#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iin s LYS 2 N 0.00 4.73 -0.04 3.17 1.02 -1.26 -4.67 119.74 122.70 1iin s LYS 2 Ca 0.00 1.58 -0.30 0.00 0.02 0.00 0.00 55.97 57.27 1iin s LYS 2 Cb 0.00 -3.18 -0.06 0.00 -0.52 0.00 0.00 37.83 34.08 1iin s LYS 2 CO 0.00 0.37 1.62 0.99 -0.92 0.00 0.00 175.35 177.41 1iin s THR 3 N -1.23 3.54 -0.02 2.17 2.01 0.48 -4.85 115.64 117.75 1iin s THR 3 Ca 0.44 0.74 0.03 0.00 0.31 0.00 0.00 61.69 63.20 1iin s THR 3 Cb -0.27 -3.47 0.04 0.00 0.01 0.00 0.00 72.50 68.81 1iin s THR 3 CO 0.34 -0.05 0.87 0.54 -0.69 0.00 0.00 174.62 175.63 1iin n ARG 4 N 6.76 1.53 -4.50 4.92 5.12 -1.26 -4.68 116.66 124.55 1iin n ARG 4 Ca 0.17 -1.31 -0.23 0.00 -1.93 0.00 0.00 57.85 54.54 1iin n ARG 4 Cb 0.43 -0.87 -0.14 0.00 -1.16 0.00 0.00 32.46 30.72 1iin n ARG 4 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 1iin s LYS 5 N -0.88 1.19 0.05 5.56 1.02 -1.26 -3.70 119.74 121.73 1iin s LYS 5 Ca 0.05 -0.89 -0.07 0.00 0.02 0.00 0.00 55.97 55.08 1iin s LYS 5 Cb 0.04 -1.28 -0.01 0.00 -0.52 0.00 0.00 37.83 36.06 1iin s LYS 5 CO 0.00 0.32 0.13 0.20 -0.92 0.00 0.00 175.35 175.09 1iin s GLY 6 N -1.23 0.14 -0.07 -3.33 0.00 -0.52 -1.26 107.32 101.04 1iin s GLY 6 Ca 0.05 -0.54 0.03 0.00 0.00 0.00 0.00 44.72 44.26 1iin s GLY 6 CO 0.02 -0.69 -0.14 -0.42 0.00 0.00 0.00 173.10 171.86 1iin s ILE 7 N -2.93 1.29 -0.29 0.90 1.01 -0.09 -0.52 121.20 120.57 1iin s ILE 7 Ca -0.02 -0.57 -0.08 0.00 0.00 0.00 0.00 60.65 59.97 1iin s ILE 7 Cb 0.01 -1.16 -0.01 0.00 0.01 0.00 0.00 42.46 41.30 1iin s ILE 7 CO -0.06 0.39 0.11 -0.63 0.00 0.00 0.00 174.94 174.75 1iin s ILE 8 N 0.60 4.41 -0.53 2.92 1.01 -0.08 -0.69 121.20 128.85 1iin s ILE 8 Ca -0.15 -0.37 -0.20 0.00 0.00 0.00 0.00 60.65 59.92 1iin s ILE 8 Cb -0.16 -3.19 0.06 0.00 0.01 0.00 0.00 42.46 39.18 1iin s ILE 8 CO 0.05 0.16 0.70 -0.22 0.00 0.00 0.00 174.94 175.62 1iin s LEU 9 N 1.60 4.84 -0.35 2.97 2.96 -0.30 -1.68 118.68 128.72 1iin s LEU 9 Ca 0.05 -0.87 0.10 0.00 -0.22 0.00 0.00 54.13 53.19 1iin s LEU 9 Cb -0.16 -2.50 0.45 0.00 0.50 0.00 0.00 46.19 44.48 1iin s LEU 9 CO 0.05 -0.99 1.10 0.00 -1.32 0.00 0.00 176.35 175.19 1iin n ALA 10 N 6.45 4.42 -2.05 5.97 0.00 0.44 -0.31 120.51 135.43 1iin n ALA 10 Ca -0.05 -3.76 0.00 0.00 0.00 0.00 0.00 53.44 49.63 1iin n ALA 10 Cb 0.45 -0.60 0.00 0.00 0.00 0.00 0.00 19.45 19.30 1iin n ALA 10 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1iin n GLY 11 N -0.47 2.05 0.00 0.00 0.00 -1.21 -4.50 105.19 101.05 1iin n GLY 11 Ca 0.30 -1.89 0.00 0.00 0.00 0.00 0.00 46.02 44.43 1iin n GLY 11 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1iin n GLY 12 N 5.00 -0.68 0.03 -0.02 0.00 -1.26 -4.83 105.19 103.43 1iin n GLY 12 Ca 0.00 -1.48 0.12 0.00 0.00 0.00 0.00 46.02 44.66 1iin n GLY 12 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1iin n SER 13 N -0.85 0.63 -1.06 1.61 3.41 -1.26 -4.86 113.62 111.24 1iin n SER 13 Ca 0.00 -0.18 -0.10 0.00 -0.26 0.00 0.00 58.87 58.33 1iin n SER 13 Cb 0.00 0.51 -0.01 0.00 -0.26 0.00 0.00 64.21 64.45 1iin n SER 13 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1iin n GLY 14 N 1.40 0.15 0.37 5.00 0.00 -1.26 -4.86 105.19 105.98 1iin n GLY 14 Ca 0.03 -0.49 0.16 0.00 0.00 0.00 0.00 46.02 45.72 1iin n GLY 14 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1iin h THR 15 N 0.00 0.81 0.00 2.61 1.35 -1.94 -0.96 112.91 114.78 1iin h THR 15 Ca -0.23 -0.10 -0.00 0.00 -0.55 0.00 0.00 66.41 65.53 1iin h THR 15 Cb 1.09 0.51 -0.00 0.00 -1.73 0.00 0.00 68.15 68.02 1iin h THR 15 CO 0.28 0.05 -0.01 0.03 -0.25 0.00 0.00 175.52 175.62 1iin h ARG 16 N 0.28 0.00 -0.38 4.72 3.08 -1.95 -2.52 114.38 117.60 1iin h ARG 16 Ca 0.30 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.35 1iin h ARG 16 Cb 0.80 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.85 1iin h ARG 16 CO -0.07 0.01 0.00 1.28 -1.07 0.00 0.00 179.97 180.12 1iin n LEU 17 N -3.16 3.05 -4.67 3.04 4.77 -0.37 -4.94 117.00 114.72 1iin n LEU 17 Ca -0.02 -2.03 -0.39 0.00 -0.03 0.00 0.00 56.01 53.55 1iin n LEU 17 Cb 0.15 -0.26 0.04 0.00 -2.33 0.00 0.00 43.42 41.02 1iin n LEU 17 CO 0.23 0.75 0.75 -1.22 -1.33 0.00 0.00 177.39 176.57 1iin n TYR 18 N 0.59 1.54 1.47 -1.77 4.01 -0.95 -2.09 117.16 119.95 1iin n TYR 18 Ca 0.13 0.45 0.14 0.00 -0.16 0.00 0.00 57.90 58.46 1iin n TYR 18 Cb 0.46 -2.25 0.58 0.00 -0.31 0.00 0.00 39.34 37.82 1iin n TYR 18 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 1iin n PRO 19 N -0.88 1.02 -0.22 -0.72 -0.04 -1.26 -4.88 135.00 128.02 1iin n PRO 19 Ca 0.12 -0.45 0.00 0.00 -0.04 0.00 0.00 63.50 63.13 1iin n PRO 19 Cb 0.45 -1.49 0.12 0.00 -0.04 0.00 0.00 33.50 32.54 1iin n PRO 19 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1iin h VAL 20 N 1.10 0.83 -0.18 0.52 2.07 -1.82 -1.23 116.25 117.55 1iin h VAL 20 Ca 0.00 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 67.34 1iin h VAL 20 Cb 0.38 0.26 0.00 0.00 -1.52 0.00 0.00 31.29 30.41 1iin h VAL 20 CO 0.00 0.10 0.00 0.35 0.02 0.00 0.00 177.57 178.04 1iin n THR 21 N -4.91 0.23 0.03 2.57 -2.24 -1.20 -3.62 114.28 105.13 1iin n THR 21 Ca 0.09 -0.27 -0.08 0.00 -2.27 0.00 0.00 64.05 61.52 1iin n THR 21 Cb 0.26 0.15 0.07 0.00 -2.10 0.00 0.00 70.33 68.71 1iin n THR 21 CO 0.00 0.00 0.00 0.24 -0.57 0.00 0.00 175.07 174.74 1iin h MET 22 N 1.42 0.47 0.00 -0.78 2.86 -1.53 -3.34 114.93 114.04 1iin h MET 22 Ca 0.00 -0.30 -0.01 0.00 -2.06 0.00 0.00 59.70 57.32 1iin h MET 22 Cb 0.32 0.04 -0.02 0.00 0.06 0.00 0.00 31.60 31.99 1iin h MET 22 CO 0.00 0.91 -0.27 0.00 1.06 0.00 0.00 176.91 178.61 1iin n ALA 23 N -2.51 2.63 -3.66 6.32 0.00 -1.24 -4.99 120.51 117.07 1iin n ALA 23 Ca -0.03 -2.61 -0.07 0.00 0.00 0.00 0.00 53.44 50.73 1iin n ALA 23 Cb 0.61 -0.41 -0.08 0.00 0.00 0.00 0.00 19.45 19.57 1iin n ALA 23 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1iin s VAL 24 N -2.45 -0.22 0.41 0.00 1.01 -1.24 -5.14 120.40 112.77 1iin s VAL 24 Ca 0.30 0.05 -0.26 0.00 0.00 0.00 0.00 61.98 62.06 1iin s VAL 24 Cb 0.28 -0.84 -0.10 0.00 0.00 0.00 0.00 36.38 35.72 1iin s VAL 24 CO -0.01 0.02 1.43 -0.24 0.00 0.00 0.00 175.10 176.30 1iin n SER 25 N 4.58 3.42 -0.26 3.32 2.88 -1.26 -4.19 113.62 122.11 1iin n SER 25 Ca -0.19 1.17 0.03 0.00 -1.33 0.00 0.00 58.87 58.54 1iin n SER 25 Cb 0.55 -1.60 0.16 0.00 -0.75 0.00 0.00 64.21 62.57 1iin n SER 25 CO 0.00 0.00 0.00 -0.61 -1.23 0.00 0.00 175.04 173.20 1iin h GLN 26 N 2.54 0.60 0.00 -1.46 4.15 -1.91 -1.35 115.11 117.69 1iin h GLN 26 Ca -0.50 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 58.88 1iin h GLN 26 Cb 1.26 -0.14 0.00 0.00 0.21 0.00 0.00 27.48 28.82 1iin h GLN 26 CO 0.62 0.40 0.00 1.04 -1.93 0.00 0.00 178.83 178.96 1iin n GLN 27 N -4.86 0.62 0.00 1.69 3.00 -1.26 -1.89 117.38 114.69 1iin n GLN 27 Ca 0.12 0.00 0.08 0.00 -0.01 0.00 0.00 57.00 57.19 1iin n GLN 27 Cb 0.30 -1.49 -0.02 0.00 0.00 0.00 0.00 30.24 29.03 1iin n GLN 27 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 1iin n LEU 28 N -0.99 1.48 -4.76 1.08 4.77 -0.52 -1.52 117.00 116.53 1iin n LEU 28 Ca 0.15 -0.71 -0.41 0.00 -0.03 0.00 0.00 56.01 55.00 1iin n LEU 28 Cb 0.07 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.14 1iin n LEU 28 CO 0.11 0.29 1.10 -0.76 -1.33 0.00 0.00 177.39 176.80 1iin s LEU 29 N -2.19 4.37 0.29 2.23 1.43 -0.79 -4.38 118.68 119.64 1iin s LEU 29 Ca 0.12 2.83 -0.29 0.00 -1.03 0.00 0.00 54.13 55.76 1iin s LEU 29 Cb 0.13 -3.65 -0.10 0.00 0.03 0.00 0.00 46.19 42.61 1iin s LEU 29 CO 0.46 -0.73 1.23 -2.16 0.23 0.00 0.00 176.35 175.37 1iin s PRO 30 N -1.30 4.47 -0.55 1.29 0.04 -1.26 -0.56 135.00 137.12 1iin s PRO 30 Ca 0.55 2.03 0.01 0.00 0.04 0.00 0.00 61.00 63.64 1iin s PRO 30 Cb -0.43 -3.14 0.14 0.00 0.04 0.00 0.00 34.50 31.11 1iin s PRO 30 CO 0.52 -0.04 0.32 0.42 0.04 0.00 0.00 177.00 178.26 1iin s ILE 31 N -0.95 3.00 0.00 0.56 -1.09 -0.43 -4.85 121.20 117.43 1iin s ILE 31 Ca 0.48 -3.16 0.00 0.00 -2.23 0.00 0.00 60.65 55.74 1iin s ILE 31 Cb -0.36 -3.03 0.00 0.00 -1.58 0.00 0.00 42.46 37.49 1iin s ILE 31 CO 0.46 -0.82 0.00 0.00 -1.23 0.00 0.00 174.94 173.35 1iin n TYR 32 N 3.28 0.00 -0.19 3.97 9.36 -1.26 -3.31 117.16 129.00 1iin n TYR 32 Ca 0.06 0.00 0.06 0.00 3.32 0.00 0.00 57.90 61.34 1iin n TYR 32 Cb 0.34 0.00 0.17 0.00 -0.63 0.00 0.00 39.34 39.22 1iin n TYR 32 CO 0.00 0.00 0.00 -0.40 0.22 0.00 0.00 176.86 176.68 1iin n ASP 33 N 4.71 3.03 -3.52 2.98 5.75 -1.26 -5.02 116.55 123.21 1iin n ASP 33 Ca 0.00 -2.00 -0.15 0.00 -0.01 0.00 0.00 54.79 52.63 1iin n ASP 33 Cb 0.00 -0.26 -0.05 0.00 -1.03 0.00 0.00 41.12 39.78 1iin n ASP 33 CO 0.00 0.00 0.00 -1.59 -0.11 0.00 0.00 177.20 175.50 1iin s LYS 34 N -1.00 1.09 0.67 0.11 -2.85 -1.21 -5.04 119.74 111.52 1iin s LYS 34 Ca 0.26 -0.12 -0.17 0.00 -1.00 0.00 0.00 55.97 54.93 1iin s LYS 34 Cb 0.13 0.51 0.00 0.00 -2.06 0.00 0.00 37.83 36.41 1iin s LYS 34 CO 0.18 -0.40 1.28 -0.35 0.10 0.00 0.00 175.35 176.16 1iin n PRO 35 N 0.41 0.98 -0.25 1.78 -0.04 -1.26 -1.31 135.00 135.31 1iin n PRO 35 Ca -0.18 0.39 0.05 0.00 -0.04 0.00 0.00 63.50 63.73 1iin n PRO 35 Cb 0.60 -2.52 0.18 0.00 -0.04 0.00 0.00 33.50 31.72 1iin n PRO 35 CO 0.00 0.00 0.00 1.98 -0.04 0.00 0.00 175.50 177.44 1iin h MET 36 N 0.32 0.27 0.00 0.54 1.85 -0.84 -1.39 114.93 115.68 1iin h MET 36 Ca -0.50 -0.02 0.00 0.00 -0.61 0.00 0.00 59.70 58.57 1iin h MET 36 Cb 1.33 -0.06 0.00 0.00 0.43 0.00 0.00 31.60 33.30 1iin h MET 36 CO 0.52 0.18 0.00 0.97 -0.40 0.00 0.00 176.91 178.18 1iin h ILE 37 N 0.28 0.00 0.00 1.77 2.10 -1.44 -0.99 117.51 119.23 1iin h ILE 37 Ca 0.41 -0.10 -0.03 0.00 1.08 0.00 0.00 64.86 66.22 1iin h ILE 37 Cb 0.69 0.93 -0.00 0.00 -1.09 0.00 0.00 36.82 37.35 1iin h ILE 37 CO -0.50 0.00 -0.16 1.88 -1.08 0.00 0.00 178.15 178.29 1iin h TYR 38 N 0.00 0.00 0.53 2.19 -1.99 -1.55 -2.20 116.97 113.95 1iin h TYR 38 Ca 0.00 0.00 -0.03 0.00 2.00 0.00 0.00 58.73 60.70 1iin h TYR 38 Cb 0.11 0.00 0.01 0.00 2.00 0.00 0.00 36.73 38.85 1iin h TYR 38 CO 0.00 0.16 -0.26 1.88 -0.00 0.00 0.00 178.16 179.95 1iin h TYR 39 N 0.00 -0.67 0.00 4.88 -1.99 -1.33 -0.41 116.97 117.45 1iin h TYR 39 Ca -0.00 -0.02 -0.04 0.00 2.00 0.00 0.00 58.73 60.68 1iin h TYR 39 Cb 0.29 0.22 -0.01 0.00 2.00 0.00 0.00 36.73 39.24 1iin h TYR 39 CO 0.00 -0.36 -0.17 -1.00 -0.00 0.00 0.00 178.16 176.63 1iin h PRO 40 N -1.11 0.00 -0.52 4.88 0.13 -1.63 -1.79 132.00 131.96 1iin h PRO 40 Ca -0.07 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.04 1iin h PRO 40 Cb 0.60 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.71 1iin h PRO 40 CO 0.12 0.17 0.28 1.25 -0.23 0.00 0.00 178.00 179.59 1iin h LEU 41 N 0.00 0.66 -1.24 1.56 5.85 -1.38 -1.87 115.31 118.89 1iin h LEU 41 Ca -0.00 -0.10 0.01 0.00 0.84 0.00 0.00 57.88 58.63 1iin h LEU 41 Cb 0.31 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.13 1iin h LEU 41 CO 0.02 0.57 0.52 0.28 -0.34 0.00 0.00 178.44 179.49 1iin h SER 42 N 0.70 0.89 -0.55 1.25 0.02 -0.31 -1.25 113.55 114.29 1iin h SER 42 Ca 0.18 -0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 61.10 1iin h SER 42 Cb 0.06 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 62.35 1iin h SER 42 CO -0.03 0.64 0.32 0.74 -1.14 0.00 0.00 176.83 177.37 1iin h THR 43 N 1.05 1.17 -0.37 -2.27 2.02 -0.56 0.85 112.91 114.81 1iin h THR 43 Ca 0.29 -0.41 -0.04 0.00 0.77 0.00 0.00 66.41 67.02 1iin h THR 43 Cb -0.11 0.44 -0.01 0.00 -1.74 0.00 0.00 68.15 66.73 1iin h THR 43 CO -0.06 0.18 0.06 -0.07 0.37 0.00 0.00 175.52 176.00 1iin h LEU 44 N 0.74 0.58 -1.12 2.58 3.38 -1.07 -2.56 115.31 117.84 1iin h LEU 44 Ca 0.20 -0.26 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 1iin h LEU 44 Cb 0.01 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.57 1iin h LEU 44 CO -0.03 0.69 0.47 0.24 0.09 0.00 0.00 178.44 179.90 1iin h MET 45 N 0.45 1.08 0.00 1.13 2.86 -0.86 -0.59 114.93 118.99 1iin h MET 45 Ca 0.11 -0.10 -0.02 0.00 -2.06 0.00 0.00 59.70 57.63 1iin h MET 45 Cb 0.35 -0.23 -0.00 0.00 0.06 0.00 0.00 31.60 31.79 1iin h MET 45 CO 0.01 0.76 -0.09 -0.07 1.06 0.00 0.00 176.91 178.57 1iin h LEU 46 N 1.09 0.00 -0.76 1.22 3.38 -0.65 -1.07 115.31 118.52 1iin h LEU 46 Ca 0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.25 1iin h LEU 46 Cb -0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.71 1iin h LEU 46 CO -0.05 0.09 0.00 0.00 0.09 0.00 0.00 178.44 178.57 1iin n ALA 47 N -2.21 2.58 -0.54 1.53 0.00 -0.32 -4.73 120.51 116.82 1iin n ALA 47 Ca -0.01 -0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.03 1iin n ALA 47 Cb 0.26 -1.22 0.00 0.00 0.00 0.00 0.00 19.45 18.49 1iin n ALA 47 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1iin n GLY 48 N 1.11 0.75 3.67 0.00 0.00 -0.40 -5.01 105.19 105.31 1iin n GLY 48 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 1iin n GLY 48 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1iin s ILE 49 N -2.58 4.89 -0.03 -0.61 1.01 -0.65 -4.91 121.20 118.32 1iin s ILE 49 Ca 0.00 1.63 0.01 0.00 0.00 0.00 0.00 60.65 62.28 1iin s ILE 49 Cb 0.00 -4.13 -0.00 0.00 0.01 0.00 0.00 42.46 38.33 1iin s ILE 49 CO 0.00 0.04 0.08 0.54 0.00 0.00 0.00 174.94 175.61 1iin n ARG 50 N 5.10 5.89 -3.72 2.79 1.74 -1.26 -3.75 116.66 123.45 1iin n ARG 50 Ca 0.04 -0.06 -0.38 0.00 -0.77 0.00 0.00 57.85 56.68 1iin n ARG 50 Cb 0.49 -0.58 -0.11 0.00 -1.02 0.00 0.00 32.46 31.23 1iin n ARG 50 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1iin s ASP 51 N -0.94 5.37 -0.01 0.55 2.15 -1.24 -0.72 116.67 121.82 1iin s ASP 51 Ca 0.00 -1.50 0.03 0.00 0.43 0.00 0.00 52.55 51.51 1iin s ASP 51 Cb 0.00 -1.88 -0.01 0.00 -0.30 0.00 0.00 42.92 40.74 1iin s ASP 51 CO 0.02 -0.45 -0.11 -0.63 -0.17 0.00 0.00 175.17 173.83 1iin s ILE 52 N 1.33 0.89 -0.20 4.11 1.01 -0.50 -1.44 121.20 126.40 1iin s ILE 52 Ca 0.02 -0.46 -0.07 0.00 0.00 0.00 0.00 60.65 60.14 1iin s ILE 52 Cb -0.22 -0.76 -0.03 0.00 0.01 0.00 0.00 42.46 41.46 1iin s ILE 52 CO 0.00 0.26 0.05 -0.22 0.00 0.00 0.00 174.94 175.03 1iin s LEU 53 N -0.13 3.59 -0.20 2.97 2.96 0.32 -1.42 118.68 126.78 1iin s LEU 53 Ca 0.02 -0.05 -0.06 0.00 -0.22 0.00 0.00 54.13 53.82 1iin s LEU 53 Cb -0.06 -1.92 -0.03 0.00 0.50 0.00 0.00 46.19 44.68 1iin s LEU 53 CO -0.00 0.11 0.04 -0.63 -1.32 0.00 0.00 176.35 174.55 1iin s ILE 54 N 0.77 4.36 -0.15 6.68 1.01 0.11 -0.90 121.20 133.08 1iin s ILE 54 Ca 0.03 -0.18 -0.02 0.00 0.00 0.00 0.00 60.65 60.48 1iin s ILE 54 Cb -0.14 -2.98 -0.02 0.00 0.01 0.00 0.00 42.46 39.34 1iin s ILE 54 CO 0.02 0.42 -0.09 -0.63 0.00 0.00 0.00 174.94 174.66 1iin s ILE 55 N 0.89 3.32 0.00 2.92 1.01 -0.67 -1.36 121.20 127.30 1iin s ILE 55 Ca 0.03 -0.56 0.00 0.00 0.00 0.00 0.00 60.65 60.12 1iin s ILE 55 Cb -0.14 -2.43 0.00 0.00 0.01 0.00 0.00 42.46 39.90 1iin s ILE 55 CO 0.02 0.50 0.00 -0.24 0.00 0.00 0.00 174.94 175.23 1iin n SER 56 N 3.70 0.00 -4.91 3.58 2.88 -1.04 -0.42 113.62 117.41 1iin n SER 56 Ca -0.18 -0.96 -0.28 0.00 -1.33 0.00 0.00 58.87 56.12 1iin n SER 56 Cb 0.52 0.00 0.07 0.00 -0.75 0.00 0.00 64.21 64.06 1iin n SER 56 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 1iin s THR 57 N -2.36 2.33 0.20 2.46 -4.23 -1.26 -0.16 115.64 112.63 1iin s THR 57 Ca 0.00 -0.06 -0.10 0.00 -1.18 0.00 0.00 61.69 60.35 1iin s THR 57 Cb 0.00 -3.07 0.13 0.00 1.34 0.00 0.00 72.50 70.90 1iin s THR 57 CO 0.00 -0.08 1.80 -0.65 -0.54 0.00 0.00 174.62 175.15 1iin h PRO 58 N -0.79 0.61 -0.07 3.99 0.11 -1.89 -1.03 132.00 132.92 1iin h PRO 58 Ca -0.45 -0.04 -0.19 0.00 0.11 0.00 0.00 66.00 65.43 1iin h PRO 58 Cb 1.31 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 32.28 1iin h PRO 58 CO 0.63 0.41 -0.76 1.96 -0.21 0.00 0.00 178.00 180.03 1iin h GLN 59 N 0.63 0.44 0.00 1.05 4.20 -1.97 -3.35 115.11 116.11 1iin h GLN 59 Ca 0.28 -0.37 -0.14 0.00 0.06 0.00 0.00 58.65 58.48 1iin h GLN 59 Cb 0.18 0.08 -0.02 0.00 0.30 0.00 0.00 27.48 28.02 1iin h GLN 59 CO -0.18 1.01 -1.19 -0.44 -0.67 0.00 0.00 178.83 177.36 1iin h ASP 60 N 0.29 0.00 -0.70 1.46 3.32 -1.87 -3.38 116.42 115.54 1iin h ASP 60 Ca -0.04 0.00 0.10 0.00 0.02 0.00 0.00 57.03 57.11 1iin h ASP 60 Cb 1.35 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 40.83 1iin h ASP 60 CO 0.13 0.51 0.34 0.74 -1.72 0.00 0.00 179.24 179.24 1iin h THR 61 N 0.00 0.83 0.00 0.35 2.02 -1.33 0.10 112.91 114.88 1iin h THR 61 Ca -0.12 -0.20 -0.00 0.00 0.77 0.00 0.00 66.41 66.87 1iin h THR 61 Cb 1.49 0.21 -0.00 0.00 -1.74 0.00 0.00 68.15 68.11 1iin h THR 61 CO 0.05 0.10 -0.02 1.55 0.37 0.00 0.00 175.52 177.57 1iin h PRO 62 N 0.57 0.00 0.06 6.66 0.13 -1.76 -1.10 132.00 136.56 1iin h PRO 62 Ca 0.35 0.00 -0.27 0.00 -0.87 0.00 0.00 66.00 65.21 1iin h PRO 62 Cb 0.38 0.00 0.02 0.00 0.13 0.00 0.00 31.00 31.53 1iin h PRO 62 CO -0.28 0.02 -1.12 0.00 -0.23 0.00 0.00 178.00 176.38 1iin h ARG 63 N 0.00 0.54 -0.54 0.86 2.47 -1.20 -1.14 114.38 115.36 1iin h ARG 63 Ca -0.00 -0.67 -0.08 0.00 -1.26 0.00 0.00 59.98 57.97 1iin h ARG 63 Cb 0.32 0.21 -0.02 0.00 -1.65 0.00 0.00 29.97 28.82 1iin h ARG 63 CO 0.00 1.28 0.03 0.74 0.56 0.00 0.00 179.97 182.58 1iin h PHE 64 N 0.27 0.96 -0.50 3.04 -1.00 -0.81 -0.02 116.94 118.88 1iin h PHE 64 Ca -0.14 -0.14 -0.01 0.00 2.81 0.00 0.00 57.97 60.49 1iin h PHE 64 Cb 1.79 -0.26 -0.02 0.00 3.61 0.00 0.00 35.95 41.06 1iin h PHE 64 CO 0.09 0.86 0.26 1.96 -1.61 0.00 0.00 178.31 179.87 1iin h GLN 65 N 0.84 0.70 -0.84 1.51 4.20 -1.13 0.02 115.11 120.42 1iin h GLN 65 Ca 0.16 -0.09 -0.00 0.00 0.06 0.00 0.00 58.65 58.78 1iin h GLN 65 Cb 0.46 -0.13 -0.04 0.00 0.30 0.00 0.00 27.48 28.06 1iin h GLN 65 CO 0.02 0.57 0.51 0.37 -0.67 0.00 0.00 178.83 179.62 1iin h GLN 66 N 0.66 1.14 -0.09 1.46 4.15 -0.75 0.35 115.11 122.03 1iin h GLN 66 Ca 0.17 -0.10 -0.05 0.00 0.77 0.00 0.00 58.65 59.45 1iin h GLN 66 Cb 0.08 -0.24 -0.00 0.00 0.21 0.00 0.00 27.48 27.53 1iin h GLN 66 CO -0.03 0.80 -0.13 1.25 -1.93 0.00 0.00 178.83 178.79 1iin h LEU 67 N 1.16 0.27 0.00 -2.39 5.85 -0.43 -3.40 115.31 116.37 1iin h LEU 67 Ca 0.30 -0.52 -0.02 0.00 0.84 0.00 0.00 57.88 58.48 1iin h LEU 67 Cb -0.05 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 40.90 1iin h LEU 67 CO -0.06 0.74 -1.76 0.18 -0.34 0.00 0.00 178.44 177.20 1iin n LEU 68 N -4.62 0.00 0.00 2.25 4.77 -0.06 -5.10 117.00 114.24 1iin n LEU 68 Ca -0.07 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.91 1iin n LEU 68 Cb 0.35 0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.47 1iin n LEU 68 CO 0.38 0.03 0.00 0.61 -1.33 0.00 0.00 177.39 177.08 1iin n GLY 69 N 1.63 1.12 0.34 -0.72 0.00 0.12 -2.21 105.19 105.48 1iin n GLY 69 Ca -0.05 -0.59 0.11 0.00 0.00 0.00 0.00 46.02 45.50 1iin n GLY 69 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1iin n ASP 70 N -2.86 1.05 0.00 1.61 5.68 -1.26 -4.80 116.55 115.97 1iin n ASP 70 Ca 0.00 -1.53 0.00 0.00 -0.50 0.00 0.00 54.79 52.76 1iin n ASP 70 Cb 0.00 -0.05 0.00 0.00 -1.14 0.00 0.00 41.12 39.93 1iin n ASP 70 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1iin n GLY 71 N 1.04 0.70 0.29 6.12 0.00 -0.94 -0.48 105.19 111.92 1iin n GLY 71 Ca 0.17 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.36 1iin n GLY 71 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1iin h SER 72 N 0.00 0.00 0.52 1.61 4.64 -1.80 -0.37 113.55 118.15 1iin h SER 72 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1iin h SER 72 Cb 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 1iin h SER 72 CO 0.00 0.05 0.00 0.06 -0.87 0.00 0.00 176.83 176.07 1iin h GLN 73 N 0.00 0.00 -0.19 4.77 -0.00 -1.89 -1.78 115.11 116.02 1iin h GLN 73 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 1iin h GLN 73 Cb 0.26 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.74 1iin h GLN 73 CO 0.01 0.00 0.00 0.91 -0.00 0.00 0.00 178.83 179.75 1iin n TRP 74 N -3.02 0.45 -1.62 0.06 8.01 -0.26 -4.96 117.44 116.10 1iin n TRP 74 Ca -0.01 -0.71 -0.07 0.00 -1.31 0.00 0.00 57.50 55.40 1iin n TRP 74 Cb 0.19 -0.15 -0.02 0.00 -2.01 0.00 0.00 31.31 29.32 1iin n TRP 74 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1iin n GLY 75 N -0.36 0.53 3.74 6.99 0.00 -0.67 -4.68 105.19 110.73 1iin n GLY 75 Ca 0.13 -0.69 -0.24 0.00 0.00 0.00 0.00 46.02 45.22 1iin n GLY 75 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1iin s LEU 76 N -1.67 3.13 -0.31 0.99 1.43 -0.51 -4.97 118.68 116.77 1iin s LEU 76 Ca 0.00 -1.05 0.01 0.00 -1.03 0.00 0.00 54.13 52.06 1iin s LEU 76 Cb 0.00 -1.46 0.09 0.00 0.03 0.00 0.00 46.19 44.85 1iin s LEU 76 CO 0.00 -0.52 0.05 0.21 0.23 0.00 0.00 176.35 176.32 1iin s ASN 77 N -3.90 4.27 -0.12 2.29 3.84 0.10 -2.64 114.94 118.78 1iin s ASN 77 Ca 0.41 -1.74 -0.04 0.00 0.21 0.00 0.00 52.86 51.70 1iin s ASN 77 Cb 0.03 -1.22 -0.04 0.00 -0.55 0.00 0.00 41.25 39.48 1iin s ASN 77 CO 0.23 -0.36 0.03 -0.76 -2.79 0.00 0.00 177.10 173.45 1iin s LEU 78 N 1.30 3.73 0.17 3.21 1.43 0.37 -1.41 118.68 127.49 1iin s LEU 78 Ca 0.07 0.15 0.06 0.00 -1.03 0.00 0.00 54.13 53.38 1iin s LEU 78 Cb -0.18 -1.89 -0.04 0.00 0.03 0.00 0.00 46.19 44.10 1iin s LEU 78 CO -0.15 0.31 -0.13 -1.10 0.23 0.00 0.00 176.35 175.51 1iin s GLN 79 N -0.43 1.20 0.05 1.70 -0.21 -0.51 -4.66 119.66 116.80 1iin s GLN 79 Ca 0.09 -1.49 0.05 0.00 0.02 0.00 0.00 55.36 54.03 1iin s GLN 79 Cb -0.12 -0.93 -0.03 0.00 1.00 0.00 0.00 33.01 32.93 1iin s GLN 79 CO 0.02 0.15 -0.14 0.71 -2.12 0.00 0.00 175.29 173.91 1iin s TYR 80 N -2.95 1.23 -0.04 0.91 1.51 -1.26 0.08 117.35 116.83 1iin s TYR 80 Ca 0.18 -0.40 -0.08 0.00 -1.01 0.00 0.00 57.07 55.76 1iin s TYR 80 Cb -0.00 -0.71 0.01 0.00 -0.11 0.00 0.00 41.96 41.15 1iin s TYR 80 CO 0.04 0.05 0.20 0.21 -1.11 0.00 0.00 175.55 174.94 1iin s LYS 81 N -1.42 0.38 -0.05 -0.62 2.20 -0.46 -4.93 119.74 114.85 1iin s LYS 81 Ca 0.00 -0.01 -0.15 0.00 -0.36 0.00 0.00 55.97 55.45 1iin s LYS 81 Cb -0.09 0.17 -0.05 0.00 -1.51 0.00 0.00 37.83 36.35 1iin s LYS 81 CO 0.02 -0.08 0.40 0.08 -0.36 0.00 0.00 175.35 175.41 1iin s VAL 82 N -0.59 5.11 -0.42 4.02 1.01 -1.26 -2.50 120.40 125.77 1iin s VAL 82 Ca -0.07 0.80 -0.09 0.00 0.00 0.00 0.00 61.98 62.62 1iin s VAL 82 Cb -0.04 -3.71 0.08 0.00 0.00 0.00 0.00 36.38 32.70 1iin s VAL 82 CO 0.01 0.51 0.26 -1.58 0.00 0.00 0.00 175.10 174.30 1iin s GLN 83 N -0.54 2.61 0.24 2.72 0.74 0.78 -4.92 119.66 121.29 1iin s GLN 83 Ca 0.23 -1.45 -0.05 0.00 0.05 0.00 0.00 55.36 54.13 1iin s GLN 83 Cb -0.16 -3.78 0.43 0.00 1.10 0.00 0.00 33.01 30.60 1iin s GLN 83 CO 0.11 -0.95 1.73 -1.35 -0.55 0.00 0.00 175.29 174.28 1iin h PRO 84 N 8.41 0.40 -4.04 1.67 0.11 -1.97 -3.40 132.00 133.18 1iin h PRO 84 Ca -0.23 -0.02 -0.28 0.00 0.11 0.00 0.00 66.00 65.58 1iin h PRO 84 Cb 1.08 -0.09 -0.28 0.00 0.11 0.00 0.00 31.00 31.82 1iin h PRO 84 CO 0.76 0.26 -0.74 0.45 -0.21 0.00 0.00 178.00 178.52 1iin s SER 85 N -5.34 0.33 -1.12 -2.05 0.15 -1.26 -4.86 113.70 99.55 1iin s SER 85 Ca -0.13 -0.05 -0.20 0.00 0.70 0.00 0.00 55.95 56.27 1iin s SER 85 Cb 0.20 -0.04 -0.06 0.00 -1.71 0.00 0.00 66.02 64.41 1iin s SER 85 CO 0.76 0.03 1.94 -0.81 1.20 0.00 0.00 173.24 176.36 1iin n PRO 86 N 3.02 2.10 -0.09 5.44 -0.04 -1.26 -4.77 135.00 139.39 1iin n PRO 86 Ca -0.13 -2.46 0.05 0.00 -0.04 0.00 0.00 63.50 60.93 1iin n PRO 86 Cb 0.59 -3.35 0.18 0.00 -0.04 0.00 0.00 33.50 30.88 1iin n PRO 86 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1iin n ASP 87 N 9.61 1.08 0.00 3.54 8.00 -1.26 -4.98 116.55 132.54 1iin n ASP 87 Ca 0.48 -1.90 0.00 0.00 0.71 0.00 0.00 54.79 54.09 1iin n ASP 87 Cb 0.43 -0.12 0.00 0.00 -0.02 0.00 0.00 41.12 41.41 1iin n ASP 87 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1iin n GLY 88 N 0.87 3.72 0.37 0.44 0.00 -1.26 -0.34 105.19 108.98 1iin n GLY 88 Ca 0.09 -1.64 0.07 0.00 0.00 0.00 0.00 46.02 44.54 1iin n GLY 88 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1iin h LEU 89 N 0.00 0.85 -2.19 0.99 3.38 -1.92 -1.74 115.31 114.68 1iin h LEU 89 Ca 0.00 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1iin h LEU 89 Cb 0.00 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.60 1iin h LEU 89 CO 0.00 0.50 -0.06 0.00 0.09 0.00 0.00 178.44 178.97 1iin h ALA 90 N 1.54 1.42 0.00 1.53 0.00 -1.74 -1.51 119.26 120.50 1iin h ALA 90 Ca 0.43 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.28 1iin h ALA 90 Cb 0.39 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1iin h ALA 90 CO -0.19 0.08 0.00 0.37 0.00 0.00 0.00 179.25 179.51 1iin h GLN 91 N 0.00 0.00 -0.55 0.00 4.15 -1.53 -1.91 115.11 115.27 1iin h GLN 91 Ca -0.00 0.00 0.10 0.00 0.77 0.00 0.00 58.65 59.52 1iin h GLN 91 Cb 0.16 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 27.82 1iin h GLN 91 CO 0.01 0.00 0.37 0.00 -1.93 0.00 0.00 178.83 177.28 1iin h ALA 92 N 2.01 2.07 0.00 3.38 0.00 -1.42 -0.58 119.26 124.72 1iin h ALA 92 Ca 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1iin h ALA 92 Cb 0.16 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 1iin h ALA 92 CO 0.00 -0.20 -0.10 0.74 0.00 0.00 0.00 179.25 179.69 1iin h PHE 93 N 0.34 0.00 0.01 0.00 -1.00 -1.56 -0.23 116.94 114.49 1iin h PHE 93 Ca 0.26 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 61.02 1iin h PHE 93 Cb 0.56 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.12 1iin h PHE 93 CO -0.00 0.06 -0.06 0.82 -1.61 0.00 0.00 178.31 177.52 1iin h ILE 94 N 0.00 1.76 -0.73 -0.55 2.04 -1.39 -1.52 117.51 117.12 1iin h ILE 94 Ca -0.00 -2.31 -0.00 0.00 1.00 0.00 0.00 64.86 63.54 1iin h ILE 94 Cb 1.05 3.33 -0.04 0.00 -0.74 0.00 0.00 36.82 40.42 1iin h ILE 94 CO 0.01 0.61 0.44 0.40 0.00 0.00 0.00 178.15 179.60 1iin h ILE 95 N -0.93 1.20 -0.51 -0.67 2.04 -1.20 -2.42 117.51 115.02 1iin h ILE 95 Ca -0.01 -0.44 0.00 0.00 1.00 0.00 0.00 64.86 65.41 1iin h ILE 95 Cb 1.03 0.17 0.00 0.00 -0.74 0.00 0.00 36.82 37.28 1iin h ILE 95 CO 0.01 0.21 0.00 0.61 0.00 0.00 0.00 178.15 178.98 1iin n GLY 96 N -1.32 2.16 0.20 5.37 0.00 -0.10 -4.54 105.19 106.97 1iin n GLY 96 Ca 0.08 -0.67 -0.06 0.00 0.00 0.00 0.00 46.02 45.37 1iin n GLY 96 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1iin h GLU 97 N 3.22 -0.09 -0.83 1.61 4.81 -0.74 -0.54 114.58 122.02 1iin h GLU 97 Ca 0.00 0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.21 1iin h GLU 97 Cb 1.20 0.02 -0.04 0.00 0.63 0.00 0.00 28.75 30.56 1iin h GLU 97 CO 0.19 -0.06 0.40 1.49 -0.73 0.00 0.00 179.01 180.30 1iin h GLU 98 N -0.09 1.18 -0.58 1.92 4.81 -1.83 -1.35 114.58 118.64 1iin h GLU 98 Ca 0.17 -0.17 -0.02 0.00 -0.13 0.00 0.00 59.36 59.21 1iin h GLU 98 Cb 0.35 -0.22 -0.03 0.00 0.63 0.00 0.00 28.75 29.49 1iin h GLU 98 CO -0.39 0.90 0.28 0.35 -0.73 0.00 0.00 179.01 179.42 1iin h PHE 99 N 1.17 0.83 -0.37 0.92 3.57 -1.72 -3.11 116.94 118.23 1iin h PHE 99 Ca 0.29 -0.04 -0.06 0.00 3.53 0.00 0.00 57.97 61.69 1iin h PHE 99 Cb 0.10 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 38.57 1iin h PHE 99 CO 0.01 0.63 0.01 0.82 -2.23 0.00 0.00 178.31 177.56 1iin h ILE 100 N 0.78 1.25 0.00 1.41 2.04 -0.63 -3.48 117.51 118.89 1iin h ILE 100 Ca 0.20 -0.96 0.00 0.00 1.00 0.00 0.00 64.86 65.10 1iin h ILE 100 Cb 0.11 1.15 0.00 0.00 -0.74 0.00 0.00 36.82 37.34 1iin h ILE 100 CO -0.03 0.32 0.00 0.61 0.00 0.00 0.00 178.15 179.05 1iin n GLY 101 N -0.38 2.82 1.22 5.37 0.00 -0.55 -2.19 105.19 111.47 1iin n GLY 101 Ca -0.01 -0.26 0.11 0.00 0.00 0.00 0.00 46.02 45.85 1iin n GLY 101 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1iin n HIS 102 N 13.55 0.85 -2.71 1.61 8.25 -1.26 -5.00 115.22 130.52 1iin n HIS 102 Ca 0.00 -0.47 -0.21 0.00 -0.26 0.00 0.00 57.72 56.78 1iin n HIS 102 Cb 0.00 -0.00 0.04 0.00 1.12 0.00 0.00 29.99 31.15 1iin n HIS 102 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1iin s ASP 103 N -1.04 5.18 0.61 0.41 1.01 -0.93 -4.73 116.67 117.18 1iin s ASP 103 Ca 0.44 -0.18 -0.11 0.00 0.71 0.00 0.00 52.55 53.42 1iin s ASP 103 Cb 0.23 -0.64 -0.04 0.00 1.01 0.00 0.00 42.92 43.48 1iin s ASP 103 CO 0.30 -1.20 1.01 -1.81 0.21 0.00 0.00 175.17 173.68 1iin s ASP 104 N -4.47 6.23 -0.10 0.27 1.01 -1.26 -3.83 116.67 114.52 1iin s ASP 104 Ca 0.59 1.38 -0.17 0.00 0.71 0.00 0.00 52.55 55.05 1iin s ASP 104 Cb -0.09 -2.45 0.04 0.00 1.01 0.00 0.00 42.92 41.42 1iin s ASP 104 CO 0.38 -0.85 0.43 0.00 0.21 0.00 0.00 175.17 175.35 1iin s ALA 106 N -0.50 3.73 -0.08 0.00 0.00 -0.39 -0.76 121.76 123.76 1iin s ALA 106 Ca -0.06 -1.10 0.03 0.00 0.00 0.00 0.00 51.96 50.82 1iin s ALA 106 Cb -0.03 -1.54 0.01 0.00 0.00 0.00 0.00 23.12 21.56 1iin s ALA 106 CO 0.03 0.57 -0.15 -1.17 0.00 0.00 0.00 175.76 175.04 1iin s LEU 107 N -3.01 1.76 -0.02 0.00 2.96 0.31 -0.91 118.68 119.76 1iin s LEU 107 Ca 0.32 -0.38 0.02 0.00 -0.22 0.00 0.00 54.13 53.87 1iin s LEU 107 Cb -0.11 -1.00 0.01 0.00 0.50 0.00 0.00 46.19 45.59 1iin s LEU 107 CO 0.25 0.06 -0.06 0.54 -1.32 0.00 0.00 176.35 175.82 1iin s VAL 108 N 0.63 0.55 0.35 1.68 0.11 0.13 -0.80 120.40 123.05 1iin s VAL 108 Ca -0.15 -0.22 -0.27 0.00 -2.93 0.00 0.00 61.98 58.41 1iin s VAL 108 Cb -0.16 -0.52 -0.09 0.00 -1.53 0.00 0.00 36.38 34.08 1iin s VAL 108 CO 0.04 0.19 1.16 -0.76 -3.33 0.00 0.00 175.10 172.40 1iin s LEU 109 N 0.35 4.35 0.07 2.54 1.43 -0.21 -1.15 118.68 126.05 1iin s LEU 109 Ca -0.04 2.35 0.12 0.00 -1.03 0.00 0.00 54.13 55.53 1iin s LEU 109 Cb -0.09 -3.85 0.54 0.00 0.03 0.00 0.00 46.19 42.83 1iin s LEU 109 CO 0.00 -0.46 1.38 0.61 0.23 0.00 0.00 176.35 178.12 1iin n GLY 110 N 0.81 -0.88 0.73 -3.19 0.00 0.57 -2.06 105.19 101.17 1iin n GLY 110 Ca 0.02 0.01 0.09 0.00 0.00 0.00 0.00 46.02 46.13 1iin n GLY 110 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1iin n ASP 111 N -1.68 3.55 -4.53 1.61 5.68 -1.26 -4.21 116.55 115.71 1iin n ASP 111 Ca 0.02 -3.05 -0.42 0.00 -0.50 0.00 0.00 54.79 50.84 1iin n ASP 111 Cb 0.12 -0.52 -0.08 0.00 -1.14 0.00 0.00 41.12 39.50 1iin n ASP 111 CO 0.00 0.00 0.00 0.21 -1.33 0.00 0.00 177.20 176.08 1iin s ASN 112 N -2.14 6.29 -0.21 -1.12 3.84 -0.88 -4.73 114.94 115.99 1iin s ASN 112 Ca 0.40 -0.29 -0.01 0.00 0.21 0.00 0.00 52.86 53.17 1iin s ASN 112 Cb 0.33 -2.27 0.01 0.00 -0.55 0.00 0.00 41.25 38.77 1iin s ASN 112 CO 0.07 -0.60 -0.11 -0.63 -2.79 0.00 0.00 177.10 173.05 1iin s ILE 113 N 2.46 2.76 0.01 -5.21 1.01 -1.26 -3.67 121.20 117.29 1iin s ILE 113 Ca 0.18 -0.79 0.05 0.00 0.00 0.00 0.00 60.65 60.09 1iin s ILE 113 Cb -0.15 -2.26 -0.03 0.00 0.01 0.00 0.00 42.46 40.02 1iin s ILE 113 CO 0.15 0.41 -0.15 -0.36 0.00 0.00 0.00 174.94 174.99 1iin s PHE 114 N 1.37 2.66 -0.02 3.97 0.08 -1.26 -1.51 117.98 123.26 1iin s PHE 114 Ca 0.04 -0.19 -0.01 0.00 0.12 0.00 0.00 56.93 56.89 1iin s PHE 114 Cb -0.14 -1.54 0.02 0.00 -0.57 0.00 0.00 43.02 40.79 1iin s PHE 114 CO -0.07 0.25 0.04 -0.47 -0.10 0.00 0.00 175.22 174.87 1iin s TYR 115 N -0.87 -0.01 0.00 0.36 5.04 -0.25 -5.00 117.35 116.61 1iin s TYR 115 Ca 0.14 0.15 0.00 0.00 -2.44 0.00 0.00 57.07 54.92 1iin s TYR 115 Cb -0.11 -0.14 0.00 0.00 0.35 0.00 0.00 41.96 42.06 1iin s TYR 115 CO 0.04 -0.07 0.00 0.41 -1.34 0.00 0.00 175.55 174.59 1iin n GLY 116 N 3.82 1.71 3.76 8.97 0.00 -1.26 -0.73 105.19 121.46 1iin n GLY 116 Ca -0.23 -1.01 -0.40 0.00 0.00 0.00 0.00 46.02 44.39 1iin n GLY 116 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1iin s HIS 117 N -2.00 3.86 -1.27 1.61 2.46 -1.26 -4.06 115.29 114.63 1iin s HIS 117 Ca 0.00 1.62 -0.02 0.00 0.47 0.00 0.00 55.06 57.13 1iin s HIS 117 Cb 0.00 -2.82 0.00 0.00 -0.13 0.00 0.00 32.58 29.63 1iin s HIS 117 CO 0.00 0.42 0.32 -0.25 -2.47 0.00 0.00 174.74 172.76 1iin n ASP 118 N 2.01 -5.02 -0.36 9.88 8.00 -1.26 -4.92 116.55 124.89 1iin n ASP 118 Ca -0.04 -0.16 -0.03 0.00 0.71 0.00 0.00 54.79 55.28 1iin n ASP 118 Cb 0.49 -3.96 0.10 0.00 -0.02 0.00 0.00 41.12 37.74 1iin n ASP 118 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 1iin h LEU 119 N -0.73 1.10 -0.77 0.64 5.85 -2.00 -0.32 115.31 119.08 1iin h LEU 119 Ca -0.40 -0.03 0.02 0.00 0.84 0.00 0.00 57.88 58.31 1iin h LEU 119 Cb 1.28 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 42.00 1iin h LEU 119 CO 0.45 0.80 0.50 -0.65 -0.34 0.00 0.00 178.44 179.20 1iin h PRO 120 N 1.30 0.97 0.00 5.25 0.11 -1.91 -0.59 132.00 137.13 1iin h PRO 120 Ca 0.35 -0.06 -0.11 0.00 0.11 0.00 0.00 66.00 66.30 1iin h PRO 120 Cb -0.15 -0.22 -0.02 0.00 0.11 0.00 0.00 31.00 30.73 1iin h PRO 120 CO -0.08 0.64 -0.50 1.57 -0.21 0.00 0.00 178.00 179.42 1iin h LYS 121 N 1.00 0.00 -0.34 1.05 2.10 -1.83 -0.21 116.57 118.33 1iin h LYS 121 Ca 0.30 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.93 1iin h LYS 121 Cb -0.05 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.27 1iin h LYS 121 CO -0.09 0.50 0.14 1.25 -2.00 0.00 0.00 179.45 179.25 1iin h LEU 122 N 0.00 0.43 -0.53 7.07 6.46 0.14 -2.53 115.31 126.35 1iin h LEU 122 Ca -0.01 -0.04 0.00 0.00 -0.12 0.00 0.00 57.88 57.72 1iin h LEU 122 Cb 1.12 -0.11 0.00 0.00 -0.73 0.00 0.00 40.66 40.94 1iin h LEU 122 CO 0.07 0.40 -0.45 0.23 -0.62 0.00 0.00 178.44 178.06 1iin n MET 123 N -4.40 0.75 -0.18 1.25 2.81 -0.35 -4.55 117.12 112.45 1iin n MET 123 Ca 0.02 -0.53 -0.04 0.00 -1.81 0.00 0.00 57.70 55.34 1iin n MET 123 Cb 0.14 -1.49 0.06 0.00 -0.71 0.00 0.00 33.22 31.22 1iin n MET 123 CO 0.00 0.00 0.00 1.49 1.51 0.00 0.00 175.97 178.97 1iin h GLU 124 N 1.29 0.52 -0.13 0.03 4.81 -0.59 -1.23 114.58 119.29 1iin h GLU 124 Ca 0.00 -0.03 0.02 0.00 -0.13 0.00 0.00 59.36 59.22 1iin h GLU 124 Cb 0.58 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.83 1iin h GLU 124 CO 0.00 0.34 0.02 0.00 -0.73 0.00 0.00 179.01 178.64 1iin h ALA 125 N 1.29 0.12 -0.46 2.92 0.00 -1.80 -1.83 119.26 119.50 1iin h ALA 125 Ca 0.24 0.03 0.08 0.00 0.00 0.00 0.00 54.91 55.26 1iin h ALA 125 Cb 0.14 0.03 -0.07 0.00 0.00 0.00 0.00 17.79 17.90 1iin h ALA 125 CO -0.16 -0.43 0.03 0.00 0.00 0.00 0.00 179.25 178.68 1iin h ALA 126 N 1.09 0.45 -0.88 0.00 0.00 -1.72 0.30 119.26 118.50 1iin h ALA 126 Ca 0.06 0.12 0.01 0.00 0.00 0.00 0.00 54.91 55.10 1iin h ALA 126 Cb 0.05 0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 1iin h ALA 126 CO -0.08 -0.37 0.58 0.28 0.00 0.00 0.00 179.25 179.67 1iin h VAL 127 N 0.15 1.22 -0.01 0.00 2.07 -0.88 -3.00 116.25 115.79 1iin h VAL 127 Ca 0.23 -0.41 0.00 0.00 0.82 0.00 0.00 66.70 67.34 1iin h VAL 127 Cb 0.32 -0.07 0.00 0.00 -1.52 0.00 0.00 31.29 30.03 1iin h VAL 127 CO -0.35 0.22 -0.43 0.59 0.02 0.00 0.00 177.57 177.62 1iin n ASN 128 N -4.41 1.46 -4.69 0.57 3.02 -0.72 -0.38 115.26 110.11 1iin n ASN 128 Ca 0.10 -1.15 -0.44 0.00 -0.03 0.00 0.00 54.58 53.06 1iin n ASN 128 Cb 0.03 0.36 -0.03 0.00 -0.61 0.00 0.00 39.78 39.53 1iin n ASN 128 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 1iin n LYS 129 N -0.47 2.61 -0.13 3.52 4.81 0.10 -4.72 118.16 123.88 1iin n LYS 129 Ca 0.10 0.95 -0.05 0.00 -0.87 0.00 0.00 58.31 58.44 1iin n LYS 129 Cb 0.40 -2.81 0.04 0.00 0.02 0.00 0.00 35.03 32.67 1iin n LYS 129 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 1iin h GLU 130 N 8.08 0.26 -3.69 1.64 4.39 -1.89 -3.44 114.58 119.94 1iin h GLU 130 Ca -0.46 -0.02 -0.09 0.00 0.34 0.00 0.00 59.36 59.13 1iin h GLU 130 Cb 1.23 -0.06 -0.08 0.00 -0.10 0.00 0.00 28.75 29.74 1iin h GLU 130 CO 0.94 0.17 -0.10 -1.54 -1.16 0.00 0.00 179.01 177.31 1iin s SER 131 N -5.34 0.08 0.00 1.42 1.04 -1.26 -4.58 113.70 105.06 1iin s SER 131 Ca -0.13 -1.04 0.00 0.00 0.48 0.00 0.00 55.95 55.26 1iin s SER 131 Cb 0.13 0.62 0.00 0.00 0.10 0.00 0.00 66.02 66.87 1iin s SER 131 CO 0.72 -1.21 0.00 0.61 0.98 0.00 0.00 173.24 174.34 1iin n GLY 132 N -0.42 -0.30 3.20 7.32 0.00 -1.26 -4.97 105.19 108.77 1iin n GLY 132 Ca -0.02 -1.56 -0.09 0.00 0.00 0.00 0.00 46.02 44.35 1iin n GLY 132 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iin s ALA 133 N -1.61 -0.31 -0.03 4.61 0.00 -0.07 -1.85 121.76 122.50 1iin s ALA 133 Ca 0.00 -0.46 0.02 0.00 0.00 0.00 0.00 51.96 51.51 1iin s ALA 133 Cb 0.00 0.42 0.01 0.00 0.00 0.00 0.00 23.12 23.55 1iin s ALA 133 CO 0.00 -0.46 -0.06 0.99 0.00 0.00 0.00 175.76 176.23 1iin s THR 134 N -3.40 0.55 0.38 0.00 2.01 -0.40 -0.48 115.64 114.28 1iin s THR 134 Ca 0.01 -0.20 0.04 0.00 0.31 0.00 0.00 61.69 61.85 1iin s THR 134 Cb 0.03 -0.53 -0.05 0.00 0.01 0.00 0.00 72.50 71.96 1iin s THR 134 CO -0.09 0.20 0.07 0.68 -0.69 0.00 0.00 174.62 174.79 1iin s VAL 135 N 0.46 1.10 -0.07 3.82 -7.23 -0.46 -1.07 120.40 116.94 1iin s VAL 135 Ca -0.06 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.14 1iin s VAL 135 Cb -0.10 -2.62 0.01 0.00 0.56 0.00 0.00 36.38 34.23 1iin s VAL 135 CO 0.00 0.00 -0.15 -0.36 -0.31 0.00 0.00 175.10 174.28 1iin s PHE 136 N -3.17 1.71 -0.11 2.82 0.40 -1.26 -0.84 117.98 117.52 1iin s PHE 136 Ca 0.29 -0.61 -0.05 0.00 -0.60 0.00 0.00 56.93 55.96 1iin s PHE 136 Cb 0.06 -1.20 -0.04 0.00 0.51 0.00 0.00 43.02 42.36 1iin s PHE 136 CO 0.14 -0.27 0.08 0.00 0.70 0.00 0.00 175.22 175.87 1iin s ALA 137 N 0.45 3.63 -0.04 5.36 0.00 0.20 -1.05 121.76 130.31 1iin s ALA 137 Ca -0.13 -0.71 -0.01 0.00 0.00 0.00 0.00 51.96 51.11 1iin s ALA 137 Cb -0.15 -1.79 0.03 0.00 0.00 0.00 0.00 23.12 21.21 1iin s ALA 137 CO 0.04 0.56 0.08 -0.47 0.00 0.00 0.00 175.76 175.98 1iin s TYR 138 N -0.84 -0.06 -0.03 0.00 5.04 -0.37 -0.53 117.35 120.56 1iin s TYR 138 Ca 0.13 0.29 -0.30 0.00 -2.44 0.00 0.00 57.07 54.76 1iin s TYR 138 Cb -0.12 -0.15 -0.05 0.00 0.35 0.00 0.00 41.96 41.99 1iin s TYR 138 CO 0.03 -0.12 1.43 -1.58 -1.34 0.00 0.00 175.55 173.97 1iin s HIS 139 N 1.06 2.68 0.22 4.97 5.65 -1.26 -1.05 115.29 127.57 1iin s HIS 139 Ca -0.09 0.72 0.05 0.00 0.25 0.00 0.00 55.06 56.00 1iin s HIS 139 Cb -0.12 -3.69 -0.05 0.00 -1.18 0.00 0.00 32.58 27.54 1iin s HIS 139 CO -0.04 -2.61 -0.06 0.14 -0.65 0.00 0.00 174.74 171.52 1iin s VAL 140 N 2.88 1.34 -0.14 0.89 -7.23 0.52 -4.95 120.40 113.71 1iin s VAL 140 Ca 0.64 -2.09 0.18 0.00 -1.81 0.00 0.00 61.98 58.90 1iin s VAL 140 Cb -0.30 -2.22 0.15 0.00 0.56 0.00 0.00 36.38 34.57 1iin s VAL 140 CO 0.25 -0.45 1.56 -1.13 -0.31 0.00 0.00 175.10 175.02 1iin h ASN 141 N 2.50 0.00 -2.13 4.85 -0.73 -1.95 -3.39 115.58 114.73 1iin h ASN 141 Ca -0.38 0.00 -0.59 0.00 1.87 0.00 0.00 56.30 57.20 1iin h ASN 141 Cb 1.22 0.00 -0.41 0.00 0.27 0.00 0.00 38.32 39.40 1iin h ASN 141 CO 0.65 0.35 -0.77 -0.90 -0.37 0.00 0.00 177.43 176.39 1iin n ASP 142 N -3.24 2.62 0.12 1.15 5.75 -1.26 -4.94 116.55 116.75 1iin n ASP 142 Ca 0.02 -3.21 0.13 0.00 -0.01 0.00 0.00 54.79 51.72 1iin n ASP 142 Cb 0.63 -0.66 0.64 0.00 -1.03 0.00 0.00 41.12 40.71 1iin n ASP 142 CO 0.00 0.00 0.00 -0.65 -0.11 0.00 0.00 177.20 176.44 1iin h PRO 143 N 4.06 0.05 -0.47 0.11 0.11 -1.85 -2.39 132.00 131.61 1iin h PRO 143 Ca 0.16 -0.00 0.14 0.00 0.11 0.00 0.00 66.00 66.40 1iin h PRO 143 Cb 0.73 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 31.81 1iin h PRO 143 CO 0.71 0.03 0.40 0.93 -0.21 0.00 0.00 178.00 179.87 1iin h GLU 144 N 0.05 0.00 0.00 1.05 3.07 -1.92 0.38 114.58 117.21 1iin h GLU 144 Ca 0.13 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.99 1iin h GLU 144 Cb 0.44 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.35 1iin h GLU 144 CO -0.01 0.00 0.00 0.54 -1.40 0.00 0.00 179.01 178.14 1iin n ARG 145 N -4.05 0.22 -3.86 2.33 1.74 -0.90 -4.24 116.66 107.91 1iin n ARG 145 Ca 0.08 0.00 -0.20 0.00 -0.77 0.00 0.00 57.85 56.97 1iin n ARG 145 Cb 0.60 -1.50 -0.05 0.00 -1.02 0.00 0.00 32.46 30.49 1iin n ARG 145 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1iin n TYR 146 N -1.39 0.16 -2.55 -1.55 4.02 0.12 -4.82 117.16 111.15 1iin n TYR 146 Ca 0.11 -2.00 -0.42 0.00 -0.01 0.00 0.00 57.90 55.58 1iin n TYR 146 Cb 0.29 -0.02 -0.03 0.00 -0.02 0.00 0.00 39.34 39.55 1iin n TYR 146 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 1iin s GLY 147 N -2.94 2.73 -0.10 2.72 0.00 -1.26 -0.34 107.32 108.14 1iin s GLY 147 Ca 0.15 0.73 0.02 0.00 0.00 0.00 0.00 44.72 45.63 1iin s GLY 147 CO 0.10 1.77 -0.17 0.14 0.00 0.00 0.00 173.10 174.94 1iin s VAL 148 N 0.52 2.70 -0.12 1.40 1.01 0.16 -0.25 120.40 125.83 1iin s VAL 148 Ca 0.53 -0.81 -0.01 0.00 0.00 0.00 0.00 61.98 61.69 1iin s VAL 148 Cb -0.27 -2.08 -0.02 0.00 0.00 0.00 0.00 36.38 34.01 1iin s VAL 148 CO 0.31 0.55 -0.08 0.54 0.00 0.00 0.00 175.10 176.42 1iin s VAL 149 N 0.03 3.56 -0.10 2.92 0.11 -0.65 -1.14 120.40 125.13 1iin s VAL 149 Ca -0.06 -0.50 -0.02 0.00 -2.93 0.00 0.00 61.98 58.47 1iin s VAL 149 Cb -0.15 -2.50 -0.03 0.00 -1.53 0.00 0.00 36.38 32.17 1iin s VAL 149 CO 0.05 0.54 -0.00 -0.70 -3.33 0.00 0.00 175.10 171.66 1iin s GLU 150 N -0.06 3.08 0.11 1.54 2.12 -0.22 -4.50 118.70 120.77 1iin s GLU 150 Ca -0.00 -0.42 0.09 0.00 0.36 0.00 0.00 54.97 55.00 1iin s GLU 150 Cb -0.13 -2.82 -0.04 0.00 0.26 0.00 0.00 34.13 31.40 1iin s GLU 150 CO 0.03 0.64 -0.19 -0.06 -0.54 0.00 0.00 175.26 175.15 1iin s PHE 151 N -0.72 2.53 0.00 5.30 0.40 -1.26 0.25 117.98 124.48 1iin s PHE 151 Ca 0.11 -0.27 0.00 0.00 -0.60 0.00 0.00 56.93 56.17 1iin s PHE 151 Cb -0.12 -1.35 0.00 0.00 0.51 0.00 0.00 43.02 42.06 1iin s PHE 151 CO 0.02 0.37 0.00 -0.40 0.70 0.00 0.00 175.22 175.91 1iin n ASP 152 N 0.89 0.00 -0.13 1.36 5.68 0.67 -4.89 116.55 120.13 1iin n ASP 152 Ca -0.16 -0.56 -0.09 0.00 -0.50 0.00 0.00 54.79 53.48 1iin n ASP 152 Cb 0.53 0.00 0.06 0.00 -1.14 0.00 0.00 41.12 40.57 1iin n ASP 152 CO 0.00 0.00 0.00 1.56 -1.33 0.00 0.00 177.20 177.43 1iin h GLN 153 N 0.00 0.89 0.00 0.11 7.50 -2.01 -1.99 115.11 119.61 1iin h GLN 153 Ca 0.00 -0.34 0.00 0.00 0.50 0.00 0.00 58.65 58.81 1iin h GLN 153 Cb 0.00 -0.05 0.00 0.00 0.05 0.00 0.00 27.48 27.48 1iin h GLN 153 CO 0.00 0.99 0.00 1.63 -1.50 0.00 0.00 178.83 179.95 1iin n LYS 154 N -4.13 0.06 -0.48 1.46 5.02 -1.26 -4.80 118.16 114.04 1iin n LYS 154 Ca 0.01 0.43 0.00 0.00 -2.02 0.00 0.00 58.31 56.72 1iin n LYS 154 Cb 0.42 -1.65 0.00 0.00 -0.02 0.00 0.00 35.03 33.77 1iin n LYS 154 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1iin n GLY 155 N -0.66 0.76 3.73 0.72 0.00 -0.75 -5.05 105.19 103.94 1iin n GLY 155 Ca 0.01 -0.05 -0.40 0.00 0.00 0.00 0.00 46.02 45.58 1iin n GLY 155 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1iin s THR 156 N -2.00 4.81 0.07 2.61 2.01 -1.26 -4.75 115.64 117.13 1iin s THR 156 Ca 0.00 1.69 -0.31 0.00 0.31 0.00 0.00 61.69 63.38 1iin s THR 156 Cb 0.00 -4.14 -0.07 0.00 0.01 0.00 0.00 72.50 68.29 1iin s THR 156 CO 0.00 0.30 1.43 0.00 -0.69 0.00 0.00 174.62 175.66 1iin s ALA 157 N 0.33 3.60 0.00 7.40 0.00 -1.26 -0.24 121.76 131.58 1iin s ALA 157 Ca 0.41 1.04 0.00 0.00 0.00 0.00 0.00 51.96 53.41 1iin s ALA 157 Cb -0.20 -3.58 0.00 0.00 0.00 0.00 0.00 23.12 19.34 1iin s ALA 157 CO 0.23 -0.78 0.39 1.33 0.00 0.00 0.00 175.76 176.93 1iin n VAL 158 N 4.31 0.11 -3.53 0.00 0.24 0.14 -4.91 118.33 114.69 1iin n VAL 158 Ca 0.13 -0.35 -0.12 0.00 -2.04 0.00 0.00 64.34 61.95 1iin n VAL 158 Cb 0.43 1.27 -0.04 0.00 -1.47 0.00 0.00 33.84 34.03 1iin n VAL 158 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1iin s SER 159 N -0.11 -0.47 -0.02 -1.34 1.04 -1.18 -4.98 113.70 106.63 1iin s SER 159 Ca 0.00 0.36 0.01 0.00 0.48 0.00 0.00 55.95 56.80 1iin s SER 159 Cb 0.00 0.42 0.02 0.00 0.10 0.00 0.00 66.02 66.56 1iin s SER 159 CO 0.00 -0.55 -0.01 -0.76 0.98 0.00 0.00 173.24 172.91 1iin s LEU 160 N -1.61 1.33 -0.01 2.42 1.43 -1.26 -1.06 118.68 119.93 1iin s LEU 160 Ca -0.03 -0.03 0.01 0.00 -1.03 0.00 0.00 54.13 53.05 1iin s LEU 160 Cb -0.00 -0.21 0.00 0.00 0.03 0.00 0.00 46.19 46.01 1iin s LEU 160 CO 0.00 -0.07 -0.02 -1.61 0.23 0.00 0.00 176.35 174.88 1iin s GLU 161 N 0.80 0.20 -0.31 1.70 2.02 -0.30 -4.96 118.70 117.87 1iin s GLU 161 Ca -0.08 -0.05 -0.23 0.00 0.02 0.00 0.00 54.97 54.63 1iin s GLU 161 Cb -0.11 -0.23 -0.00 0.00 0.10 0.00 0.00 34.13 33.89 1iin s GLU 161 CO -0.01 0.02 0.74 -2.00 0.02 0.00 0.00 175.26 174.03 1iin s GLU 162 N 0.13 3.95 -1.23 1.61 2.56 -1.26 0.36 118.70 124.80 1iin s GLU 162 Ca -0.01 0.51 -0.23 0.00 0.00 0.00 0.00 54.97 55.24 1iin s GLU 162 Cb -0.03 -3.73 0.01 0.00 2.00 0.00 0.00 34.13 32.39 1iin s GLU 162 CO -0.00 -0.65 0.65 1.63 -0.56 0.00 0.00 175.26 176.33 1iin n LYS 163 N 6.11 -1.06 -2.23 4.30 5.02 0.54 -4.91 118.16 125.94 1iin n LYS 163 Ca 0.02 0.27 -0.38 0.00 -2.02 0.00 0.00 58.31 56.21 1iin n LYS 163 Cb 0.48 -3.49 -0.01 0.00 -0.02 0.00 0.00 35.03 31.99 1iin n LYS 163 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1iin s PRO 164 N -6.74 3.84 0.37 1.97 0.04 -1.26 -4.93 135.00 128.29 1iin s PRO 164 Ca 0.39 1.85 0.18 0.00 0.04 0.00 0.00 61.00 63.46 1iin s PRO 164 Cb -0.18 -2.51 0.63 0.00 0.04 0.00 0.00 34.50 32.48 1iin s PRO 164 CO 0.92 -0.51 1.71 -0.07 0.04 0.00 0.00 177.00 179.09 1iin h LEU 165 N 2.25 0.00 -6.68 -3.56 3.38 -1.91 -3.33 115.31 105.46 1iin h LEU 165 Ca -0.49 0.00 -0.60 0.00 0.09 0.00 0.00 57.88 56.87 1iin h LEU 165 Cb 1.25 0.00 -0.40 0.00 0.09 0.00 0.00 40.66 41.59 1iin h LEU 165 CO 0.61 0.39 -0.76 0.00 0.09 0.00 0.00 178.44 178.77 1iin n GLN 166 N -3.50 1.19 -1.58 1.13 6.02 -1.26 -5.03 117.38 114.34 1iin n GLN 166 Ca -0.00 -3.93 -0.49 0.00 -0.01 0.00 0.00 57.00 52.57 1iin n GLN 166 Cb 0.53 -1.99 -0.04 0.00 1.02 0.00 0.00 30.24 29.76 1iin n GLN 166 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.06 173.75 1iin n PRO 167 N 2.18 1.18 0.00 -1.09 -0.02 -1.25 -4.85 135.00 131.15 1iin n PRO 167 Ca 0.25 0.42 0.15 0.00 -2.02 0.00 0.00 63.50 62.30 1iin n PRO 167 Cb 0.41 -1.95 0.78 0.00 -0.02 0.00 0.00 33.50 32.72 1iin n PRO 167 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1iin n LYS 168 N 1.89 0.79 -3.80 -0.52 5.02 -1.26 -4.89 118.16 115.38 1iin n LYS 168 Ca 0.15 -0.12 -0.03 0.00 -2.02 0.00 0.00 58.31 56.29 1iin n LYS 168 Cb 0.24 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.75 1iin n LYS 168 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1iin s SER 169 N -2.30 -0.09 -0.05 4.39 1.04 -1.26 -4.85 113.70 110.59 1iin s SER 169 Ca 0.36 -0.52 0.21 0.00 0.48 0.00 0.00 55.95 56.48 1iin s SER 169 Cb 0.21 0.48 0.68 0.00 0.10 0.00 0.00 66.02 67.50 1iin s SER 169 CO 0.42 -0.93 1.58 0.59 0.98 0.00 0.00 173.24 175.89 1iin n ASN 170 N -0.80 4.30 -4.55 7.02 3.02 -1.26 -4.83 115.26 118.15 1iin n ASN 170 Ca -0.05 -2.18 -0.42 0.00 -0.03 0.00 0.00 54.58 51.90 1iin n ASN 170 Cb 0.60 -0.53 -0.07 0.00 -0.61 0.00 0.00 39.78 39.17 1iin n ASN 170 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1iin s TYR 171 N -1.35 3.15 0.16 3.10 1.51 -1.26 -0.35 117.35 122.30 1iin s TYR 171 Ca 0.50 0.19 -0.09 0.00 -1.01 0.00 0.00 57.07 56.67 1iin s TYR 171 Cb 0.29 -3.07 -0.06 0.00 -0.11 0.00 0.00 41.96 39.01 1iin s TYR 171 CO 0.30 -0.63 0.46 0.00 -1.11 0.00 0.00 175.55 174.57 1iin s ALA 172 N 2.57 3.68 -0.26 3.71 0.00 -0.21 -1.64 121.76 129.61 1iin s ALA 172 Ca 0.21 -0.38 -0.19 0.00 0.00 0.00 0.00 51.96 51.60 1iin s ALA 172 Cb -0.15 -2.31 -0.02 0.00 0.00 0.00 0.00 23.12 20.64 1iin s ALA 172 CO 0.15 0.57 0.57 0.08 0.00 0.00 0.00 175.76 177.13 1iin s VAL 173 N -1.63 5.03 1.21 0.00 1.01 0.66 -1.23 120.40 125.44 1iin s VAL 173 Ca 0.41 1.01 -0.19 0.00 0.00 0.00 0.00 61.98 63.21 1iin s VAL 173 Cb -0.12 -3.88 0.29 0.00 0.00 0.00 0.00 36.38 32.66 1iin s VAL 173 CO 0.21 0.06 1.10 0.42 0.00 0.00 0.00 175.10 176.89 1iin s THR 174 N 2.39 1.59 -0.45 3.92 -4.23 -0.22 -4.58 115.64 114.06 1iin s THR 174 Ca 0.24 0.00 0.03 0.00 -1.18 0.00 0.00 61.69 60.78 1iin s THR 174 Cb -0.16 -2.46 0.24 0.00 1.34 0.00 0.00 72.50 71.46 1iin s THR 174 CO 0.09 0.00 1.10 0.61 -0.54 0.00 0.00 174.62 175.88 1iin n GLY 175 N -0.81 2.40 3.11 3.99 0.00 -1.26 -4.76 105.19 107.86 1iin n GLY 175 Ca 0.13 -0.33 -0.31 0.00 0.00 0.00 0.00 46.02 45.52 1iin n GLY 175 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1iin s LEU 176 N -0.98 1.93 0.02 0.99 2.96 -1.26 -1.05 118.68 121.29 1iin s LEU 176 Ca 0.18 -0.53 0.01 0.00 -0.22 0.00 0.00 54.13 53.57 1iin s LEU 176 Cb 0.14 -1.29 -0.02 0.00 0.50 0.00 0.00 46.19 45.53 1iin s LEU 176 CO 0.04 0.04 -0.05 -0.31 -1.32 0.00 0.00 176.35 174.75 1iin s TYR 177 N 0.97 0.42 -0.12 5.38 1.51 0.02 -4.15 117.35 121.37 1iin s TYR 177 Ca -0.05 -0.35 0.02 0.00 -1.01 0.00 0.00 57.07 55.68 1iin s TYR 177 Cb -0.15 -0.26 0.01 0.00 -0.11 0.00 0.00 41.96 41.45 1iin s TYR 177 CO -0.03 -0.09 -0.18 -0.06 -1.11 0.00 0.00 175.55 174.08 1iin s PHE 178 N -0.95 2.28 0.17 2.71 0.40 -0.23 -0.53 117.98 121.82 1iin s PHE 178 Ca -0.08 -1.10 0.07 0.00 -0.60 0.00 0.00 56.93 55.22 1iin s PHE 178 Cb -0.07 -1.60 -0.04 0.00 0.51 0.00 0.00 43.02 41.82 1iin s PHE 178 CO -0.00 -0.53 -0.15 0.71 0.70 0.00 0.00 175.22 175.95 1iin s TYR 179 N 0.88 1.62 0.54 0.36 1.51 0.06 -1.28 117.35 121.03 1iin s TYR 179 Ca -0.07 -0.56 0.00 0.00 -1.01 0.00 0.00 57.07 55.43 1iin s TYR 179 Cb -0.15 -0.79 0.11 0.00 -0.11 0.00 0.00 41.96 41.01 1iin s TYR 179 CO -0.01 0.27 0.73 -0.40 -1.11 0.00 0.00 175.55 175.04 1iin n ASP 180 N 0.02 1.06 0.08 2.29 5.68 -0.77 -1.48 116.55 123.44 1iin n ASP 180 Ca -0.11 -1.88 0.08 0.00 -0.50 0.00 0.00 54.79 52.38 1iin n ASP 180 Cb 0.59 -0.47 0.37 0.00 -1.14 0.00 0.00 41.12 40.47 1iin n ASP 180 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 1iin n ASN 181 N -2.89 0.35 0.07 -1.12 2.85 -1.25 -2.67 115.26 110.60 1iin n ASN 181 Ca 0.12 0.62 0.12 0.00 -0.11 0.00 0.00 54.58 55.33 1iin n ASN 181 Cb 0.44 -0.68 0.45 0.00 1.24 0.00 0.00 39.78 41.23 1iin n ASN 181 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 1iin n SER 182 N -1.93 0.43 0.24 1.20 3.41 -1.26 -3.46 113.62 112.24 1iin n SER 182 Ca 0.01 0.57 0.07 0.00 -0.26 0.00 0.00 58.87 59.26 1iin n SER 182 Cb 0.11 -0.67 0.59 0.00 -0.26 0.00 0.00 64.21 63.97 1iin n SER 182 CO 0.00 0.00 0.00 1.62 -0.16 0.00 0.00 175.04 176.50 1iin h VAL 183 N 0.00 1.05 0.31 -3.33 3.04 -1.89 -2.45 116.25 112.97 1iin h VAL 183 Ca 0.00 -0.22 -0.02 0.00 -1.01 0.00 0.00 66.70 65.45 1iin h VAL 183 Cb 0.47 1.11 0.00 0.00 -2.01 0.00 0.00 31.29 30.86 1iin h VAL 183 CO 0.00 0.07 -0.15 0.58 -1.01 0.00 0.00 177.57 177.06 1iin h VAL 184 N 0.01 0.71 -0.33 1.51 2.07 -1.83 0.12 116.25 118.51 1iin h VAL 184 Ca 0.00 -0.21 -0.11 0.00 0.82 0.00 0.00 66.70 67.21 1iin h VAL 184 Cb 0.11 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 30.70 1iin h VAL 184 CO 0.01 0.04 -0.24 -0.33 0.02 0.00 0.00 177.57 177.07 1iin h GLU 185 N -0.53 0.65 -0.61 1.57 4.39 -1.80 -1.52 114.58 116.73 1iin h GLU 185 Ca -0.04 -0.26 0.05 0.00 0.34 0.00 0.00 59.36 59.45 1iin h GLU 185 Cb 0.39 -0.03 -0.05 0.00 -0.10 0.00 0.00 28.75 28.96 1iin h GLU 185 CO 0.07 0.83 0.32 1.98 -1.16 0.00 0.00 179.01 181.05 1iin h MET 186 N 0.57 0.59 -0.40 2.33 4.05 -1.28 -1.89 114.93 118.90 1iin h MET 186 Ca 0.08 -0.04 -0.15 0.00 -0.28 0.00 0.00 59.70 59.31 1iin h MET 186 Cb 0.71 -0.13 -0.01 0.00 -0.80 0.00 0.00 31.60 31.37 1iin h MET 186 CO 0.05 0.39 -0.35 0.00 0.23 0.00 0.00 176.91 177.23 1iin h ALA 187 N 1.32 0.61 0.00 0.39 0.00 -0.32 -2.69 119.26 118.57 1iin h ALA 187 Ca 0.27 -0.44 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 1iin h ALA 187 Cb 0.16 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 1iin h ALA 187 CO -0.17 0.68 -0.00 0.87 0.00 0.00 0.00 179.25 180.62 1iin h LYS 188 N 0.77 0.00 -0.02 0.00 1.57 -0.80 -2.40 116.57 115.69 1iin h LYS 188 Ca 0.07 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1iin h LYS 188 Cb 0.94 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.25 1iin h LYS 188 CO 0.09 0.00 -0.02 -1.71 -0.57 0.00 0.00 179.45 177.25 1iin n ASN 189 N -3.12 2.04 -4.82 0.86 5.15 -0.75 -4.95 115.26 109.67 1iin n ASN 189 Ca -0.02 -1.66 -0.33 0.00 -0.60 0.00 0.00 54.58 51.96 1iin n ASN 189 Cb 0.14 0.01 -0.07 0.00 -0.53 0.00 0.00 39.78 39.34 1iin n ASN 189 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1iin s LEU 190 N -2.02 3.98 0.12 1.20 1.43 -0.91 -5.07 118.68 117.41 1iin s LEU 190 Ca 0.34 1.68 0.05 0.00 -1.03 0.00 0.00 54.13 55.17 1iin s LEU 190 Cb 0.21 -4.48 -0.04 0.00 0.03 0.00 0.00 46.19 41.91 1iin s LEU 190 CO 0.33 -0.33 0.03 -0.54 0.23 0.00 0.00 176.35 176.08 1iin s LYS 191 N -3.08 2.62 0.61 1.70 1.02 -1.26 -5.05 119.74 116.30 1iin s LYS 191 Ca 0.61 -0.89 -0.19 0.00 0.02 0.00 0.00 55.97 55.52 1iin s LYS 191 Cb -0.10 -2.54 -0.03 0.00 -0.52 0.00 0.00 37.83 34.65 1iin s LYS 191 CO 0.14 0.51 1.32 -1.25 -0.92 0.00 0.00 175.35 175.15 1iin s PRO 192 N -2.61 2.77 0.44 -1.68 0.04 -1.26 -4.78 135.00 127.93 1iin s PRO 192 Ca 0.27 2.13 -0.04 0.00 0.04 0.00 0.00 61.00 63.40 1iin s PRO 192 Cb -0.11 -2.00 0.09 0.00 0.04 0.00 0.00 34.50 32.53 1iin s PRO 192 CO 0.20 -1.44 0.60 -1.13 0.04 0.00 0.00 177.00 175.26 1iin n SER 193 N -1.58 0.40 0.20 6.66 3.41 -0.67 -4.82 113.62 117.23 1iin n SER 193 Ca 0.14 -1.43 0.10 0.00 -0.26 0.00 0.00 58.87 57.42 1iin n SER 193 Cb 0.47 -0.43 0.64 0.00 -0.26 0.00 0.00 64.21 64.64 1iin n SER 193 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1iin h ALA 194 N -1.16 2.08 -0.41 7.33 0.00 -1.96 0.11 119.26 125.26 1iin h ALA 194 Ca -0.20 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1iin h ALA 194 Cb 0.63 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1iin h ALA 194 CO 0.17 -0.11 0.00 2.89 0.00 0.00 0.00 179.25 182.20 1iin n ARG 195 N -4.51 2.31 -2.35 0.00 1.85 -1.26 -4.92 116.66 107.79 1iin n ARG 195 Ca -0.00 -1.62 -0.10 0.00 -1.00 0.00 0.00 57.85 55.13 1iin n ARG 195 Cb 0.19 -1.49 0.00 0.00 -1.05 0.00 0.00 32.46 30.11 1iin n ARG 195 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1iin n GLY 196 N 0.98 0.04 3.25 2.89 0.00 0.38 -5.04 105.19 107.68 1iin n GLY 196 Ca 0.15 -0.44 -0.19 0.00 0.00 0.00 0.00 46.02 45.54 1iin n GLY 196 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1iin s GLU 197 N -4.71 1.04 -0.53 1.61 2.02 -1.26 -4.76 118.70 112.10 1iin s GLU 197 Ca 0.06 -1.20 -0.25 0.00 0.02 0.00 0.00 54.97 53.59 1iin s GLU 197 Cb -0.02 -1.02 0.04 0.00 0.10 0.00 0.00 34.13 33.22 1iin s GLU 197 CO 0.07 0.21 0.98 -0.51 0.02 0.00 0.00 175.26 176.03 1iin s LEU 198 N -2.28 3.97 0.03 1.80 1.43 0.53 -1.67 118.68 122.50 1iin s LEU 198 Ca 0.08 -0.16 -0.30 0.00 -1.03 0.00 0.00 54.13 52.72 1iin s LEU 198 Cb -0.07 -2.98 -0.04 0.00 0.03 0.00 0.00 46.19 43.13 1iin s LEU 198 CO 0.04 -1.23 1.06 -1.61 0.23 0.00 0.00 176.35 174.83 1iin s GLU 199 N 4.07 4.52 0.32 1.70 0.41 -1.26 -2.27 118.70 126.19 1iin s GLU 199 Ca 0.34 1.55 0.12 0.00 -0.41 0.00 0.00 54.97 56.57 1iin s GLU 199 Cb -0.11 -3.41 0.51 0.00 -1.78 0.00 0.00 34.13 29.34 1iin s GLU 199 CO 0.22 -0.11 1.70 0.97 -0.49 0.00 0.00 175.26 177.55 1iin h ILE 200 N 4.65 1.34 -0.02 -1.63 6.09 -1.94 -2.45 117.51 123.55 1iin h ILE 200 Ca -0.41 -1.78 -0.06 0.00 -1.37 0.00 0.00 64.86 61.23 1iin h ILE 200 Cb 1.22 1.97 -0.01 0.00 0.47 0.00 0.00 36.82 40.47 1iin h ILE 200 CO 0.77 0.50 -0.28 0.74 -3.07 0.00 0.00 178.15 176.81 1iin h THR 201 N 0.00 1.21 -0.52 2.19 2.02 -1.99 -0.60 112.91 115.23 1iin h THR 201 Ca -0.01 -1.01 -0.13 0.00 0.77 0.00 0.00 66.41 66.04 1iin h THR 201 Cb 0.93 1.51 -0.02 0.00 -1.74 0.00 0.00 68.15 68.84 1iin h THR 201 CO 0.07 0.29 -0.17 0.44 0.37 0.00 0.00 175.52 176.52 1iin h ASP 202 N 0.04 1.04 0.04 4.18 3.32 -1.85 -0.48 116.42 122.71 1iin h ASP 202 Ca 0.00 -0.37 0.00 0.00 0.02 0.00 0.00 57.03 56.68 1iin h ASP 202 Cb 0.52 -0.29 -0.01 0.00 0.22 0.00 0.00 39.33 39.78 1iin h ASP 202 CO 0.04 1.18 -0.04 0.40 -1.72 0.00 0.00 179.24 179.09 1iin h ILE 203 N 0.89 0.90 -0.68 0.35 1.08 -1.24 -2.64 117.51 116.18 1iin h ILE 203 Ca 0.13 0.00 -0.02 0.00 -0.39 0.00 0.00 64.86 64.58 1iin h ILE 203 Cb 0.75 0.90 -0.03 0.00 -3.07 0.00 0.00 36.82 35.36 1iin h ILE 203 CO 0.06 0.00 0.36 0.78 -0.69 0.00 0.00 178.15 178.66 1iin h ASN 204 N -0.09 0.84 -0.52 1.72 2.35 -0.87 -2.52 115.58 116.49 1iin h ASN 204 Ca 0.01 -0.07 -0.06 0.00 -0.55 0.00 0.00 56.30 55.63 1iin h ASN 204 Cb 0.10 -0.21 -0.03 0.00 0.05 0.00 0.00 38.32 38.23 1iin h ASN 204 CO -0.02 0.69 0.11 -0.09 -1.65 0.00 0.00 177.43 176.47 1iin h ARG 205 N 0.95 0.89 0.50 0.81 2.43 -0.93 -0.69 114.38 118.33 1iin h ARG 205 Ca 0.24 -0.20 -0.02 0.00 -0.81 0.00 0.00 59.98 59.19 1iin h ARG 205 Cb 0.04 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.47 1iin h ARG 205 CO -0.04 0.81 -0.26 0.82 -1.51 0.00 0.00 179.97 179.79 1iin h ILE 206 N 0.85 0.46 -0.80 1.20 2.04 -1.09 -0.06 117.51 120.11 1iin h ILE 206 Ca 0.18 0.00 0.12 0.00 1.00 0.00 0.00 64.86 66.16 1iin h ILE 206 Cb 0.34 0.46 -0.08 0.00 -0.74 0.00 0.00 36.82 36.80 1iin h ILE 206 CO 0.00 0.00 0.42 1.88 0.00 0.00 0.00 178.15 180.45 1iin h TYR 207 N -0.70 0.75 0.10 1.37 -1.99 -1.31 -2.47 116.97 112.72 1iin h TYR 207 Ca -0.06 0.03 -0.01 0.00 2.00 0.00 0.00 58.73 60.69 1iin h TYR 207 Cb 0.55 -0.21 0.00 0.00 2.00 0.00 0.00 36.73 39.07 1iin h TYR 207 CO -0.06 0.24 -0.05 1.98 -0.00 0.00 0.00 178.16 180.27 1iin h MET 208 N 0.66 -0.13 -0.12 4.88 4.05 -0.66 0.93 114.93 124.54 1iin h MET 208 Ca 0.41 0.01 0.03 0.00 -0.28 0.00 0.00 59.70 59.88 1iin h MET 208 Cb 0.49 0.03 -0.00 0.00 -0.80 0.00 0.00 31.60 31.32 1iin h MET 208 CO -0.31 -0.07 0.11 0.93 0.23 0.00 0.00 176.91 177.80 1iin h GLU 209 N -0.16 0.00 -0.28 0.39 5.08 -0.64 0.34 114.58 119.31 1iin h GLU 209 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1iin h GLU 209 Cb 0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.37 1iin h GLU 209 CO 0.02 0.00 0.00 1.04 -1.00 0.00 0.00 179.01 179.07 1iin n GLN 210 N -4.05 1.94 -2.78 2.33 6.02 -0.93 -4.91 117.38 115.00 1iin n GLN 210 Ca -0.00 -1.43 -0.17 0.00 -0.01 0.00 0.00 57.00 55.38 1iin n GLN 210 Cb 0.22 -1.40 0.02 0.00 1.02 0.00 0.00 30.24 30.11 1iin n GLN 210 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1iin n GLY 211 N 1.21 -0.25 0.33 1.08 0.00 0.12 -4.90 105.19 102.78 1iin n GLY 211 Ca 0.16 -0.10 0.03 0.00 0.00 0.00 0.00 46.02 46.12 1iin n GLY 211 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1iin n ARG 212 N -3.18 1.38 -3.61 1.61 1.74 0.28 -4.99 116.66 109.88 1iin n ARG 212 Ca -0.10 -1.35 -0.37 0.00 -0.77 0.00 0.00 57.85 55.25 1iin n ARG 212 Cb 0.60 -1.15 -0.10 0.00 -1.02 0.00 0.00 32.46 30.79 1iin n ARG 212 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1iin s LEU 213 N -0.78 4.08 -0.17 0.55 2.96 -1.20 -0.89 118.68 123.24 1iin s LEU 213 Ca 0.11 0.10 -0.07 0.00 -0.22 0.00 0.00 54.13 54.05 1iin s LEU 213 Cb 0.06 -2.14 -0.04 0.00 0.50 0.00 0.00 46.19 44.57 1iin s LEU 213 CO 0.09 0.01 0.07 -0.44 -1.32 0.00 0.00 176.35 174.76 1iin s SER 214 N 1.31 5.72 -0.36 3.68 0.01 0.36 -4.92 113.70 119.50 1iin s SER 214 Ca 0.08 0.14 -0.04 0.00 1.31 0.00 0.00 55.95 57.44 1iin s SER 214 Cb -0.14 -1.94 0.07 0.00 0.21 0.00 0.00 66.02 64.22 1iin s SER 214 CO 0.07 0.22 0.12 -0.69 0.41 0.00 0.00 173.24 173.37 1iin s VAL 215 N 0.09 3.41 -0.12 3.43 1.01 -1.26 -1.36 120.40 125.61 1iin s VAL 215 Ca 0.06 -1.56 -0.22 0.00 0.00 0.00 0.00 61.98 60.26 1iin s VAL 215 Cb -0.12 -3.10 -0.03 0.00 0.00 0.00 0.00 36.38 33.13 1iin s VAL 215 CO 0.01 -0.37 0.66 0.00 0.00 0.00 0.00 175.10 175.39 1iin s ALA 216 N 1.27 3.43 0.06 5.51 0.00 -0.02 -4.89 121.76 127.12 1iin s ALA 216 Ca 0.01 -0.03 -0.28 0.00 0.00 0.00 0.00 51.96 51.66 1iin s ALA 216 Cb -0.21 -2.93 -0.05 0.00 0.00 0.00 0.00 23.12 19.93 1iin s ALA 216 CO -0.01 -0.24 0.89 -1.64 0.00 0.00 0.00 175.76 174.75 1iin s MET 217 N 1.16 4.60 -0.39 0.00 -1.94 -1.26 -0.62 119.30 120.84 1iin s MET 217 Ca 0.33 1.29 -0.08 0.00 -1.71 0.00 0.00 55.69 55.52 1iin s MET 217 Cb -0.17 -3.39 0.06 0.00 2.01 0.00 0.00 34.83 33.35 1iin s MET 217 CO 0.14 0.19 0.20 1.41 -0.01 0.00 0.00 175.02 176.95 1iin s MET 218 N 0.18 2.58 1.09 2.03 0.00 0.31 -4.87 119.30 120.62 1iin s MET 218 Ca 0.44 -1.37 -0.12 0.00 0.00 0.00 0.00 55.69 54.65 1iin s MET 218 Cb -0.22 -3.66 0.24 0.00 0.00 0.00 0.00 34.83 31.20 1iin s MET 218 CO 0.27 -0.85 1.07 0.20 0.00 0.00 0.00 175.02 175.70 1iin s GLY 219 N 1.83 1.59 0.04 2.11 0.00 -1.26 -4.50 107.32 107.13 1iin s GLY 219 Ca 0.02 0.15 0.12 0.00 0.00 0.00 0.00 44.72 45.01 1iin s GLY 219 CO 0.02 0.77 1.37 -0.96 0.00 0.00 0.00 173.10 174.30 1iin n ARG 220 N -4.75 0.03 0.00 2.90 1.85 -1.26 -1.71 116.66 113.72 1iin n ARG 220 Ca 0.06 0.36 0.09 0.00 -1.00 0.00 0.00 57.85 57.36 1iin n ARG 220 Cb 0.53 -1.56 0.43 0.00 -1.05 0.00 0.00 32.46 30.82 1iin n ARG 220 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1iin n GLY 221 N -0.49 -1.13 3.86 2.89 0.00 -1.26 -4.73 105.19 104.34 1iin n GLY 221 Ca 0.02 -0.07 -0.30 0.00 0.00 0.00 0.00 46.02 45.67 1iin n GLY 221 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1iin s TYR 222 N -2.92 3.38 -0.13 1.61 1.51 -0.69 -4.69 117.35 115.41 1iin s TYR 222 Ca 0.11 0.17 -0.01 0.00 -1.01 0.00 0.00 57.07 56.33 1iin s TYR 222 Cb 0.13 -1.69 -0.02 0.00 -0.11 0.00 0.00 41.96 40.26 1iin s TYR 222 CO 0.35 0.56 -0.09 0.00 -1.11 0.00 0.00 175.55 175.26 1iin s ALA 223 N -1.49 2.81 -0.47 3.71 0.00 0.09 -4.96 121.76 121.46 1iin s ALA 223 Ca 0.33 -0.86 0.01 0.00 0.00 0.00 0.00 51.96 51.43 1iin s ALA 223 Cb -0.12 -1.35 0.12 0.00 0.00 0.00 0.00 23.12 21.77 1iin s ALA 223 CO 0.26 0.28 0.24 -0.46 0.00 0.00 0.00 175.76 176.07 1iin s TRP 224 N 0.19 3.49 -0.08 0.00 -0.00 -1.26 -1.09 118.94 120.19 1iin s TRP 224 Ca -0.05 -2.82 -0.30 0.00 -0.00 0.00 0.00 56.10 52.93 1iin s TRP 224 Cb -0.14 -3.05 -0.04 0.00 -0.00 0.00 0.00 33.47 30.24 1iin s TRP 224 CO 0.04 -0.88 1.38 -0.51 -0.00 0.00 0.00 176.95 176.98 1iin s LEU 225 N 0.45 4.26 0.42 5.86 1.43 -0.57 -4.99 118.68 125.54 1iin s LEU 225 Ca 0.13 1.95 -0.24 0.00 -1.03 0.00 0.00 54.13 54.94 1iin s LEU 225 Cb -0.22 -3.55 -0.08 0.00 0.03 0.00 0.00 46.19 42.37 1iin s LEU 225 CO -0.04 -0.76 1.16 -0.62 0.23 0.00 0.00 176.35 176.33 1iin s ASP 226 N 2.16 6.39 -0.05 2.29 2.15 -1.26 -4.34 116.67 124.01 1iin s ASP 226 Ca 0.61 2.32 0.07 0.00 0.43 0.00 0.00 52.55 55.99 1iin s ASP 226 Cb -0.27 -2.61 0.11 0.00 -0.30 0.00 0.00 42.92 39.85 1iin s ASP 226 CO 0.22 -0.77 1.05 0.35 -0.17 0.00 0.00 175.17 175.86 1iin n THR 227 N -0.15 0.73 0.46 1.71 -2.24 -1.26 -4.29 114.28 109.24 1iin n THR 227 Ca 0.05 -0.87 0.13 0.00 -2.27 0.00 0.00 64.05 61.09 1iin n THR 227 Cb 0.47 0.23 0.43 0.00 -2.10 0.00 0.00 70.33 69.36 1iin n THR 227 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1iin h GLY 228 N 0.00 0.00 -2.62 3.38 0.00 -1.92 -3.45 103.07 98.46 1iin h GLY 228 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 47.33 47.09 1iin h GLY 228 CO 0.00 0.00 -0.62 -0.51 0.00 0.00 0.00 176.54 175.41 1iin s THR 229 N -3.24 0.05 0.22 4.70 -4.23 -1.26 -4.80 115.64 107.08 1iin s THR 229 Ca 0.07 -1.99 -0.09 0.00 -1.18 0.00 0.00 61.69 58.51 1iin s THR 229 Cb 0.10 -2.44 0.18 0.00 1.34 0.00 0.00 72.50 71.68 1iin s THR 229 CO 0.54 -0.07 1.87 0.45 -0.54 0.00 0.00 174.62 176.87 1iin h HIS 230 N 2.64 1.07 -0.09 3.99 3.86 -1.92 -1.03 115.15 123.69 1iin h HIS 230 Ca -0.36 0.01 -0.00 0.00 -1.16 0.00 0.00 60.37 58.85 1iin h HIS 230 Cb 1.24 -0.36 -0.00 0.00 1.06 0.00 0.00 27.41 29.35 1iin h HIS 230 CO 0.37 0.71 0.04 0.37 0.86 0.00 0.00 177.93 180.28 1iin h GLN 231 N 1.13 0.12 -0.19 2.45 5.75 -1.99 -2.36 115.11 120.03 1iin h GLN 231 Ca 0.30 -0.02 -0.05 0.00 -0.15 0.00 0.00 58.65 58.73 1iin h GLN 231 Cb -0.07 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 28.44 1iin h GLN 231 CO -0.06 0.19 -0.12 0.66 -2.65 0.00 0.00 178.83 176.85 1iin h SER 232 N 0.03 0.28 -0.47 -0.69 4.64 -1.74 -1.62 113.55 113.97 1iin h SER 232 Ca 0.03 -0.06 -0.06 0.00 -0.47 0.00 0.00 61.79 61.23 1iin h SER 232 Cb 0.10 -0.07 -0.02 0.00 -0.31 0.00 0.00 62.40 62.10 1iin h SER 232 CO -0.00 0.43 0.04 -0.07 -0.87 0.00 0.00 176.83 176.36 1iin h LEU 233 N 0.28 0.78 -0.87 5.97 3.38 -0.98 0.19 115.31 124.06 1iin h LEU 233 Ca 0.06 -0.28 -0.12 0.00 0.09 0.00 0.00 57.88 57.63 1iin h LEU 233 Cb 0.39 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 1iin h LEU 233 CO 0.02 0.87 -0.54 -0.29 0.09 0.00 0.00 178.44 178.59 1iin h ILE 234 N 0.67 1.38 -0.15 1.22 2.10 -1.08 -1.81 117.51 119.84 1iin h ILE 234 Ca 0.14 -1.86 -0.12 0.00 1.08 0.00 0.00 64.86 64.10 1iin h ILE 234 Cb 0.44 1.98 -0.01 0.00 -1.09 0.00 0.00 36.82 38.14 1iin h ILE 234 CO 0.02 0.54 -0.44 -0.33 -1.08 0.00 0.00 178.15 176.85 1iin h GLU 235 N 0.05 0.35 -0.42 2.19 5.08 -0.90 -1.50 114.58 119.43 1iin h GLU 235 Ca -0.00 -0.18 -0.10 0.00 -1.00 0.00 0.00 59.36 58.08 1iin h GLU 235 Cb 0.97 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.22 1iin h GLU 235 CO 0.07 0.72 -0.11 0.00 -1.00 0.00 0.00 179.01 178.70 1iin h ALA 236 N 1.25 0.58 -0.55 3.43 0.00 -0.63 -1.03 119.26 122.31 1iin h ALA 236 Ca 0.02 -0.33 -0.03 0.00 0.00 0.00 0.00 54.91 54.57 1iin h ALA 236 Cb 0.89 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 1iin h ALA 236 CO 0.07 0.47 0.21 0.77 0.00 0.00 0.00 179.25 180.78 1iin h SER 237 N 0.65 0.76 -0.74 0.00 0.02 -1.14 -1.41 113.55 111.70 1iin h SER 237 Ca 0.11 -0.17 -0.06 0.00 -0.84 0.00 0.00 61.79 60.82 1iin h SER 237 Cb 0.65 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.96 1iin h SER 237 CO 0.04 0.73 0.22 0.78 -1.14 0.00 0.00 176.83 177.46 1iin h ASN 238 N 0.75 1.09 0.28 3.07 2.35 -1.18 0.18 115.58 122.11 1iin h ASN 238 Ca 0.18 -0.21 -0.01 0.00 -0.55 0.00 0.00 56.30 55.71 1iin h ASN 238 Cb 0.21 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 38.30 1iin h ASN 238 CO -0.01 1.01 -0.15 0.15 -1.65 0.00 0.00 177.43 176.78 1iin h PHE 239 N 1.11 -0.39 -0.88 1.19 3.57 -0.92 0.13 116.94 120.75 1iin h PHE 239 Ca 0.24 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.72 1iin h PHE 239 Cb 0.32 0.13 -0.04 0.00 2.79 0.00 0.00 35.95 39.15 1iin h PHE 239 CO 0.03 -0.24 0.49 0.82 -2.23 0.00 0.00 178.31 177.18 1iin h ILE 240 N -0.40 1.25 -0.53 1.41 1.08 -1.13 -2.17 117.51 117.02 1iin h ILE 240 Ca -0.04 -0.61 -0.03 0.00 -0.39 0.00 0.00 64.86 63.80 1iin h ILE 240 Cb 0.32 0.05 -0.02 0.00 -3.07 0.00 0.00 36.82 34.10 1iin h ILE 240 CO 0.05 0.28 0.23 0.00 -0.69 0.00 0.00 178.15 178.02 1iin h ALA 241 N 1.27 0.68 -0.79 1.87 0.00 -0.66 -0.95 119.26 120.68 1iin h ALA 241 Ca 0.31 -0.14 0.01 0.00 0.00 0.00 0.00 54.91 55.09 1iin h ALA 241 Cb 0.01 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.55 1iin h ALA 241 CO -0.05 0.27 0.52 1.15 0.00 0.00 0.00 179.25 181.15 1iin h THR 242 N 0.71 1.20 0.10 0.00 2.02 -0.35 -1.04 112.91 115.54 1iin h THR 242 Ca 0.18 -0.37 -0.00 0.00 0.77 0.00 0.00 66.41 66.99 1iin h THR 242 Cb 0.16 0.04 0.00 0.00 -1.74 0.00 0.00 68.15 66.61 1iin h THR 242 CO -0.02 0.20 -0.05 0.40 0.37 0.00 0.00 175.52 176.42 1iin h ILE 243 N 1.07 1.09 -0.48 3.11 2.04 -1.21 -2.99 117.51 120.14 1iin h ILE 243 Ca 0.29 -0.74 -0.04 0.00 1.00 0.00 0.00 64.86 65.37 1iin h ILE 243 Cb -0.12 1.56 -0.02 0.00 -0.74 0.00 0.00 36.82 37.50 1iin h ILE 243 CO -0.07 0.18 0.14 -0.33 0.00 0.00 0.00 178.15 178.07 1iin h GLU 244 N -0.48 0.76 -0.27 2.37 5.08 -1.02 -1.74 114.58 119.28 1iin h GLU 244 Ca -0.01 -0.17 -0.09 0.00 -1.00 0.00 0.00 59.36 58.09 1iin h GLU 244 Cb 0.40 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.53 1iin h GLU 244 CO 0.02 0.72 -0.20 0.93 -1.00 0.00 0.00 179.01 179.49 1iin h GLU 245 N 0.65 0.50 -0.18 2.33 4.39 -1.30 0.46 114.58 121.42 1iin h GLU 245 Ca 0.15 -0.17 -0.06 0.00 0.34 0.00 0.00 59.36 59.62 1iin h GLU 245 Cb 0.29 -0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 28.90 1iin h GLU 245 CO -0.00 0.68 -0.13 -0.09 -1.16 0.00 0.00 179.01 178.30 1iin h ARG 246 N 0.45 0.41 0.00 2.33 9.65 -1.37 -3.31 114.38 122.54 1iin h ARG 246 Ca 0.07 -0.20 -0.13 0.00 -1.10 0.00 0.00 59.98 58.62 1iin h ARG 246 Cb 0.60 -0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 29.16 1iin h ARG 246 CO 0.04 0.74 -0.72 1.96 2.80 0.00 0.00 179.97 184.80 1iin h GLN 247 N 0.07 0.00 -0.59 0.20 4.20 -1.08 -3.47 115.11 114.43 1iin h GLN 247 Ca 0.03 0.00 -0.12 0.00 0.06 0.00 0.00 58.65 58.63 1iin h GLN 247 Cb 0.65 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.40 1iin h GLN 247 CO 0.04 0.55 -0.13 0.41 -0.67 0.00 0.00 178.83 179.03 1iin n GLY 248 N 1.27 0.44 3.22 3.46 0.00 0.16 -5.02 105.19 108.71 1iin n GLY 248 Ca -0.00 -0.71 -0.13 0.00 0.00 0.00 0.00 46.02 45.18 1iin n GLY 248 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1iin s LEU 249 N -1.53 2.51 0.12 0.99 1.43 -1.15 -5.06 118.68 115.99 1iin s LEU 249 Ca 0.00 -0.99 0.03 0.00 -1.03 0.00 0.00 54.13 52.14 1iin s LEU 249 Cb 0.00 -0.25 -0.04 0.00 0.03 0.00 0.00 46.19 45.93 1iin s LEU 249 CO 0.00 -0.37 0.16 -0.54 0.23 0.00 0.00 176.35 175.84 1iin s LYS 250 N -3.67 3.09 -0.17 1.70 1.02 -1.26 -4.24 119.74 116.21 1iin s LYS 250 Ca 0.14 -0.70 -0.08 0.00 0.02 0.00 0.00 55.97 55.35 1iin s LYS 250 Cb 0.03 -2.79 -0.04 0.00 -0.52 0.00 0.00 37.83 34.50 1iin s LYS 250 CO -0.01 0.53 0.11 0.08 -0.92 0.00 0.00 175.35 175.14 1iin s VAL 251 N -1.61 5.25 -1.26 3.17 1.01 -1.26 -4.59 120.40 121.11 1iin s VAL 251 Ca 0.32 0.13 -0.09 0.00 0.00 0.00 0.00 61.98 62.33 1iin s VAL 251 Cb -0.11 -3.35 -0.01 0.00 0.00 0.00 0.00 36.38 32.91 1iin s VAL 251 CO 0.25 0.50 0.66 -1.20 0.00 0.00 0.00 175.10 175.31 1iin n SER 252 N 3.04 -2.87 -4.44 3.32 7.64 -1.26 -4.95 113.62 114.09 1iin n SER 252 Ca -0.17 -0.96 -0.44 0.00 1.01 0.00 0.00 58.87 58.31 1iin n SER 252 Cb 0.53 -3.47 -0.08 0.00 -1.01 0.00 0.00 64.21 60.18 1iin n SER 252 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1iin h PRO 254 N 8.80 0.43 -0.65 0.00 0.11 -1.93 -0.83 132.00 137.93 1iin h PRO 254 Ca -0.27 -0.03 0.04 0.00 0.11 0.00 0.00 66.00 65.85 1iin h PRO 254 Cb 1.11 -0.10 -0.04 0.00 0.11 0.00 0.00 31.00 32.08 1iin h PRO 254 CO 0.86 0.28 0.39 0.93 -0.21 0.00 0.00 178.00 180.26 1iin h GLU 255 N 0.44 0.74 -0.41 1.05 3.07 -1.97 0.20 114.58 117.71 1iin h GLU 255 Ca 0.34 -0.04 -0.10 0.00 -0.50 0.00 0.00 59.36 59.06 1iin h GLU 255 Cb 0.45 -0.17 -0.01 0.00 -0.84 0.00 0.00 28.75 28.18 1iin h GLU 255 CO -0.33 0.49 -0.12 1.49 -1.40 0.00 0.00 179.01 179.14 1iin h GLU 256 N 0.76 0.80 -0.68 2.33 4.81 -1.81 -1.16 114.58 119.63 1iin h GLU 256 Ca 0.27 -0.32 -0.07 0.00 -0.13 0.00 0.00 59.36 59.11 1iin h GLU 256 Cb 0.06 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.37 1iin h GLU 256 CO -0.12 0.94 0.15 0.82 -0.73 0.00 0.00 179.01 180.06 1iin h ILE 257 N 0.61 1.26 -0.63 2.32 2.04 -0.69 0.19 117.51 122.61 1iin h ILE 257 Ca 0.10 -0.99 -0.01 0.00 1.00 0.00 0.00 64.86 64.96 1iin h ILE 257 Cb 0.65 0.59 -0.03 0.00 -0.74 0.00 0.00 36.82 37.29 1iin h ILE 257 CO 0.04 0.38 0.35 0.00 0.00 0.00 0.00 178.15 178.92 1iin h ALA 258 N 1.07 0.81 0.06 1.87 0.00 -0.48 -0.32 119.26 122.27 1iin h ALA 258 Ca 0.21 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 1iin h ALA 258 Cb 0.39 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1iin h ALA 258 CO 0.01 0.32 -0.03 0.35 0.00 0.00 0.00 179.25 179.90 1iin h PHE 259 N 0.86 -0.08 -0.53 0.00 3.57 -0.78 0.81 116.94 120.78 1iin h PHE 259 Ca 0.22 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.72 1iin h PHE 259 Cb 0.04 0.03 -0.03 0.00 2.79 0.00 0.00 35.95 38.78 1iin h PHE 259 CO -0.01 0.22 0.33 0.00 -2.23 0.00 0.00 178.31 176.62 1iin h ARG 260 N -0.38 0.71 -0.37 1.11 2.47 -0.39 0.28 114.38 117.80 1iin h ARG 260 Ca -0.01 -0.05 0.00 0.00 -1.26 0.00 0.00 59.98 58.66 1iin h ARG 260 Cb 0.33 -0.16 0.00 0.00 -1.65 0.00 0.00 29.97 28.50 1iin h ARG 260 CO 0.01 0.49 0.00 1.63 0.56 0.00 0.00 179.97 182.66 1iin n LYS 261 N -4.44 1.92 -2.81 0.04 5.02 -0.15 -4.92 118.16 112.81 1iin n LYS 261 Ca 0.05 -1.42 -0.20 0.00 -2.02 0.00 0.00 58.31 54.72 1iin n LYS 261 Cb 0.06 -1.33 0.02 0.00 -0.02 0.00 0.00 35.03 33.77 1iin n LYS 261 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1iin n ASN 262 N 0.65 -5.57 0.19 4.39 3.02 0.09 -4.88 115.26 113.14 1iin n ASN 262 Ca 0.14 -0.21 0.08 0.00 -0.03 0.00 0.00 54.58 54.56 1iin n ASN 262 Cb 0.34 -4.45 0.20 0.00 -0.61 0.00 0.00 39.78 35.27 1iin n ASN 262 CO 0.00 0.00 0.00 -0.26 -2.62 0.00 0.00 177.26 174.38 1iin h PHE 263 N -0.99 0.00 -4.10 3.10 0.05 0.43 -3.46 116.94 111.97 1iin h PHE 263 Ca -0.47 0.00 -0.15 0.00 3.82 0.00 0.00 57.97 61.17 1iin h PHE 263 Cb 1.33 0.00 -0.12 0.00 2.00 0.00 0.00 35.95 39.16 1iin h PHE 263 CO 0.47 0.27 -0.35 0.96 -0.18 0.00 0.00 178.31 179.48 1iin s ILE 264 N -3.23 0.00 0.50 -0.55 -4.36 -1.08 -4.35 121.20 108.12 1iin s ILE 264 Ca 0.04 -1.69 0.05 0.00 -0.26 0.00 0.00 60.65 58.79 1iin s ILE 264 Cb 0.08 -2.36 0.00 0.00 1.25 0.00 0.00 42.46 41.43 1iin s ILE 264 CO 0.69 0.00 0.23 0.54 0.24 0.00 0.00 174.94 176.64 1iin s ASN 265 N -3.09 4.44 0.26 4.36 2.20 -1.26 -4.49 114.94 117.36 1iin s ASN 265 Ca 0.30 -1.31 -0.01 0.00 -0.94 0.00 0.00 52.86 50.90 1iin s ASN 265 Cb 0.03 0.21 0.54 0.00 -2.00 0.00 0.00 41.25 40.03 1iin s ASN 265 CO 0.11 -0.89 1.74 0.00 -2.94 0.00 0.00 177.10 175.12 1iin h ALA 266 N 1.09 1.22 -0.32 3.54 0.00 -1.99 -0.92 119.26 121.88 1iin h ALA 266 Ca -0.40 0.11 0.01 0.00 0.00 0.00 0.00 54.91 54.63 1iin h ALA 266 Cb 1.29 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 19.12 1iin h ALA 266 CO 0.65 -0.18 0.19 1.96 0.00 0.00 0.00 179.25 181.87 1iin h GLN 267 N 0.51 0.38 -0.79 0.00 7.50 -2.00 0.20 115.11 120.92 1iin h GLN 267 Ca 0.46 -0.02 -0.04 0.00 0.50 0.00 0.00 58.65 59.55 1iin h GLN 267 Cb 0.72 -0.09 -0.04 0.00 0.05 0.00 0.00 27.48 28.12 1iin h GLN 267 CO -0.41 0.25 0.34 1.96 -1.50 0.00 0.00 178.83 179.47 1iin h GLN 268 N 0.39 1.17 -0.43 1.46 4.20 -1.74 -2.52 115.11 117.64 1iin h GLN 268 Ca 0.13 -0.20 0.01 0.00 0.06 0.00 0.00 58.65 58.64 1iin h GLN 268 Cb -0.00 -0.20 -0.02 0.00 0.30 0.00 0.00 27.48 27.56 1iin h GLN 268 CO -0.06 0.93 0.29 0.28 -0.67 0.00 0.00 178.83 179.60 1iin h VAL 269 N 1.14 1.11 -0.81 -0.54 2.07 -0.48 -1.89 116.25 116.85 1iin h VAL 269 Ca 0.27 -0.20 0.05 0.00 0.82 0.00 0.00 66.70 67.64 1iin h VAL 269 Cb 0.18 0.47 -0.05 0.00 -1.52 0.00 0.00 31.29 30.37 1iin h VAL 269 CO -0.03 0.11 0.53 0.40 0.02 0.00 0.00 177.57 178.60 1iin h ILE 270 N 0.59 1.07 -0.04 4.57 2.04 -0.57 -1.06 117.51 124.11 1iin h ILE 270 Ca 0.16 -0.32 -0.00 0.00 1.00 0.00 0.00 64.86 65.70 1iin h ILE 270 Cb -0.06 0.06 -0.00 0.00 -0.74 0.00 0.00 36.82 36.08 1iin h ILE 270 CO -0.04 0.17 0.01 -0.33 0.00 0.00 0.00 178.15 177.96 1iin h GLU 271 N 0.93 0.06 -0.22 2.37 5.08 -1.09 -2.81 114.58 118.90 1iin h GLU 271 Ca 0.34 -0.02 0.04 0.00 -1.00 0.00 0.00 59.36 58.72 1iin h GLU 271 Cb 0.16 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 1iin h GLU 271 CO -0.11 0.30 0.15 -0.07 -1.00 0.00 0.00 179.01 178.28 1iin h LEU 272 N -0.18 0.12 -0.90 1.33 3.38 -0.82 -1.97 115.31 116.27 1iin h LEU 272 Ca 0.01 -0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.89 1iin h LEU 272 Cb 0.27 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 1iin h LEU 272 CO 0.00 0.09 -0.17 0.00 0.09 0.00 0.00 178.44 178.45 1iin h ALA 273 N 1.88 1.07 -0.03 1.53 0.00 -0.95 -3.35 119.26 119.41 1iin h ALA 273 Ca 0.10 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1iin h ALA 273 Cb 0.20 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1iin h ALA 273 CO -0.01 0.57 0.00 0.41 0.00 0.00 0.00 179.25 180.21 1iin n GLY 274 N -0.44 -2.78 0.15 0.00 0.00 -0.74 -0.85 105.19 100.54 1iin n GLY 274 Ca 0.00 0.52 0.10 0.00 0.00 0.00 0.00 46.02 46.65 1iin n GLY 274 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1iin n PRO 275 N -2.86 0.12 0.00 1.61 -0.02 -1.26 -1.88 135.00 130.72 1iin n PRO 275 Ca 0.00 0.62 0.08 0.00 -2.02 0.00 0.00 63.50 62.18 1iin n PRO 275 Cb 0.00 -1.94 0.06 0.00 -0.02 0.00 0.00 33.50 31.60 1iin n PRO 275 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1iin n LEU 276 N -2.18 2.25 0.00 2.45 4.77 -0.03 -4.68 117.00 119.58 1iin n LEU 276 Ca -0.01 -0.96 0.05 0.00 -0.03 0.00 0.00 56.01 55.06 1iin n LEU 276 Cb 0.06 0.00 0.29 0.00 -2.33 0.00 0.00 43.42 41.43 1iin n LEU 276 CO 0.09 0.40 0.50 -1.54 -1.33 0.00 0.00 177.39 175.51 1iin n SER 277 N 0.75 0.00 -0.09 -1.43 3.41 -0.40 -0.81 113.62 115.05 1iin n SER 277 Ca 0.09 -0.41 0.14 0.00 -0.26 0.00 0.00 58.87 58.44 1iin n SER 277 Cb 0.40 0.00 0.60 0.00 -0.26 0.00 0.00 64.21 64.95 1iin n SER 277 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1iin n LYS 278 N -0.93 0.56 -4.22 4.33 5.02 -1.26 -4.61 118.16 117.06 1iin n LYS 278 Ca 0.07 -0.18 -0.19 0.00 -2.02 0.00 0.00 58.31 55.99 1iin n LYS 278 Cb 0.03 -1.50 -0.07 0.00 -0.02 0.00 0.00 35.03 33.48 1iin n LYS 278 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 1iin n ASN 279 N -1.06 -0.82 0.22 4.39 0.23 -1.11 -5.02 115.26 112.09 1iin n ASN 279 Ca 0.13 -3.17 0.18 0.00 -0.53 0.00 0.00 54.58 51.19 1iin n ASN 279 Cb 0.28 1.83 0.83 0.00 -2.08 0.00 0.00 39.78 40.64 1iin n ASN 279 CO 0.00 0.00 0.00 -0.78 -0.93 0.00 0.00 177.26 175.55 1iin h ASP 280 N 2.06 0.00 0.64 0.53 -0.00 -1.91 -2.91 116.42 114.83 1iin h ASP 280 Ca -0.24 0.00 -0.03 0.00 -0.00 0.00 0.00 57.03 56.76 1iin h ASP 280 Cb 1.21 0.00 0.01 0.00 -0.00 0.00 0.00 39.33 40.55 1iin h ASP 280 CO 0.35 0.00 -0.31 0.22 -0.00 0.00 0.00 179.24 179.50 1iin h TYR 281 N 0.00 -0.80 -0.50 0.28 3.20 -1.96 0.60 116.97 117.79 1iin h TYR 281 Ca 0.09 -0.02 -0.08 0.00 3.14 0.00 0.00 58.73 61.86 1iin h TYR 281 Cb 0.70 0.26 -0.02 0.00 1.54 0.00 0.00 36.73 39.22 1iin h TYR 281 CO 0.00 -0.45 -0.02 0.78 -1.64 0.00 0.00 178.16 176.83 1iin h GLY 282 N -1.08 0.92 1.27 1.82 0.00 -0.85 -1.92 103.07 103.24 1iin h GLY 282 Ca -0.09 -0.64 -0.10 0.00 0.00 0.00 0.00 47.33 46.50 1iin h GLY 282 CO 0.14 0.59 -0.10 0.50 0.00 0.00 0.00 176.54 177.68 1iin h LYS 283 N 0.79 0.86 0.02 4.80 1.57 -1.51 -1.58 116.57 121.53 1iin h LYS 283 Ca 0.15 -0.29 0.01 0.00 -1.87 0.00 0.00 60.65 58.65 1iin h LYS 283 Cb 0.50 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.73 1iin h LYS 283 CO 0.02 0.92 -0.07 -0.92 -0.57 0.00 0.00 179.45 178.83 1iin h TYR 284 N 0.77 -0.19 -0.35 -1.35 3.20 0.72 0.03 116.97 119.80 1iin h TYR 284 Ca 0.13 0.00 0.03 0.00 3.14 0.00 0.00 58.73 62.03 1iin h TYR 284 Cb 0.61 0.08 -0.03 0.00 1.54 0.00 0.00 36.73 38.93 1iin h TYR 284 CO 0.03 -0.12 0.16 -0.07 -1.64 0.00 0.00 178.16 176.53 1iin h LEU 285 N -0.14 0.23 -0.47 2.82 3.38 -1.08 -0.10 115.31 119.94 1iin h LEU 285 Ca 0.02 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1iin h LEU 285 Cb 0.17 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 1iin h LEU 285 CO -0.06 0.17 0.31 -0.07 0.09 0.00 0.00 178.44 178.88 1iin h LEU 286 N 0.34 0.55 -1.00 1.67 3.38 -1.06 -1.98 115.31 117.21 1iin h LEU 286 Ca 0.15 -0.02 0.01 0.00 0.09 0.00 0.00 57.88 58.11 1iin h LEU 286 Cb 0.08 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 40.64 1iin h LEU 286 CO -0.12 0.40 0.66 0.50 0.09 0.00 0.00 178.44 179.98 1iin h LYS 287 N 0.64 1.30 -0.30 1.13 3.64 -0.64 -2.80 116.57 119.53 1iin h LYS 287 Ca 0.17 -0.08 0.07 0.00 -1.27 0.00 0.00 60.65 59.54 1iin h LYS 287 Cb -0.06 -0.29 -0.08 0.00 -0.41 0.00 0.00 32.23 31.39 1iin h LYS 287 CO -0.04 0.86 -0.22 1.98 -2.27 0.00 0.00 179.45 179.77 1iin h MET 288 N 1.34 -0.18 -0.03 1.90 4.05 -0.26 -3.51 114.93 118.23 1iin h MET 288 Ca 0.37 0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.80 1iin h MET 288 Cb -0.13 0.04 0.00 0.00 -0.80 0.00 0.00 31.60 30.71 1iin h MET 288 CO -0.09 -0.12 0.00 1.33 0.23 0.00 0.00 176.91 178.26