 3i4c s LYS 263 N -5.41 3.94 0.00 0.00 1.02 -1.26 -0.87 119.74 117.15 3i4c s LYS 263 Ca 0.65 2.43 0.00 0.00 0.02 0.00 0.00 55.97 59.07 3i4c s LYS 263 Cb -0.08 -2.82 0.00 0.00 -0.52 0.00 0.00 37.83 34.41 3i4c s LYS 263 CO 0.47 -0.62 0.00 1.04 -0.92 0.00 0.00 175.35 175.32 3i4c n GLN 264 N 0.18 -0.76 -1.95 1.68 6.02 0.26 -4.96 117.38 117.85 3i4c n GLN 264 Ca 0.03 0.19 -0.37 0.00 -0.01 0.00 0.00 57.00 56.84 3i4c n GLN 264 Cb 0.41 -3.94 0.04 0.00 1.02 0.00 0.00 30.24 27.77 3i4c n GLN 264 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 3i4c s GLY 265 N -2.00 2.79 -0.14 1.08 0.00 -0.05 -4.75 107.32 104.25 3i4c s GLY 265 Ca 0.00 1.10 0.00 0.00 0.00 0.00 0.00 44.72 45.82 3i4c s GLY 265 CO 0.00 1.53 -0.15 0.54 0.00 0.00 0.00 173.10 175.01 3i4c s LYS 266 N -3.21 3.26 -0.46 2.90 1.02 -0.50 -1.53 119.74 121.22 3i4c s LYS 266 Ca 0.76 -0.74 -0.13 0.00 0.02 0.00 0.00 55.97 55.88 3i4c s LYS 266 Cb -0.33 -2.60 0.09 0.00 -0.52 0.00 0.00 37.83 34.46 3i4c s LYS 266 CO 0.37 0.09 0.36 -0.47 -0.92 0.00 0.00 175.35 174.78 3i4c s TYR 267 N 0.64 3.29 -0.46 3.18 6.14 0.90 -0.85 117.35 130.18 3i4c s TYR 267 Ca -0.08 -1.24 -0.21 0.00 0.64 0.00 0.00 57.07 56.18 3i4c s TYR 267 Cb -0.16 -3.22 0.03 0.00 0.42 0.00 0.00 41.96 39.04 3i4c s TYR 267 CO 0.03 -0.86 0.66 0.08 0.64 0.00 0.00 175.55 176.10 3i4c s VAL 268 N 1.54 4.80 -0.16 3.14 1.01 0.13 -1.02 120.40 129.84 3i4c s VAL 268 Ca 0.04 0.00 -0.11 0.00 0.00 0.00 0.00 61.98 61.91 3i4c s VAL 268 Cb -0.25 -4.25 -0.05 0.00 0.00 0.00 0.00 36.38 31.83 3i4c s VAL 268 CO 0.04 -0.68 0.19 -0.04 0.00 0.00 0.00 175.10 174.61 3i4c s MET 269 N 2.87 4.05 -0.04 2.72 1.00 -0.06 -0.59 119.30 129.25 3i4c s MET 269 Ca 0.22 -0.08 0.02 0.00 0.00 0.00 0.00 55.69 55.85 3i4c s MET 269 Cb -0.15 -3.37 0.01 0.00 0.00 0.00 0.00 34.83 31.32 3i4c s MET 269 CO 0.18 0.40 -0.10 0.08 0.00 0.00 0.00 175.02 175.58 3i4c s VAL 270 N 0.04 0.87 -4.59 -6.03 1.01 -0.33 -1.86 120.40 109.52 3i4c s VAL 270 Ca 0.13 -0.38 0.00 0.00 0.00 0.00 0.00 61.98 61.73 3i4c s VAL 270 Cb -0.12 -0.79 0.00 0.00 0.00 0.00 0.00 36.38 35.47 3i4c s VAL 270 CO 0.02 0.28 0.00 0.61 0.00 0.00 0.00 175.10 176.01 3i4c n GLY 271 N 3.50 1.00 0.23 4.51 0.00 -1.25 -0.00 105.19 113.18 3i4c n GLY 271 Ca -0.20 -1.97 0.01 0.00 0.00 0.00 0.00 46.02 43.85 3i4c n GLY 271 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3i4c n LEU 272 N 0.00 0.50 -4.77 0.99 4.77 -1.26 -5.00 117.00 112.22 3i4c n LEU 272 Ca 0.00 -1.03 -0.40 0.00 -0.03 0.00 0.00 56.01 54.55 3i4c n LEU 272 Cb 0.00 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.04 3i4c n LEU 272 CO 0.00 0.25 1.07 0.12 -1.33 0.00 0.00 177.39 177.50 3i4c s PHE 273 N -0.47 2.66 -1.10 -1.77 5.36 -1.26 -4.86 117.98 116.54 3i4c s PHE 273 Ca 0.04 1.27 -0.23 0.00 -0.96 0.00 0.00 56.93 57.06 3i4c s PHE 273 Cb 0.04 -3.89 -0.04 0.00 -0.34 0.00 0.00 43.02 38.79 3i4c s PHE 273 CO 0.00 -2.66 1.86 0.20 -1.46 0.00 0.00 175.22 173.16 3i4c s GLY 274 N -0.39 0.50 0.06 13.12 0.00 -1.26 -4.87 107.32 114.49 3i4c s GLY 274 Ca 0.55 -2.09 -0.07 0.00 0.00 0.00 0.00 44.72 43.11 3i4c s GLY 274 CO 0.57 3.32 0.14 0.00 0.00 0.00 0.00 173.10 177.14 3i4c s ALA 275 N 9.11 -0.11 0.06 3.20 0.00 -1.26 -4.98 121.76 127.79 3i4c s ALA 275 Ca 0.64 -0.64 0.05 0.00 0.00 0.00 0.00 51.96 52.02 3i4c s ALA 275 Cb -0.02 0.37 -0.04 0.00 0.00 0.00 0.00 23.12 23.44 3i4c s ALA 275 CO 0.06 -0.43 -0.06 -0.51 0.00 0.00 0.00 175.76 174.82 3i4c s ASP 276 N -2.60 4.63 -0.09 0.00 1.01 -1.26 -5.08 116.67 113.29 3i4c s ASP 276 Ca 0.02 -0.24 -0.23 0.00 0.71 0.00 0.00 52.55 52.81 3i4c s ASP 276 Cb 0.03 -1.02 -0.03 0.00 1.01 0.00 0.00 42.92 42.91 3i4c s ASP 276 CO -0.08 0.22 0.70 -0.22 0.21 0.00 0.00 175.17 175.99 3i4c s LEU 277 N -1.91 4.29 -0.17 1.23 2.96 -1.26 -4.99 118.68 118.82 3i4c s LEU 277 Ca 0.21 1.14 -0.01 0.00 -0.22 0.00 0.00 54.13 55.25 3i4c s LEU 277 Cb -0.11 -3.06 0.05 0.00 0.50 0.00 0.00 46.19 43.56 3i4c s LEU 277 CO 0.12 -0.15 -0.04 -1.00 -1.32 0.00 0.00 176.35 173.96 3i4c s HIS 278 N 1.00 1.71 -0.14 5.38 3.76 -1.26 -5.12 115.29 120.63 3i4c s HIS 278 Ca 0.36 -1.13 -0.12 0.00 -0.15 0.00 0.00 55.06 54.02 3i4c s HIS 278 Cb -0.17 -1.32 0.04 0.00 1.11 0.00 0.00 32.58 32.24 3i4c s HIS 278 CO 0.17 -0.63 0.36 -0.47 -0.85 0.00 0.00 174.74 173.31 3i4c s TYR 279 N 1.63 -0.40 -0.09 1.40 5.04 -1.26 -4.93 117.35 118.74 3i4c s TYR 279 Ca -0.00 0.97 -0.29 0.00 -2.44 0.00 0.00 57.07 55.30 3i4c s TYR 279 Cb -0.16 0.14 -0.06 0.00 0.35 0.00 0.00 41.96 42.23 3i4c s TYR 279 CO -0.07 -0.19 1.80 -1.58 -1.34 0.00 0.00 175.55 174.16 3i4c s HIS 280 N 0.25 1.71 0.22 4.97 5.65 -1.26 -4.91 115.29 121.92 3i4c s HIS 280 Ca -0.00 0.14 -0.09 0.00 0.25 0.00 0.00 55.06 55.36 3i4c s HIS 280 Cb -0.03 -4.02 0.33 0.00 -1.18 0.00 0.00 32.58 27.68 3i4c s HIS 280 CO -0.00 -4.13 1.68 0.00 -0.65 0.00 0.00 174.74 171.64 3i4c h ALA 281 N 10.82 0.70 -0.23 1.58 0.00 -2.00 -0.99 119.26 129.14 3i4c h ALA 281 Ca -0.41 0.17 0.07 0.00 0.00 0.00 0.00 54.91 54.74 3i4c h ALA 281 Cb 1.20 0.27 -0.01 0.00 0.00 0.00 0.00 17.79 19.25 3i4c h ALA 281 CO 0.96 -0.36 0.18 -1.35 0.00 0.00 0.00 179.25 178.68 3i4c h PRO 282 N 0.18 0.00 -0.33 0.00 0.11 -2.00 0.28 132.00 130.24 3i4c h PRO 282 Ca 0.34 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 66.32 3i4c h PRO 282 Cb 0.55 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.65 3i4c h PRO 282 CO -0.50 0.00 -0.33 -0.07 -0.21 0.00 0.00 178.00 176.90 3i4c h LEU 283 N 0.00 0.76 -0.19 2.35 3.38 -1.57 -1.42 115.31 118.62 3i4c h LEU 283 Ca 0.11 -0.31 -0.04 0.00 0.09 0.00 0.00 57.88 57.73 3i4c h LEU 283 Cb 0.47 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 3i4c h LEU 283 CO -0.00 1.02 -0.03 0.40 0.09 0.00 0.00 178.44 179.92 3i4c h ILE 284 N 0.61 1.28 -0.26 1.22 2.04 -0.89 -2.84 117.51 118.66 3i4c h ILE 284 Ca 0.07 -0.97 -0.19 0.00 1.00 0.00 0.00 64.86 64.77 3i4c h ILE 284 Cb 0.85 1.53 0.00 0.00 -0.74 0.00 0.00 36.82 38.46 3i4c h ILE 284 CO 0.07 0.29 -0.57 0.71 0.00 0.00 0.00 178.15 178.65 3i4c h THR 285 N 0.08 1.28 -0.38 -0.27 1.35 -1.38 -0.68 112.91 112.91 3i4c h THR 285 Ca 0.05 -1.76 -0.05 0.00 -0.55 0.00 0.00 66.41 64.10 3i4c h THR 285 Cb 0.45 1.68 -0.02 0.00 -1.73 0.00 0.00 68.15 68.53 3i4c h THR 285 CO 0.02 0.57 0.04 -0.07 -0.25 0.00 0.00 175.52 175.83 3i4c h LEU 286 N 0.63 0.54 -1.99 3.87 3.38 -1.31 -3.09 115.31 117.34 3i4c h LEU 286 Ca 0.01 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.88 3i4c h LEU 286 Cb 1.18 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.78 3i4c h LEU 286 CO 0.12 0.59 0.00 -1.20 0.09 0.00 0.00 178.44 178.04 3i4c n SER 287 N -4.29 2.76 -3.32 -0.43 7.64 -1.07 -4.98 113.62 109.93 3i4c n SER 287 Ca 0.02 -1.82 -0.24 0.00 1.01 0.00 0.00 58.87 57.85 3i4c n SER 287 Cb 0.23 -0.10 0.01 0.00 -1.01 0.00 0.00 64.21 63.34 3i4c n SER 287 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3i4c n GLU 288 N 1.05 -4.06 -1.83 1.43 1.02 -0.31 0.91 120.64 118.85 3i4c n GLU 288 Ca 0.13 0.61 -0.30 0.00 -0.02 0.00 0.00 57.16 57.57 3i4c n GLU 288 Cb 0.47 -5.38 0.04 0.00 -0.02 0.00 0.00 31.44 26.55 3i4c n GLU 288 CO 0.00 0.00 0.00 0.96 1.18 0.00 0.00 177.13 179.27 3i4c s ILE 289 N -3.04 3.78 0.00 -3.67 -4.36 -0.92 -3.69 121.20 109.30 3i4c s ILE 289 Ca 0.40 0.58 0.02 0.00 -0.26 0.00 0.00 60.65 61.39 3i4c s ILE 289 Cb -0.20 -3.53 -0.01 0.00 1.25 0.00 0.00 42.46 39.97 3i4c s ILE 289 CO 0.49 -0.75 -0.07 -1.10 0.24 0.00 0.00 174.94 173.75 3i4c s GLN 290 N -5.28 0.56 -0.20 0.37 -0.21 -0.58 -4.89 119.66 109.43 3i4c s GLN 290 Ca 0.58 -0.31 -0.03 0.00 0.02 0.00 0.00 55.36 55.62 3i4c s GLN 290 Cb -0.11 -0.52 -0.01 0.00 1.00 0.00 0.00 33.01 33.37 3i4c s GLN 290 CO 0.53 0.14 -0.08 -0.06 -2.12 0.00 0.00 175.29 173.70 3i4c s PHE 291 N -0.30 2.92 -0.02 0.91 0.08 -1.26 -0.07 117.98 120.23 3i4c s PHE 291 Ca 0.01 -0.99 0.03 0.00 0.12 0.00 0.00 56.93 56.10 3i4c s PHE 291 Cb -0.04 -2.04 0.00 0.00 -0.57 0.00 0.00 43.02 40.37 3i4c s PHE 291 CO -0.00 -0.53 -0.10 0.14 -0.10 0.00 0.00 175.22 174.63 3i4c s VAL 292 N 1.29 0.81 0.20 -0.44 -7.23 -0.19 -4.96 120.40 109.89 3i4c s VAL 292 Ca 0.03 -0.39 0.05 0.00 -1.81 0.00 0.00 61.98 59.87 3i4c s VAL 292 Cb -0.14 -0.72 -0.03 0.00 0.56 0.00 0.00 36.38 36.04 3i4c s VAL 292 CO -0.04 0.25 0.24 -0.83 -0.31 0.00 0.00 175.10 174.42 3i4c s GLY 293 N 0.13 1.52 0.08 2.32 0.00 -1.26 -0.88 107.32 109.23 3i4c s GLY 293 Ca -0.02 -1.22 -0.23 0.00 0.00 0.00 0.00 44.72 43.25 3i4c s GLY 293 CO 0.00 -1.24 0.56 -0.45 0.00 0.00 0.00 173.10 171.97 3i4c s SER 294 N -3.52 -0.49 0.00 1.64 0.15 -0.77 -4.92 113.70 105.79 3i4c s SER 294 Ca 0.33 0.15 0.00 0.00 0.70 0.00 0.00 55.95 57.13 3i4c s SER 294 Cb -0.10 0.53 0.00 0.00 -1.71 0.00 0.00 66.02 64.75 3i4c s SER 294 CO 0.26 -0.79 0.00 -0.11 1.20 0.00 0.00 173.24 173.80 3i4c n LEU 295 N 0.17 0.00 0.00 3.45 7.94 -1.26 -3.96 117.00 123.34 3i4c n LEU 295 Ca -0.18 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.72 3i4c n LEU 295 Cb 0.62 0.07 0.00 0.00 0.53 0.00 0.00 43.42 44.64 3i4c n LEU 295 CO 0.17 -0.20 0.00 1.33 -1.11 0.00 0.00 177.39 177.59 3i4c n VAL 296 N -1.89 0.00 -3.60 1.96 0.24 -1.26 -4.67 118.33 109.11 3i4c n VAL 296 Ca 0.00 0.00 0.02 0.00 -2.04 0.00 0.00 64.34 62.32 3i4c n VAL 296 Cb 0.00 0.00 -0.01 0.00 -1.47 0.00 0.00 33.84 32.36 3i4c n VAL 296 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 3i4c s GLY 297 N 0.00 -0.42 0.04 7.63 0.00 -1.26 -4.24 107.32 109.06 3i4c s GLY 297 Ca 0.00 0.96 0.01 0.00 0.00 0.00 0.00 44.72 45.68 3i4c s GLY 297 CO 0.00 0.21 0.05 1.16 0.00 0.00 0.00 173.10 174.52 3i4c n ASN 298 N -0.42 0.56 -0.26 1.64 0.23 -1.26 -4.59 115.26 111.16 3i4c n ASN 298 Ca -0.07 -1.12 0.06 0.00 -0.53 0.00 0.00 54.58 52.92 3i4c n ASN 298 Cb 0.62 -0.02 0.30 0.00 -2.08 0.00 0.00 39.78 38.61 3i4c n ASN 298 CO 0.00 0.00 0.00 1.56 -0.93 0.00 0.00 177.26 177.89 3i4c h GLN 299 N 0.00 0.85 -0.60 -3.83 1.08 -1.92 -0.84 115.11 109.85 3i4c h GLN 299 Ca -0.02 -0.05 -0.10 0.00 -1.45 0.00 0.00 58.65 57.03 3i4c h GLN 299 Cb 0.09 -0.19 -0.02 0.00 -0.05 0.00 0.00 27.48 27.31 3i4c h GLN 299 CO 0.03 0.56 -0.01 1.03 -0.95 0.00 0.00 178.83 179.49 3i4c h SER 300 N 0.88 1.04 -0.57 1.46 0.87 -1.95 0.36 113.55 115.64 3i4c h SER 300 Ca 0.38 -0.31 -0.08 0.00 -1.23 0.00 0.00 61.79 60.55 3i4c h SER 300 Cb 0.32 -0.28 -0.02 0.00 -0.44 0.00 0.00 62.40 61.98 3i4c h SER 300 CO -0.15 1.10 0.04 0.44 -0.53 0.00 0.00 176.83 177.74 3i4c h ASP 301 N 0.96 0.95 -0.24 6.23 3.32 -1.65 -1.33 116.42 124.65 3i4c h ASP 301 Ca 0.17 -0.29 -0.02 0.00 0.02 0.00 0.00 57.03 56.91 3i4c h ASP 301 Cb 0.57 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.86 3i4c h ASP 301 CO 0.03 1.00 0.06 0.15 -1.72 0.00 0.00 179.24 178.76 3i4c h PHE 302 N 0.86 0.40 -0.54 4.55 3.57 -1.00 -1.90 116.94 122.90 3i4c h PHE 302 Ca 0.17 -0.05 0.06 0.00 3.53 0.00 0.00 57.97 61.68 3i4c h PHE 302 Cb 0.49 -0.11 -0.05 0.00 2.79 0.00 0.00 35.95 39.06 3i4c h PHE 302 CO 0.04 0.48 0.25 1.25 -2.23 0.00 0.00 178.31 178.09 3i4c h LEU 303 N 0.21 0.33 -0.10 0.59 5.85 -0.80 -1.73 115.31 119.66 3i4c h LEU 303 Ca 0.08 0.04 -0.00 0.00 0.84 0.00 0.00 57.88 58.84 3i4c h LEU 303 Cb 0.27 -0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.29 3i4c h LEU 303 CO 0.00 0.22 0.05 1.23 -0.34 0.00 0.00 178.44 179.60 3i4c h GLY 304 N 0.47 0.15 1.47 3.75 0.00 -1.01 -1.84 103.07 106.06 3i4c h GLY 304 Ca 0.25 -0.08 -0.13 0.00 0.00 0.00 0.00 47.33 47.38 3i4c h GLY 304 CO -0.20 0.07 -0.35 1.19 0.00 0.00 0.00 176.54 177.25 3i4c h ILE 305 N 0.03 1.29 -0.45 2.60 6.09 -1.24 -2.07 117.51 123.75 3i4c h ILE 305 Ca 0.03 -1.49 -0.13 0.00 -1.37 0.00 0.00 64.86 61.91 3i4c h ILE 305 Cb 0.13 1.46 -0.01 0.00 0.47 0.00 0.00 36.82 38.87 3i4c h ILE 305 CO -0.00 0.47 -0.23 0.24 -3.07 0.00 0.00 178.15 175.56 3i4c h MET 306 N 0.50 0.93 -0.61 2.19 2.86 -1.29 -0.53 114.93 118.98 3i4c h MET 306 Ca 0.05 -0.40 -0.05 0.00 -2.06 0.00 0.00 59.70 57.24 3i4c h MET 306 Cb 0.84 -0.03 -0.03 0.00 0.06 0.00 0.00 31.60 32.45 3i4c h MET 306 CO 0.07 1.05 0.17 0.00 1.06 0.00 0.00 176.91 179.27 3i4c h ARG 307 N 0.80 0.97 -0.22 1.72 3.08 -1.20 0.17 114.38 119.70 3i4c h ARG 307 Ca 0.10 -0.22 -0.02 0.00 0.07 0.00 0.00 59.98 59.91 3i4c h ARG 307 Cb 0.79 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.70 3i4c h ARG 307 CO 0.07 0.87 0.05 -0.07 -1.07 0.00 0.00 179.97 179.82 3i4c h LEU 308 N 0.89 0.33 -0.40 3.04 3.38 -1.23 -2.13 115.31 119.19 3i4c h LEU 308 Ca 0.20 -0.24 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 3i4c h LEU 308 Cb 0.32 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 3i4c h LEU 308 CO -0.00 0.49 0.09 0.00 0.09 0.00 0.00 178.44 179.10 3i4c h ALA 309 N 0.86 0.52 0.00 1.53 0.00 -0.91 -0.58 119.26 120.68 3i4c h ALA 309 Ca 0.07 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 3i4c h ALA 309 Cb 0.29 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 3i4c h ALA 309 CO 0.00 0.21 -0.12 0.93 0.00 0.00 0.00 179.25 180.27 3i4c h GLU 310 N 0.50 0.00 -0.01 0.00 4.39 -0.64 -0.31 114.58 118.51 3i4c h GLU 310 Ca 0.12 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.82 3i4c h GLU 310 Cb 0.32 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.97 3i4c h GLU 310 CO 0.00 0.12 -0.10 0.00 -1.16 0.00 0.00 179.01 177.88 3i4c n ALA 311 N -2.39 2.77 -0.98 3.43 0.00 -0.81 -4.70 120.51 117.84 3i4c n ALA 311 Ca -0.02 -0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.06 3i4c n ALA 311 Cb 0.21 -1.25 0.00 0.00 0.00 0.00 0.00 19.45 18.41 3i4c n ALA 311 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3i4c n GLY 312 N 1.23 0.74 0.16 0.00 0.00 -0.13 -4.88 105.19 102.32 3i4c n GLY 312 Ca 0.16 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.32 3i4c n GLY 312 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3i4c h LYS 313 N 2.05 0.00 -3.59 1.61 1.57 -1.34 -3.41 116.57 113.47 3i4c h LYS 313 Ca 0.00 0.00 -0.39 0.00 -1.87 0.00 0.00 60.65 58.39 3i4c h LYS 313 Cb 0.03 0.00 -0.37 0.00 0.08 0.00 0.00 32.23 31.97 3i4c h LYS 313 CO 0.00 0.00 -0.75 0.08 -0.57 0.00 0.00 179.45 178.21 3i4c s VAL 314 N -3.36 0.17 0.45 0.50 1.01 -1.19 -4.81 120.40 113.16 3i4c s VAL 314 Ca 0.04 0.21 -0.15 0.00 0.00 0.00 0.00 61.98 62.08 3i4c s VAL 314 Cb 0.09 -0.34 -0.08 0.00 0.00 0.00 0.00 36.38 36.06 3i4c s VAL 314 CO 0.45 0.20 0.88 -0.54 0.00 0.00 0.00 175.10 176.10 3i4c s LYS 315 N 1.75 3.91 0.73 2.72 -0.14 -1.26 -4.36 119.74 123.09 3i4c s LYS 315 Ca 0.01 0.77 -0.14 0.00 -1.36 0.00 0.00 55.97 55.24 3i4c s LYS 315 Cb -0.13 -2.26 0.04 0.00 -1.68 0.00 0.00 37.83 33.80 3i4c s LYS 315 CO -0.03 -0.13 1.15 -2.14 -0.76 0.00 0.00 175.35 173.44 3i4c s PRO 316 N -3.82 2.30 0.59 -1.68 0.02 -1.26 -4.99 135.00 126.15 3i4c s PRO 316 Ca 0.56 1.53 -0.17 0.00 0.02 0.00 0.00 61.00 62.94 3i4c s PRO 316 Cb -0.10 -1.88 -0.03 0.00 0.02 0.00 0.00 34.50 32.51 3i4c s PRO 316 CO 0.29 -1.67 1.09 -1.64 -0.33 0.00 0.00 177.00 174.74 3i4c s MET 317 N -4.17 3.19 0.06 5.54 -1.94 -1.26 -4.94 119.30 115.78 3i4c s MET 317 Ca 0.69 1.37 -0.30 0.00 -1.71 0.00 0.00 55.69 55.74 3i4c s MET 317 Cb -0.24 -2.00 -0.08 0.00 2.01 0.00 0.00 34.83 34.52 3i4c s MET 317 CO 0.46 -0.93 1.73 0.42 -0.01 0.00 0.00 175.02 176.69 3i4c s ILE 318 N -2.22 3.03 0.17 2.53 1.01 -1.26 -4.94 121.20 119.53 3i4c s ILE 318 Ca 0.67 0.38 0.10 0.00 0.00 0.00 0.00 60.65 61.80 3i4c s ILE 318 Cb -0.19 -3.24 -0.04 0.00 0.01 0.00 0.00 42.46 38.99 3i4c s ILE 318 CO 0.35 -0.01 -0.22 -0.89 0.00 0.00 0.00 174.94 174.16 3i4c s THR 319 N 3.13 2.14 -0.20 2.92 2.01 -1.26 -1.79 115.64 122.58 3i4c s THR 319 Ca 0.77 -1.94 -0.00 0.00 0.31 0.00 0.00 61.69 60.83 3i4c s THR 319 Cb -0.40 -1.99 0.05 0.00 0.01 0.00 0.00 72.50 70.17 3i4c s THR 319 CO 0.34 -0.15 -0.04 -0.75 -0.69 0.00 0.00 174.62 173.34 3i4c s LYS 320 N -2.58 1.37 0.21 4.92 2.47 0.42 -4.91 119.74 121.64 3i4c s LYS 320 Ca 0.18 -0.72 -0.28 0.00 -1.56 0.00 0.00 55.97 53.59 3i4c s LYS 320 Cb -0.08 -2.31 -0.09 0.00 -1.46 0.00 0.00 37.83 33.90 3i4c s LYS 320 CO 0.08 -0.55 0.87 0.95 0.16 0.00 0.00 175.35 176.86 3i4c s THR 321 N 1.57 4.21 0.23 3.43 -4.23 -1.26 -0.93 115.64 118.65 3i4c s THR 321 Ca -0.03 1.91 -0.00 0.00 -1.18 0.00 0.00 61.69 62.39 3i4c s THR 321 Cb -0.17 -4.23 -0.04 0.00 1.34 0.00 0.00 72.50 69.40 3i4c s THR 321 CO -0.07 0.49 0.19 -0.04 -0.54 0.00 0.00 174.62 174.64 3i4c s MET 322 N -1.22 1.34 0.31 3.99 -1.94 0.33 -4.91 119.30 117.21 3i4c s MET 322 Ca 0.39 -1.69 -0.02 0.00 -1.71 0.00 0.00 55.69 52.67 3i4c s MET 322 Cb -0.24 0.30 -0.04 0.00 2.01 0.00 0.00 34.83 36.85 3i4c s MET 322 CO 0.29 -0.46 0.53 0.15 -0.01 0.00 0.00 175.02 175.52 3i4c s LYS 323 N -3.99 3.54 0.30 2.03 -0.14 -1.26 -0.54 119.74 119.69 3i4c s LYS 323 Ca 0.38 -0.21 0.06 0.00 -1.36 0.00 0.00 55.97 54.84 3i4c s LYS 323 Cb 0.06 -2.68 0.75 0.00 -1.68 0.00 0.00 37.83 34.27 3i4c s LYS 323 CO 0.15 0.21 1.77 1.25 -0.76 0.00 0.00 175.35 177.97 3i4c h LEU 324 N 1.26 0.78 -1.68 3.17 5.85 -1.88 -0.14 115.31 122.67 3i4c h LEU 324 Ca -0.49 0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.33 3i4c h LEU 324 Cb 1.20 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.19 3i4c h LEU 324 CO 0.64 0.27 0.00 -0.33 -0.34 0.00 0.00 178.44 178.68 3i4c h GLU 325 N 0.76 0.00 -0.55 1.25 3.07 -1.97 -2.40 114.58 114.74 3i4c h GLU 325 Ca 0.58 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.44 3i4c h GLU 325 Cb 0.92 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.83 3i4c h GLU 325 CO -0.39 0.00 0.00 0.39 -1.40 0.00 0.00 179.01 177.61 3i4c n GLU 326 N -2.75 2.30 0.04 2.33 1.02 -0.06 -4.44 120.64 119.08 3i4c n GLU 326 Ca -0.00 -1.40 -0.11 0.00 -0.02 0.00 0.00 57.16 55.63 3i4c n GLU 326 Cb 0.18 -1.54 -0.04 0.00 -0.02 0.00 0.00 31.44 30.02 3i4c n GLU 326 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3i4c h ALA 327 N 3.36 -0.30 -0.95 0.62 0.00 -1.55 0.16 119.26 120.60 3i4c h ALA 327 Ca 0.00 0.01 0.07 0.00 0.00 0.00 0.00 54.91 54.99 3i4c h ALA 327 Cb 0.81 0.45 -0.07 0.00 0.00 0.00 0.00 17.79 18.98 3i4c h ALA 327 CO 0.11 -0.74 0.60 -0.91 0.00 0.00 0.00 179.25 178.31 3i4c h ASN 328 N -0.36 0.96 0.15 0.00 2.35 -1.87 -0.55 115.58 116.26 3i4c h ASN 328 Ca 0.07 0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.83 3i4c h ASN 328 Cb 0.47 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 38.65 3i4c h ASN 328 CO -0.25 0.61 -0.07 -0.08 -1.65 0.00 0.00 177.43 175.99 3i4c h GLU 329 N 1.09 -0.19 -0.58 0.81 4.81 -1.68 0.12 114.58 118.96 3i4c h GLU 329 Ca 0.41 0.01 0.09 0.00 -0.13 0.00 0.00 59.36 59.74 3i4c h GLU 329 Cb 0.18 0.04 -0.07 0.00 0.63 0.00 0.00 28.75 29.54 3i4c h GLU 329 CO -0.18 -0.11 0.21 0.00 -0.73 0.00 0.00 179.01 178.20 3i4c h ALA 330 N 0.62 0.73 -0.35 2.92 0.00 0.04 0.44 119.26 123.65 3i4c h ALA 330 Ca -0.02 0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 3i4c h ALA 330 Cb 0.18 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 3i4c h ALA 330 CO 0.03 -0.20 -0.16 0.82 0.00 0.00 0.00 179.25 179.74 3i4c h ILE 331 N 0.38 1.26 -0.48 0.00 2.04 -0.85 -2.70 117.51 117.16 3i4c h ILE 331 Ca 0.29 -1.19 -0.03 0.00 1.00 0.00 0.00 64.86 64.94 3i4c h ILE 331 Cb 0.34 1.17 -0.02 0.00 -0.74 0.00 0.00 36.82 37.57 3i4c h ILE 331 CO -0.29 0.39 0.20 0.44 0.00 0.00 0.00 178.15 178.89 3i4c h ASP 332 N 0.58 0.66 -0.21 1.72 3.32 0.67 -0.45 116.42 122.71 3i4c h ASP 332 Ca 0.09 -0.16 0.06 0.00 0.02 0.00 0.00 57.03 57.04 3i4c h ASP 332 Cb 0.61 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.98 3i4c h ASP 332 CO 0.04 0.64 0.21 0.78 -1.72 0.00 0.00 179.24 179.19 3i4c h ASN 333 N 0.64 0.00 0.49 6.45 2.35 -0.66 0.51 115.58 125.35 3i4c h ASN 333 Ca 0.16 0.00 -0.30 0.00 -0.55 0.00 0.00 56.30 55.61 3i4c h ASN 333 Cb 0.18 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.56 3i4c h ASN 333 CO -0.01 0.00 -1.42 -0.07 -1.65 0.00 0.00 177.43 174.28 3i4c h LEU 334 N 0.00 0.48 -0.28 1.61 3.38 -0.89 1.06 115.31 120.67 3i4c h LEU 334 Ca 0.10 -0.58 -0.08 0.00 0.09 0.00 0.00 57.88 57.42 3i4c h LEU 334 Cb 0.52 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 3i4c h LEU 334 CO -0.00 1.46 -0.12 -0.33 0.09 0.00 0.00 178.44 179.54 3i4c h GLU 335 N 0.08 0.57 -0.85 1.13 5.08 0.35 -2.84 114.58 118.10 3i4c h GLU 335 Ca -0.21 -0.24 -0.06 0.00 -1.00 0.00 0.00 59.36 57.85 3i4c h GLU 335 Cb 2.03 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 31.22 3i4c h GLU 335 CO 0.20 0.81 0.08 0.09 -1.00 0.00 0.00 179.01 179.18 3i4c n ASN 336 N -4.45 3.26 -3.99 1.42 3.02 0.01 -4.90 115.26 109.63 3i4c n ASN 336 Ca -0.03 -2.52 -0.30 0.00 -0.03 0.00 0.00 54.58 51.69 3i4c n ASN 336 Cb 0.35 -0.61 -0.07 0.00 -0.61 0.00 0.00 39.78 38.84 3i4c n ASN 336 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 3i4c n PHE 337 N 0.15 -0.99 -2.15 3.10 3.01 -1.06 -4.80 117.46 114.71 3i4c n PHE 337 Ca 0.17 0.53 -0.21 0.00 1.01 0.00 0.00 57.45 58.95 3i4c n PHE 337 Cb 0.79 -1.92 0.02 0.00 -0.01 0.00 0.00 39.48 38.36 3i4c n PHE 337 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 3i4c n LYS 338 N -3.68 3.36 -3.08 -1.08 4.01 0.36 -4.83 118.16 113.22 3i4c n LYS 338 Ca -0.09 -4.11 -0.20 0.00 -0.51 0.00 0.00 58.31 53.41 3i4c n LYS 338 Cb 0.47 -2.19 -0.03 0.00 -0.51 0.00 0.00 35.03 32.78 3i4c n LYS 338 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 3i4c n ALA 339 N -0.68 2.82 -2.22 7.82 0.00 -0.82 -4.79 120.51 122.64 3i4c n ALA 339 Ca 0.39 -3.72 -0.43 0.00 0.00 0.00 0.00 53.44 49.68 3i4c n ALA 339 Cb 0.93 -0.87 -0.02 0.00 0.00 0.00 0.00 19.45 19.48 3i4c n ALA 339 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 3i4c s ILE 340 N -3.05 3.85 0.00 0.00 -4.36 -1.26 -4.69 121.20 111.69 3i4c s ILE 340 Ca 0.41 0.95 0.00 0.00 -0.26 0.00 0.00 60.65 61.75 3i4c s ILE 340 Cb 0.34 -3.87 0.00 0.00 1.25 0.00 0.00 42.46 40.18 3i4c s ILE 340 CO -0.09 -0.37 0.00 0.61 0.24 0.00 0.00 174.94 175.33 3i4c n GLY 341 N 4.58 3.52 3.64 6.27 0.00 -1.26 -5.01 105.19 116.92 3i4c n GLY 341 Ca 0.17 -1.33 -0.42 0.00 0.00 0.00 0.00 46.02 44.44 3i4c n GLY 341 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3i4c s ARG 342 N -5.79 3.81 -0.05 1.61 6.06 -0.74 -4.69 118.95 119.16 3i4c s ARG 342 Ca 0.00 2.30 -0.24 0.00 -2.50 0.00 0.00 55.73 55.29 3i4c s ARG 342 Cb 0.00 -4.20 -0.04 0.00 0.06 0.00 0.00 34.95 30.78 3i4c s ARG 342 CO 0.00 -1.32 0.75 -0.65 -2.50 0.00 0.00 175.30 171.58 3i4c s GLN 343 N 5.00 4.46 -0.07 5.12 -0.21 -1.26 -0.44 119.66 132.26 3i4c s GLN 343 Ca 0.89 0.97 0.02 0.00 0.02 0.00 0.00 55.36 57.26 3i4c s GLN 343 Cb -0.37 -3.44 0.01 0.00 1.00 0.00 0.00 33.01 30.21 3i4c s GLN 343 CO 0.37 0.06 -0.14 0.08 -2.12 0.00 0.00 175.29 173.55 3i4c s VAL 344 N 0.77 1.26 -0.02 1.09 1.01 -0.11 -0.97 120.40 123.44 3i4c s VAL 344 Ca 0.40 -0.54 -0.20 0.00 0.00 0.00 0.00 61.98 61.64 3i4c s VAL 344 Cb -0.18 -1.14 -0.05 0.00 0.00 0.00 0.00 36.38 35.00 3i4c s VAL 344 CO 0.20 0.38 0.56 -0.76 0.00 0.00 0.00 175.10 175.49 3i4c s LEU 345 N 0.69 4.41 -0.58 3.92 1.43 0.19 -0.51 118.68 128.23 3i4c s LEU 345 Ca -0.14 1.10 -0.00 0.00 -1.03 0.00 0.00 54.13 54.06 3i4c s LEU 345 Cb -0.16 -2.86 0.15 0.00 0.03 0.00 0.00 46.19 43.35 3i4c s LEU 345 CO 0.04 0.12 0.36 -0.63 0.23 0.00 0.00 176.35 176.46 3i4c s ILE 346 N -0.20 3.28 -0.87 -0.59 1.01 0.30 -0.62 121.20 123.51 3i4c s ILE 346 Ca 0.30 -3.05 0.00 0.00 0.00 0.00 0.00 60.65 57.90 3i4c s ILE 346 Cb -0.18 -3.19 0.00 0.00 0.01 0.00 0.00 42.46 39.11 3i4c s ILE 346 CO 0.16 -0.84 0.22 -2.65 0.00 0.00 0.00 174.94 171.83