#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 4.44 -0.10 3.17 1.02 -1.26 -4.65 119.74 122.36 1iin s LYS 2 Ca 0.00 1.42 -0.30 0.00 0.02 0.00 0.00 55.97 57.11 1iin s LYS 2 Cb 0.00 -2.73 -0.03 0.00 -0.52 0.00 0.00 37.83 34.55 1iin s LYS 2 CO 0.00 0.13 1.35 0.99 -0.92 0.00 0.00 175.35 176.90 1iin s THR 3 N -1.61 4.06 -0.01 2.17 2.01 0.09 -4.86 115.64 117.49 1iin s THR 3 Ca 0.53 1.33 0.01 0.00 0.31 0.00 0.00 61.69 63.86 1iin s THR 3 Cb -0.20 -3.86 0.01 0.00 0.01 0.00 0.00 72.50 68.46 1iin s THR 3 CO 0.26 -0.08 0.80 0.54 -0.69 0.00 0.00 174.62 175.45 1iin n ARG 4 N 6.32 1.56 -4.51 4.92 5.12 -1.26 -4.72 116.66 124.09 1iin n ARG 4 Ca 0.14 -1.11 -0.24 0.00 -1.93 0.00 0.00 57.85 54.70 1iin n ARG 4 Cb 0.44 -0.80 -0.14 0.00 -1.16 0.00 0.00 32.46 30.81 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 -0.63 1.25 0.05 5.56 1.02 -1.26 -3.55 119.74 122.18 1iin s LYS 5 Ca 0.01 -0.97 -0.06 0.00 0.02 0.00 0.00 55.97 54.98 1iin s LYS 5 Cb 0.01 -1.38 -0.01 0.00 -0.52 0.00 0.00 37.83 35.93 1iin s LYS 5 CO 0.00 0.34 0.11 0.20 -0.92 0.00 0.00 175.35 175.08 1iin s GLY 6 N -1.35 0.17 -0.07 -3.33 0.00 -0.60 -1.11 107.32 101.02 1iin s GLY 6 Ca 0.06 -0.60 0.04 0.00 0.00 0.00 0.00 44.72 44.22 1iin s GLY 6 CO 0.02 -0.74 -0.18 -0.42 0.00 0.00 0.00 173.10 171.78 1iin s ILE 7 N -2.93 1.58 -0.29 0.90 1.01 -0.27 -1.01 121.20 120.19 1iin s ILE 7 Ca -0.02 -0.76 -0.06 0.00 0.00 0.00 0.00 60.65 59.81 1iin s ILE 7 Cb 0.01 -1.38 0.01 0.00 0.01 0.00 0.00 42.46 41.10 1iin s ILE 7 CO -0.06 0.45 0.07 -0.63 0.00 0.00 0.00 174.94 174.77 1iin s ILE 8 N 0.36 3.90 -0.54 2.92 1.01 -0.19 -0.81 121.20 127.85 1iin s ILE 8 Ca -0.13 -0.71 -0.21 0.00 0.00 0.00 0.00 60.65 59.60 1iin s ILE 8 Cb -0.15 -3.01 0.06 0.00 0.01 0.00 0.00 42.46 39.36 1iin s ILE 8 CO 0.05 0.09 0.75 -0.22 0.00 0.00 0.00 174.94 175.61 1iin s LEU 9 N 1.49 4.70 -0.37 2.97 2.96 -0.77 -0.90 118.68 128.76 1iin s LEU 9 Ca 0.02 -0.79 0.09 0.00 -0.22 0.00 0.00 54.13 53.24 1iin s LEU 9 Cb -0.17 -2.55 0.44 0.00 0.50 0.00 0.00 46.19 44.42 1iin s LEU 9 CO 0.02 -1.05 1.11 0.00 -1.32 0.00 0.00 176.35 175.11 1iin n ALA 10 N 6.68 4.61 -2.30 5.97 0.00 0.19 -0.73 120.51 134.93 1iin n ALA 10 Ca -0.04 -3.88 0.00 0.00 0.00 0.00 0.00 53.44 49.52 1iin n ALA 10 Cb 0.46 -0.56 0.00 0.00 0.00 0.00 0.00 19.45 19.34 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 -0.49 2.88 0.00 0.00 0.00 -1.22 -4.50 105.19 101.86 1iin n GLY 11 Ca 0.33 -1.81 0.00 0.00 0.00 0.00 0.00 46.02 44.54 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 -0.13 0.10 -0.02 0.00 -1.26 -4.81 105.19 104.07 1iin n GLY 12 Ca 0.00 -1.62 0.08 0.00 0.00 0.00 0.00 46.02 44.48 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 -0.87 0.80 -0.41 1.61 3.41 -1.26 -4.87 113.62 112.03 1iin n SER 13 Ca 0.00 0.32 -0.04 0.00 -0.26 0.00 0.00 58.87 58.89 1iin n SER 13 Cb 0.00 0.46 -0.01 0.00 -0.26 0.00 0.00 64.21 64.40 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 1.24 0.41 0.41 5.00 0.00 -1.26 -4.85 105.19 106.14 1iin n GLY 14 Ca -0.03 -0.78 0.22 0.00 0.00 0.00 0.00 46.02 45.43 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 0.67 -0.13 2.61 1.35 -1.93 0.16 112.91 115.63 1iin h THR 15 Ca -0.09 -0.06 0.04 0.00 -0.55 0.00 0.00 66.41 65.75 1iin h THR 15 Cb 0.74 0.49 -0.01 0.00 -1.73 0.00 0.00 68.15 67.64 1iin h THR 15 CO 0.12 0.03 0.15 0.03 -0.25 0.00 0.00 175.52 175.60 1iin h ARG 16 N 0.16 0.00 -0.33 4.72 -0.00 -1.93 -2.44 114.38 114.57 1iin h ARG 16 Ca 0.38 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.86 1iin h ARG 16 Cb 1.26 0.00 0.00 0.00 0.00 0.00 0.00 29.97 31.23 1iin h ARG 16 CO -0.06 0.00 0.00 1.28 0.00 0.00 0.00 179.97 181.19 1iin n LEU 17 N -3.80 2.95 -4.67 3.04 4.77 0.04 -4.88 117.00 114.45 1iin n LEU 17 Ca 0.00 -1.70 -0.38 0.00 -0.03 0.00 0.00 56.01 53.90 1iin n LEU 17 Cb 0.26 -0.22 0.05 0.00 -2.33 0.00 0.00 43.42 41.18 1iin n LEU 17 CO 0.27 0.69 0.74 -1.22 -1.33 0.00 0.00 177.39 176.54 1iin n TYR 18 N 0.87 1.49 1.65 -1.77 4.01 -0.92 -1.79 117.16 120.69 1iin n TYR 18 Ca 0.14 0.44 0.15 0.00 -0.16 0.00 0.00 57.90 58.47 1iin n TYR 18 Cb 0.45 -2.24 0.70 0.00 -0.31 0.00 0.00 39.34 37.95 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 -1.02 1.13 -0.19 -0.72 -0.04 -1.26 -4.88 135.00 128.01 1iin n PRO 19 Ca 0.13 -0.39 0.00 0.00 -0.04 0.00 0.00 63.50 63.19 1iin n PRO 19 Cb 0.46 -1.49 0.10 0.00 -0.04 0.00 0.00 33.50 32.53 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 0.96 0.69 -0.08 0.52 2.07 -1.75 -0.84 116.25 117.82 1iin h VAL 20 Ca 0.00 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.42 1iin h VAL 20 Cb 0.28 0.37 0.00 0.00 -1.52 0.00 0.00 31.29 30.41 1iin h VAL 20 CO 0.00 0.05 0.00 0.35 0.02 0.00 0.00 177.57 177.99 1iin n THR 21 N -5.09 0.11 0.08 2.57 -2.24 -1.20 -2.56 114.28 105.94 1iin n THR 21 Ca 0.08 -0.16 -0.09 0.00 -2.27 0.00 0.00 64.05 61.62 1iin n THR 21 Cb 0.30 0.01 -0.10 0.00 -2.10 0.00 0.00 70.33 68.44 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 0.93 0.08 0.00 -0.78 2.86 -1.46 -3.36 114.93 113.20 1iin h MET 22 Ca 0.00 -0.13 -0.22 0.00 -2.06 0.00 0.00 59.70 57.29 1iin h MET 22 Cb 0.20 0.05 -0.04 0.00 0.06 0.00 0.00 31.60 31.87 1iin h MET 22 CO 0.00 1.03 -1.56 0.00 1.06 0.00 0.00 176.91 177.44 1iin n ALA 23 N -2.41 1.76 -3.21 6.32 0.00 -1.13 -4.95 120.51 116.89 1iin n ALA 23 Ca -0.02 -0.65 -0.13 0.00 0.00 0.00 0.00 53.44 52.64 1iin n ALA 23 Cb 0.93 -0.90 -0.12 0.00 0.00 0.00 0.00 19.45 19.36 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 -2.79 -0.01 0.35 0.00 1.01 -1.06 -5.13 120.40 112.76 1iin s VAL 24 Ca -0.04 0.03 -0.28 0.00 0.00 0.00 0.00 61.98 61.69 1iin s VAL 24 Cb 0.08 -0.30 -0.12 0.00 0.00 0.00 0.00 36.38 36.04 1iin s VAL 24 CO 0.82 0.01 1.31 -0.24 0.00 0.00 0.00 175.10 177.00 1iin n SER 25 N 3.22 2.85 -0.25 3.32 2.88 -1.26 -4.13 113.62 120.24 1iin n SER 25 Ca -0.15 1.20 0.03 0.00 -1.33 0.00 0.00 58.87 58.62 1iin n SER 25 Cb 0.57 -1.50 0.16 0.00 -0.75 0.00 0.00 64.21 62.69 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 2.56 0.56 0.00 -1.46 4.15 -1.90 -1.75 115.11 117.27 1iin h GLN 26 Ca -0.47 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 58.92 1iin h GLN 26 Cb 1.28 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 28.84 1iin h GLN 26 CO 0.62 0.37 0.00 1.04 -1.93 0.00 0.00 178.83 178.94 1iin n GLN 27 N -4.89 0.72 0.00 1.69 3.00 -1.26 -1.55 117.38 115.09 1iin n GLN 27 Ca 0.12 0.00 0.07 0.00 -0.01 0.00 0.00 57.00 57.19 1iin n GLN 27 Cb 0.32 -1.46 0.00 0.00 0.00 0.00 0.00 30.24 29.10 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 -0.96 1.63 -4.77 1.08 4.77 -0.67 -1.04 117.00 117.04 1iin n LEU 28 Ca 0.16 -0.79 -0.41 0.00 -0.03 0.00 0.00 56.01 54.94 1iin n LEU 28 Cb 0.07 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.15 1iin n LEU 28 CO 0.12 0.31 1.05 -0.76 -1.33 0.00 0.00 177.39 176.78 1iin s LEU 29 N -1.91 4.38 0.31 2.23 1.43 -0.59 -4.41 118.68 120.12 1iin s LEU 29 Ca 0.13 2.85 -0.28 0.00 -1.03 0.00 0.00 54.13 55.80 1iin s LEU 29 Cb 0.12 -3.66 -0.09 0.00 0.03 0.00 0.00 46.19 42.59 1iin s LEU 29 CO 0.36 -0.69 1.11 -2.16 0.23 0.00 0.00 176.35 175.21 1iin s PRO 30 N -1.91 4.50 -0.57 1.29 0.04 -1.26 -0.13 135.00 136.97 1iin s PRO 30 Ca 0.51 1.79 0.03 0.00 0.04 0.00 0.00 61.00 63.36 1iin s PRO 30 Cb -0.43 -3.04 0.14 0.00 0.04 0.00 0.00 34.50 31.21 1iin s PRO 30 CO 0.57 0.09 0.33 0.42 0.04 0.00 0.00 177.00 178.45 1iin s ILE 31 N -1.26 2.86 0.00 0.56 -1.09 -0.28 -4.84 121.20 117.15 1iin s ILE 31 Ca 0.48 -3.38 0.00 0.00 -2.23 0.00 0.00 60.65 55.52 1iin s ILE 31 Cb -0.31 -2.94 0.00 0.00 -1.58 0.00 0.00 42.46 37.63 1iin s ILE 31 CO 0.39 -0.84 0.00 0.00 -1.23 0.00 0.00 174.94 173.26 1iin n TYR 32 N 3.03 0.00 -0.25 3.97 9.36 -1.26 -3.40 117.16 128.61 1iin n TYR 32 Ca 0.07 0.00 0.09 0.00 3.32 0.00 0.00 57.90 61.38 1iin n TYR 32 Cb 0.33 0.00 0.24 0.00 -0.63 0.00 0.00 39.34 39.28 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 5.89 3.46 -3.51 2.98 5.75 -1.26 -5.00 116.55 124.85 1iin n ASP 33 Ca 0.00 -1.99 -0.15 0.00 -0.01 0.00 0.00 54.79 52.64 1iin n ASP 33 Cb 0.00 -0.36 -0.05 0.00 -1.03 0.00 0.00 41.12 39.68 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 -1.02 1.11 0.54 0.11 -2.85 -1.22 -5.03 119.74 111.38 1iin s LYS 34 Ca 0.37 -0.10 -0.22 0.00 -1.00 0.00 0.00 55.97 55.02 1iin s LYS 34 Cb 0.19 0.51 -0.06 0.00 -2.06 0.00 0.00 37.83 36.42 1iin s LYS 34 CO 0.25 -0.41 1.27 -0.35 0.10 0.00 0.00 175.35 176.22 1iin n PRO 35 N 0.40 1.56 -0.31 1.78 -0.04 -1.26 -1.12 135.00 136.00 1iin n PRO 35 Ca -0.18 0.58 0.09 0.00 -0.04 0.00 0.00 63.50 63.95 1iin n PRO 35 Cb 0.60 -2.47 0.26 0.00 -0.04 0.00 0.00 33.50 31.85 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 1.34 0.63 0.00 0.54 1.85 -0.54 -1.31 114.93 117.44 1iin h MET 36 Ca -0.50 -0.04 -0.00 0.00 -0.61 0.00 0.00 59.70 58.55 1iin h MET 36 Cb 1.31 -0.14 -0.00 0.00 0.43 0.00 0.00 31.60 33.20 1iin h MET 36 CO 0.56 0.41 -0.02 0.97 -0.40 0.00 0.00 176.91 178.44 1iin h ILE 37 N 0.65 0.28 -0.06 1.77 2.10 -1.26 -0.92 117.51 120.06 1iin h ILE 37 Ca 0.51 -0.11 0.02 0.00 1.08 0.00 0.00 64.86 66.36 1iin h ILE 37 Cb 0.76 1.08 -0.00 0.00 -1.09 0.00 0.00 36.82 37.57 1iin h ILE 37 CO -0.38 0.02 0.05 1.88 -1.08 0.00 0.00 178.15 178.63 1iin h TYR 38 N 0.00 0.00 0.56 2.19 -1.99 -1.53 -2.26 116.97 113.94 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 0.08 0.00 0.01 0.00 2.00 0.00 0.00 36.73 38.81 1iin h TYR 38 CO 0.00 0.00 -0.27 1.88 -0.00 0.00 0.00 178.16 179.77 1iin h TYR 39 N 0.00 -0.70 0.00 4.88 -1.99 -1.33 -0.64 116.97 117.20 1iin h TYR 39 Ca 0.03 -0.02 -0.03 0.00 2.00 0.00 0.00 58.73 60.72 1iin h TYR 39 Cb 0.13 0.23 -0.00 0.00 2.00 0.00 0.00 36.73 39.08 1iin h TYR 39 CO 0.00 -0.41 -0.12 -1.00 -0.00 0.00 0.00 178.16 176.63 1iin h PRO 40 N -1.17 0.00 -0.52 4.88 0.13 -1.57 -1.56 132.00 132.19 1iin h PRO 40 Ca -0.08 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.03 1iin h PRO 40 Cb 0.60 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.70 1iin h PRO 40 CO 0.13 0.12 0.25 1.25 -0.23 0.00 0.00 178.00 179.51 1iin h LEU 41 N 0.00 0.68 -0.98 1.56 5.85 -1.38 -2.12 115.31 118.92 1iin h LEU 41 Ca -0.00 -0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.58 1iin h LEU 41 Cb 0.23 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 41.04 1iin h LEU 41 CO 0.02 0.63 0.56 0.28 -0.34 0.00 0.00 178.44 179.58 1iin h SER 42 N 0.69 1.12 -0.23 1.25 0.02 -0.35 -1.17 113.55 114.88 1iin h SER 42 Ca 0.18 -0.07 0.02 0.00 -0.84 0.00 0.00 61.79 61.08 1iin h SER 42 Cb 0.13 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.36 1iin h SER 42 CO -0.02 0.86 0.09 0.74 -1.14 0.00 0.00 176.83 177.35 1iin h THR 43 N 1.29 0.95 -0.70 -2.27 2.02 -0.84 0.24 112.91 113.60 1iin h THR 43 Ca 0.33 -0.07 -0.00 0.00 0.77 0.00 0.00 66.41 67.44 1iin h THR 43 Cb -0.05 0.74 -0.03 0.00 -1.74 0.00 0.00 68.15 67.06 1iin h THR 43 CO -0.06 0.04 0.42 -0.07 0.37 0.00 0.00 175.52 176.22 1iin h LEU 44 N 0.20 0.84 -1.22 2.58 3.38 -1.02 -2.33 115.31 117.74 1iin h LEU 44 Ca 0.10 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1iin h LEU 44 Cb 0.06 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 1iin h LEU 44 CO -0.10 0.65 0.35 0.24 0.09 0.00 0.00 178.44 179.68 1iin h MET 45 N 0.95 0.89 0.00 1.13 2.86 -0.64 -0.76 114.93 119.35 1iin h MET 45 Ca 0.25 -0.09 -0.02 0.00 -2.06 0.00 0.00 59.70 57.78 1iin h MET 45 Cb -0.03 -0.18 -0.00 0.00 0.06 0.00 0.00 31.60 31.44 1iin h MET 45 CO -0.05 0.66 -0.08 -0.07 1.06 0.00 0.00 176.91 178.43 1iin h LEU 46 N 0.90 0.00 -0.49 1.22 3.38 -0.46 0.08 115.31 119.94 1iin h LEU 46 Ca 0.23 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.20 1iin h LEU 46 Cb 0.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.77 1iin h LEU 46 CO -0.04 0.08 -0.00 0.00 0.09 0.00 0.00 178.44 178.57 1iin n ALA 47 N -2.16 2.64 -0.67 1.53 0.00 -0.49 -4.68 120.51 116.69 1iin n ALA 47 Ca -0.00 -0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.11 1iin n ALA 47 Cb 0.32 -1.34 0.00 0.00 0.00 0.00 0.00 19.45 18.43 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 1.10 0.74 3.66 0.00 0.00 0.02 -5.01 105.19 105.69 1iin n GLY 48 Ca 0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 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 4.82 0.00 -0.61 1.01 -0.42 -4.90 121.20 118.53 1iin s ILE 49 Ca 0.00 1.72 0.00 0.00 0.00 0.00 0.00 60.65 62.37 1iin s ILE 49 Cb 0.00 -4.18 0.00 0.00 0.01 0.00 0.00 42.46 38.29 1iin s ILE 49 CO 0.00 -0.04 0.00 0.54 0.00 0.00 0.00 174.94 175.44 1iin n ARG 50 N 5.63 5.35 -3.49 2.79 1.74 -1.26 -3.77 116.66 123.65 1iin n ARG 50 Ca 0.06 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 56.72 1iin n ARG 50 Cb 0.48 -0.58 -0.08 0.00 -1.02 0.00 0.00 32.46 31.26 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 -1.15 5.89 -0.00 0.55 2.15 -1.23 -0.97 116.67 121.91 1iin s ASP 51 Ca 0.00 -1.49 0.04 0.00 0.43 0.00 0.00 52.55 51.52 1iin s ASP 51 Cb 0.00 -2.09 -0.01 0.00 -0.30 0.00 0.00 42.92 40.52 1iin s ASP 51 CO 0.00 -0.62 -0.12 -0.63 -0.17 0.00 0.00 175.17 173.63 1iin s ILE 52 N 1.52 0.94 -0.19 4.11 1.01 0.03 -1.56 121.20 127.06 1iin s ILE 52 Ca 0.04 -0.58 -0.04 0.00 0.00 0.00 0.00 60.65 60.07 1iin s ILE 52 Cb -0.24 -0.80 -0.02 0.00 0.01 0.00 0.00 42.46 41.41 1iin s ILE 52 CO 0.04 0.21 -0.04 -0.22 0.00 0.00 0.00 174.94 174.92 1iin s LEU 53 N -0.43 3.04 -0.23 2.97 2.96 -0.18 -1.12 118.68 125.69 1iin s LEU 53 Ca 0.04 -0.27 -0.08 0.00 -0.22 0.00 0.00 54.13 53.59 1iin s LEU 53 Cb -0.05 -1.75 -0.04 0.00 0.50 0.00 0.00 46.19 44.85 1iin s LEU 53 CO -0.00 0.07 0.09 -0.63 -1.32 0.00 0.00 176.35 174.57 1iin s ILE 54 N 0.93 4.71 -0.17 6.68 1.01 0.22 -1.03 121.20 133.56 1iin s ILE 54 Ca -0.00 -0.04 -0.03 0.00 0.00 0.00 0.00 60.65 60.58 1iin s ILE 54 Cb -0.15 -3.19 -0.02 0.00 0.01 0.00 0.00 42.46 39.12 1iin s ILE 54 CO 0.01 0.36 -0.07 -0.63 0.00 0.00 0.00 174.94 174.61 1iin s ILE 55 N 1.19 3.46 0.16 2.92 1.01 -0.07 -1.60 121.20 128.26 1iin s ILE 55 Ca 0.05 -0.50 0.02 0.00 0.00 0.00 0.00 60.65 60.22 1iin s ILE 55 Cb -0.14 -2.51 -0.01 0.00 0.01 0.00 0.00 42.46 39.81 1iin s ILE 55 CO 0.04 0.48 0.17 -0.24 0.00 0.00 0.00 174.94 175.39 1iin n SER 56 N 3.91 -0.45 -4.84 3.58 2.88 -1.12 0.57 113.62 118.15 1iin n SER 56 Ca -0.18 -1.95 -0.30 0.00 -1.33 0.00 0.00 58.87 55.11 1iin n SER 56 Cb 0.52 0.93 0.08 0.00 -0.75 0.00 0.00 64.21 64.99 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 -2.61 2.90 0.25 2.46 -4.23 -1.26 -0.32 115.64 112.82 1iin s THR 57 Ca 0.16 0.29 -0.04 0.00 -1.18 0.00 0.00 61.69 60.92 1iin s THR 57 Cb 0.00 -3.15 0.22 0.00 1.34 0.00 0.00 72.50 70.91 1iin s THR 57 CO 0.12 -0.38 1.84 1.55 -0.54 0.00 0.00 174.62 177.20 1iin h PRO 58 N -1.01 0.89 -0.31 3.99 0.13 -1.87 -0.77 132.00 133.05 1iin h PRO 58 Ca -0.47 -0.05 -0.10 0.00 -0.87 0.00 0.00 66.00 64.51 1iin h PRO 58 Cb 1.28 -0.20 -0.01 0.00 0.13 0.00 0.00 31.00 32.20 1iin h PRO 58 CO 0.62 0.59 -0.19 1.96 -0.23 0.00 0.00 178.00 180.75 1iin h GLN 59 N 0.92 0.67 0.00 0.86 7.50 -1.96 -3.34 115.11 119.76 1iin h GLN 59 Ca 0.39 -0.31 -0.11 0.00 0.50 0.00 0.00 58.65 59.12 1iin h GLN 59 Cb 0.26 -0.01 -0.02 0.00 0.05 0.00 0.00 27.48 27.76 1iin h GLN 59 CO -0.20 0.91 -0.83 -0.44 -1.50 0.00 0.00 178.83 176.76 1iin h ASP 60 N 0.43 0.00 -0.80 1.46 3.32 -1.88 -3.38 116.42 115.57 1iin h ASP 60 Ca 0.06 0.00 0.14 0.00 0.02 0.00 0.00 57.03 57.26 1iin h ASP 60 Cb 0.73 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 40.19 1iin h ASP 60 CO 0.05 0.43 0.37 0.74 -1.72 0.00 0.00 179.24 179.12 1iin h THR 61 N 0.00 0.70 0.00 0.35 2.02 -1.26 0.13 112.91 114.85 1iin h THR 61 Ca -0.06 -0.18 -0.05 0.00 0.77 0.00 0.00 66.41 66.89 1iin h THR 61 Cb 1.38 0.12 -0.01 0.00 -1.74 0.00 0.00 68.15 67.90 1iin h THR 61 CO 0.05 0.10 -0.22 1.55 0.37 0.00 0.00 175.52 177.37 1iin h PRO 62 N 0.53 0.00 -0.04 6.66 0.13 -1.78 -2.32 132.00 135.18 1iin h PRO 62 Ca 0.44 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.56 1iin h PRO 62 Cb 0.63 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.76 1iin h PRO 62 CO -0.38 0.22 0.01 0.00 -0.23 0.00 0.00 178.00 177.62 1iin h ARG 63 N 0.00 0.07 -0.81 0.86 2.47 -0.97 -0.33 114.38 115.67 1iin h ARG 63 Ca -0.00 -0.02 0.02 0.00 -1.26 0.00 0.00 59.98 58.72 1iin h ARG 63 Cb 0.47 -0.01 -0.04 0.00 -1.65 0.00 0.00 29.97 28.74 1iin h ARG 63 CO 0.03 0.28 0.54 0.74 0.56 0.00 0.00 179.97 182.11 1iin h PHE 64 N -0.16 1.00 -0.42 3.04 -1.00 -1.15 -0.44 116.94 117.83 1iin h PHE 64 Ca 0.01 0.02 -0.09 0.00 2.81 0.00 0.00 57.97 60.73 1iin h PHE 64 Cb 0.24 -0.34 -0.02 0.00 3.61 0.00 0.00 35.95 39.44 1iin h PHE 64 CO 0.00 0.62 -0.11 0.37 -1.61 0.00 0.00 178.31 177.58 1iin h GLN 65 N 1.07 0.74 -0.51 1.51 4.15 -1.19 0.11 115.11 120.99 1iin h GLN 65 Ca 0.31 -0.24 -0.03 0.00 0.77 0.00 0.00 58.65 59.46 1iin h GLN 65 Cb -0.07 -0.07 -0.02 0.00 0.21 0.00 0.00 27.48 27.53 1iin h GLN 65 CO -0.07 0.82 0.19 0.37 -1.93 0.00 0.00 178.83 178.21 1iin h GLN 66 N 0.67 0.76 0.22 1.69 4.15 0.03 0.29 115.11 122.93 1iin h GLN 66 Ca 0.12 -0.14 -0.01 0.00 0.77 0.00 0.00 58.65 59.38 1iin h GLN 66 Cb 0.57 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 28.14 1iin h GLN 66 CO 0.04 0.68 -0.11 1.25 -1.93 0.00 0.00 178.83 178.76 1iin h LEU 67 N 0.68 -0.25 0.00 -2.39 6.46 -0.75 -3.39 115.31 115.67 1iin h LEU 67 Ca 0.17 -0.24 -0.08 0.00 -0.12 0.00 0.00 57.88 57.60 1iin h LEU 67 Cb 0.21 0.07 -0.02 0.00 -0.73 0.00 0.00 40.66 40.19 1iin h LEU 67 CO -0.01 0.14 -1.94 0.18 -0.62 0.00 0.00 178.44 176.18 1iin n LEU 68 N -5.06 0.14 0.00 2.25 4.77 0.35 -5.08 117.00 114.37 1iin n LEU 68 Ca -0.09 0.06 0.00 0.00 -0.03 0.00 0.00 56.01 55.95 1iin n LEU 68 Cb 0.25 0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.44 1iin n LEU 68 CO 0.31 0.09 0.00 0.61 -1.33 0.00 0.00 177.39 177.07 1iin n GLY 69 N 1.36 1.39 1.08 -0.72 0.00 0.10 -2.21 105.19 106.19 1iin n GLY 69 Ca -0.10 -0.61 0.10 0.00 0.00 0.00 0.00 46.02 45.41 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 -0.93 3.13 0.00 1.61 5.75 -1.26 -4.80 116.55 120.05 1iin n ASP 70 Ca 0.00 -1.98 0.00 0.00 -0.01 0.00 0.00 54.79 52.80 1iin n ASP 70 Cb 0.00 -0.37 0.00 0.00 -1.03 0.00 0.00 41.12 39.72 1iin n ASP 70 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1iin n GLY 71 N 1.44 0.22 0.27 6.12 0.00 -0.94 -0.37 105.19 111.93 1iin n GLY 71 Ca 0.20 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.34 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 0.40 1.61 4.64 -1.82 0.07 113.55 118.45 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 0.31 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.40 1iin h SER 72 CO 0.00 0.05 -0.02 0.06 -0.87 0.00 0.00 176.83 176.05 1iin h GLN 73 N 0.00 0.00 -0.20 4.77 -0.00 -1.88 -1.40 115.11 116.41 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 0.11 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.59 1iin h GLN 73 CO 0.01 0.02 0.00 0.91 -0.00 0.00 0.00 178.83 179.76 1iin n TRP 74 N -3.18 0.59 -1.75 0.06 8.01 -0.17 -4.96 117.44 116.05 1iin n TRP 74 Ca -0.02 -0.82 -0.09 0.00 -1.31 0.00 0.00 57.50 55.26 1iin n TRP 74 Cb 0.17 -0.22 -0.02 0.00 -2.01 0.00 0.00 31.31 29.24 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 -0.56 0.51 3.84 6.99 0.00 -0.53 -4.70 105.19 110.74 1iin n GLY 75 Ca 0.17 -0.55 -0.26 0.00 0.00 0.00 0.00 46.02 45.38 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 -2.40 2.86 -0.30 0.99 1.43 -0.19 -4.97 118.68 116.11 1iin s LEU 76 Ca 0.00 -1.17 -0.00 0.00 -1.03 0.00 0.00 54.13 51.92 1iin s LEU 76 Cb 0.00 -1.33 0.09 0.00 0.03 0.00 0.00 46.19 44.99 1iin s LEU 76 CO 0.00 -0.87 0.08 0.21 0.23 0.00 0.00 176.35 176.00 1iin s ASN 77 N -4.12 4.05 -0.12 2.29 3.84 -0.14 -2.84 114.94 117.89 1iin s ASN 77 Ca 0.35 -1.63 -0.03 0.00 0.21 0.00 0.00 52.86 51.76 1iin s ASN 77 Cb -0.00 -0.97 -0.03 0.00 -0.55 0.00 0.00 41.25 39.70 1iin s ASN 77 CO 0.21 -0.39 -0.00 -0.76 -2.79 0.00 0.00 177.10 173.36 1iin s LEU 78 N 1.53 3.51 0.22 3.21 1.43 0.50 -0.79 118.68 128.28 1iin s LEU 78 Ca 0.08 0.04 0.08 0.00 -1.03 0.00 0.00 54.13 53.30 1iin s LEU 78 Cb -0.18 -1.83 -0.05 0.00 0.03 0.00 0.00 46.19 44.17 1iin s LEU 78 CO -0.21 0.28 -0.14 -1.10 0.23 0.00 0.00 176.35 175.41 1iin s GLN 79 N -0.27 1.38 0.08 1.70 -0.21 -0.28 -4.54 119.66 117.52 1iin s GLN 79 Ca 0.06 -1.62 0.07 0.00 0.02 0.00 0.00 55.36 53.88 1iin s GLN 79 Cb -0.12 -1.17 -0.03 0.00 1.00 0.00 0.00 33.01 32.69 1iin s GLN 79 CO 0.02 0.18 -0.18 0.71 -2.12 0.00 0.00 175.29 173.90 1iin s TYR 80 N -2.95 1.53 -0.04 0.91 1.51 -1.26 -0.61 117.35 116.43 1iin s TYR 80 Ca 0.24 -0.43 -0.12 0.00 -1.01 0.00 0.00 57.07 55.74 1iin s TYR 80 Cb -0.01 -0.85 0.02 0.00 -0.11 0.00 0.00 41.96 41.02 1iin s TYR 80 CO 0.08 0.13 0.28 0.21 -1.11 0.00 0.00 175.55 175.15 1iin s LYS 81 N -1.78 0.55 0.06 -0.62 2.20 -0.63 -4.93 119.74 114.58 1iin s LYS 81 Ca 0.03 -0.03 -0.08 0.00 -0.36 0.00 0.00 55.97 55.52 1iin s LYS 81 Cb -0.10 0.24 -0.05 0.00 -1.51 0.00 0.00 37.83 36.41 1iin s LYS 81 CO 0.03 -0.13 0.35 0.08 -0.36 0.00 0.00 175.35 175.33 1iin s VAL 82 N -0.87 5.17 -0.36 4.02 1.01 -1.26 -2.80 120.40 125.31 1iin s VAL 82 Ca -0.10 0.33 -0.04 0.00 0.00 0.00 0.00 61.98 62.18 1iin s VAL 82 Cb -0.05 -3.62 0.07 0.00 0.00 0.00 0.00 36.38 32.79 1iin s VAL 82 CO 0.03 0.30 0.11 -1.58 0.00 0.00 0.00 175.10 173.96 1iin s GLN 83 N -1.89 2.32 0.22 2.72 0.74 0.57 -4.90 119.66 119.43 1iin s GLN 83 Ca 0.31 -1.47 -0.08 0.00 0.05 0.00 0.00 55.36 54.17 1iin s GLN 83 Cb -0.14 -3.42 0.34 0.00 1.10 0.00 0.00 33.01 30.90 1iin s GLN 83 CO 0.18 -0.82 1.71 -1.35 -0.55 0.00 0.00 175.29 174.46 1iin h PRO 84 N 8.09 0.30 -3.64 1.67 0.11 -1.96 -3.38 132.00 133.19 1iin h PRO 84 Ca -0.19 -0.02 -0.19 0.00 0.11 0.00 0.00 66.00 65.72 1iin h PRO 84 Cb 1.06 -0.07 -0.25 0.00 0.11 0.00 0.00 31.00 31.86 1iin h PRO 84 CO 0.62 0.20 -0.62 -1.54 -0.21 0.00 0.00 178.00 176.45 1iin s SER 85 N -5.31 0.01 -0.67 -2.05 1.04 -1.26 -4.80 113.70 100.65 1iin s SER 85 Ca -0.13 -0.05 -0.19 0.00 0.48 0.00 0.00 55.95 56.06 1iin s SER 85 Cb 0.19 0.15 -0.16 0.00 0.10 0.00 0.00 66.02 66.30 1iin s SER 85 CO 0.75 -0.15 1.88 -0.81 0.98 0.00 0.00 173.24 175.89 1iin n PRO 86 N 2.44 1.37 -0.04 4.02 -0.04 -1.26 -4.70 135.00 136.79 1iin n PRO 86 Ca -0.17 -1.62 0.01 0.00 -0.04 0.00 0.00 63.50 61.69 1iin n PRO 86 Cb 0.58 -2.74 0.03 0.00 -0.04 0.00 0.00 33.50 31.33 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 6.95 0.37 0.00 3.54 8.00 -1.26 -4.96 116.55 129.19 1iin n ASP 87 Ca 0.46 -2.00 0.00 0.00 0.71 0.00 0.00 54.79 53.96 1iin n ASP 87 Cb 0.34 -0.05 0.00 0.00 -0.02 0.00 0.00 41.12 41.39 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 0.61 3.82 0.37 0.44 0.00 -1.26 -0.31 105.19 108.85 1iin n GLY 88 Ca 0.02 -1.59 0.09 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 0.78 -2.13 0.99 3.38 -1.90 -1.54 115.31 114.90 1iin h LEU 89 Ca 0.00 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1iin h LEU 89 Cb 0.00 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.62 1iin h LEU 89 CO 0.00 0.43 -0.03 0.00 0.09 0.00 0.00 178.44 178.93 1iin h ALA 90 N 1.57 1.07 0.00 1.53 0.00 -1.62 -0.92 119.26 120.88 1iin h ALA 90 Ca 0.44 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.33 1iin h ALA 90 Cb 0.53 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1iin h ALA 90 CO -0.21 0.04 0.00 0.94 0.00 0.00 0.00 179.25 180.02 1iin n GLN 91 N -3.22 0.16 -0.22 0.00 7.27 -0.58 -2.17 117.38 118.62 1iin n GLN 91 Ca -0.01 0.52 0.02 0.00 0.07 0.00 0.00 57.00 57.59 1iin n GLN 91 Cb 0.20 -1.89 0.27 0.00 2.41 0.00 0.00 30.24 31.23 1iin n GLN 91 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1iin h ALA 92 N 2.15 1.51 0.00 1.69 0.00 -1.31 -1.75 119.26 121.54 1iin h ALA 92 Ca 0.00 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1iin h ALA 92 Cb 0.19 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 1iin h ALA 92 CO 0.00 0.43 -0.09 0.74 0.00 0.00 0.00 179.25 180.33 1iin h PHE 93 N 0.97 0.00 0.07 0.00 -1.00 -1.66 0.13 116.94 115.45 1iin h PHE 93 Ca 0.29 0.00 -0.09 0.00 2.81 0.00 0.00 57.97 60.98 1iin h PHE 93 Cb -0.03 0.00 0.01 0.00 3.61 0.00 0.00 35.95 39.54 1iin h PHE 93 CO -0.00 0.09 -0.40 0.82 -1.61 0.00 0.00 178.31 177.21 1iin h ILE 94 N 0.00 1.66 -0.51 -0.55 2.04 -1.51 -1.71 117.51 116.93 1iin h ILE 94 Ca -0.00 -2.44 -0.03 0.00 1.00 0.00 0.00 64.86 63.38 1iin h ILE 94 Cb 0.86 3.31 -0.02 0.00 -0.74 0.00 0.00 36.82 40.22 1iin h ILE 94 CO 0.01 0.66 0.19 0.40 0.00 0.00 0.00 178.15 179.41 1iin h ILE 95 N -0.69 1.19 -0.41 -0.67 2.04 -1.33 -2.50 117.51 115.14 1iin h ILE 95 Ca -0.07 -0.62 0.00 0.00 1.00 0.00 0.00 64.86 65.17 1iin h ILE 95 Cb 1.32 0.61 0.00 0.00 -0.74 0.00 0.00 36.82 38.00 1iin h ILE 95 CO 0.07 0.24 0.00 0.61 0.00 0.00 0.00 178.15 179.08 1iin n GLY 96 N -1.06 1.09 0.23 5.37 0.00 0.44 -4.55 105.19 106.70 1iin n GLY 96 Ca 0.04 -0.51 -0.01 0.00 0.00 0.00 0.00 46.02 45.54 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 2.79 0.02 -0.52 1.61 4.81 -0.83 1.00 114.58 123.46 1iin h GLU 97 Ca 0.00 -0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.16 1iin h GLU 97 Cb 0.63 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.99 1iin h GLU 97 CO 0.00 0.01 0.05 1.49 -0.73 0.00 0.00 179.01 179.83 1iin h GLU 98 N 0.02 0.89 -0.49 1.92 4.81 -1.83 -1.42 114.58 118.47 1iin h GLU 98 Ca 0.28 -0.26 0.02 0.00 -0.13 0.00 0.00 59.36 59.28 1iin h GLU 98 Cb 0.44 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.70 1iin h GLU 98 CO -0.58 0.89 0.30 0.35 -0.73 0.00 0.00 179.01 179.24 1iin h PHE 99 N 0.77 0.57 -0.31 0.92 3.57 -1.56 -3.03 116.94 117.86 1iin h PHE 99 Ca 0.15 0.02 -0.13 0.00 3.53 0.00 0.00 57.97 61.54 1iin h PHE 99 Cb 0.45 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 39.00 1iin h PHE 99 CO 0.03 0.33 -0.35 0.82 -2.23 0.00 0.00 178.31 176.92 1iin h ILE 100 N 0.61 1.29 0.00 1.41 2.04 -0.66 -3.48 117.51 118.71 1iin h ILE 100 Ca 0.19 -1.49 0.00 0.00 1.00 0.00 0.00 64.86 64.56 1iin h ILE 100 Cb -0.01 1.42 0.00 0.00 -0.74 0.00 0.00 36.82 37.49 1iin h ILE 100 CO -0.08 0.48 0.00 0.61 0.00 0.00 0.00 178.15 179.17 1iin n GLY 101 N -0.06 3.98 0.79 5.37 0.00 -0.55 -1.60 105.19 113.12 1iin n GLY 101 Ca -0.01 0.09 0.07 0.00 0.00 0.00 0.00 46.02 46.17 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 14.00 0.65 -2.68 1.61 8.25 -1.26 -5.00 115.22 130.79 1iin n HIS 102 Ca 0.00 -0.57 -0.21 0.00 -0.26 0.00 0.00 57.72 56.67 1iin n HIS 102 Cb 0.00 -0.09 0.05 0.00 1.12 0.00 0.00 29.99 31.07 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 -1.16 5.07 0.62 0.41 1.01 -0.63 -4.72 116.67 117.27 1iin s ASP 103 Ca 0.30 -0.18 -0.12 0.00 0.71 0.00 0.00 52.55 53.26 1iin s ASP 103 Cb 0.18 -0.58 -0.04 0.00 1.01 0.00 0.00 42.92 43.50 1iin s ASP 103 CO 0.16 -1.30 1.03 -1.81 0.21 0.00 0.00 175.17 173.47 1iin s ASP 104 N -4.51 6.13 -0.18 0.27 1.11 -1.26 -3.75 116.67 114.48 1iin s ASP 104 Ca 0.60 1.48 -0.19 0.00 0.18 0.00 0.00 52.55 54.62 1iin s ASP 104 Cb -0.09 -2.48 0.05 0.00 1.07 0.00 0.00 42.92 41.47 1iin s ASP 104 CO 0.39 -0.93 0.53 0.00 1.18 0.00 0.00 175.17 176.34 1iin s ALA 106 N 0.06 3.93 -0.07 0.00 0.00 -0.27 -1.25 121.76 124.16 1iin s ALA 106 Ca -0.02 -1.10 0.02 0.00 0.00 0.00 0.00 51.96 50.87 1iin s ALA 106 Cb -0.04 -1.79 0.01 0.00 0.00 0.00 0.00 23.12 21.31 1iin s ALA 106 CO 0.02 0.38 -0.12 -1.17 0.00 0.00 0.00 175.76 174.86 1iin s LEU 107 N -3.61 1.62 0.02 0.00 2.96 0.14 -1.11 118.68 118.69 1iin s LEU 107 Ca 0.35 -0.31 0.04 0.00 -0.22 0.00 0.00 54.13 54.00 1iin s LEU 107 Cb -0.10 -0.84 -0.02 0.00 0.50 0.00 0.00 46.19 45.73 1iin s LEU 107 CO 0.29 0.02 -0.14 0.54 -1.32 0.00 0.00 176.35 175.75 1iin s VAL 108 N 0.75 1.07 0.28 1.68 0.11 0.01 -0.38 120.40 123.92 1iin s VAL 108 Ca -0.13 -0.80 -0.27 0.00 -2.93 0.00 0.00 61.98 57.85 1iin s VAL 108 Cb -0.16 -0.94 -0.09 0.00 -1.53 0.00 0.00 36.38 33.66 1iin s VAL 108 CO 0.03 0.13 0.92 -0.76 -3.33 0.00 0.00 175.10 172.09 1iin s LEU 109 N -0.77 4.46 0.10 2.54 1.43 -0.17 -1.85 118.68 124.41 1iin s LEU 109 Ca 0.03 1.84 0.11 0.00 -1.03 0.00 0.00 54.13 55.08 1iin s LEU 109 Cb -0.07 -3.80 0.53 0.00 0.03 0.00 0.00 46.19 42.88 1iin s LEU 109 CO 0.00 0.03 1.35 0.61 0.23 0.00 0.00 176.35 178.58 1iin n GLY 110 N 0.96 -0.82 0.75 -3.19 0.00 0.09 -1.96 105.19 101.01 1iin n GLY 110 Ca -0.00 0.04 0.08 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 -1.74 3.42 -4.56 1.61 5.68 -1.26 -4.22 116.55 115.47 1iin n ASP 111 Ca 0.01 -3.11 -0.41 0.00 -0.50 0.00 0.00 54.79 50.78 1iin n ASP 111 Cb 0.09 -0.53 -0.08 0.00 -1.14 0.00 0.00 41.12 39.46 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 -2.20 6.33 -0.22 -1.12 3.84 -0.83 -4.68 114.94 116.06 1iin s ASN 112 Ca 0.40 0.01 0.02 0.00 0.21 0.00 0.00 52.86 53.50 1iin s ASN 112 Cb 0.34 -2.27 0.04 0.00 -0.55 0.00 0.00 41.25 38.81 1iin s ASN 112 CO 0.07 -0.48 -0.15 -0.63 -2.79 0.00 0.00 177.10 173.12 1iin s ILE 113 N 2.41 2.08 -0.01 -5.21 1.01 -1.26 -3.45 121.20 116.77 1iin s ILE 113 Ca 0.19 -1.29 0.04 0.00 0.00 0.00 0.00 60.65 59.59 1iin s ILE 113 Cb -0.15 -2.06 -0.03 0.00 0.01 0.00 0.00 42.46 40.23 1iin s ILE 113 CO 0.13 0.23 -0.12 -0.36 0.00 0.00 0.00 174.94 174.83 1iin s PHE 114 N 1.20 2.75 -0.02 3.97 2.99 -1.26 -1.74 117.98 125.88 1iin s PHE 114 Ca -0.02 -0.12 0.01 0.00 0.00 0.00 0.00 56.93 56.79 1iin s PHE 114 Cb -0.17 -1.58 0.02 0.00 0.00 0.00 0.00 43.02 41.29 1iin s PHE 114 CO -0.09 0.29 -0.01 -0.47 -0.00 0.00 0.00 175.22 174.94 1iin s TYR 115 N -0.89 0.31 0.00 0.36 5.04 -0.13 -5.00 117.35 117.04 1iin s TYR 115 Ca 0.15 -0.02 0.00 0.00 -2.44 0.00 0.00 57.07 54.75 1iin s TYR 115 Cb -0.11 -0.34 0.00 0.00 0.35 0.00 0.00 41.96 41.87 1iin s TYR 115 CO 0.05 -0.09 0.00 0.41 -1.34 0.00 0.00 175.55 174.58 1iin n GLY 116 N 3.76 1.95 0.46 8.97 0.00 -1.26 -0.99 105.19 118.08 1iin n GLY 116 Ca -0.22 -0.91 -0.17 0.00 0.00 0.00 0.00 46.02 44.71 1iin n GLY 116 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 1iin h HIS 117 N 0.00 -1.20 -1.73 1.61 2.76 -2.02 -3.35 115.15 111.23 1iin h HIS 117 Ca 0.00 -0.01 -0.67 0.00 -2.20 0.00 0.00 60.37 57.50 1iin h HIS 117 Cb 0.00 0.44 -0.36 0.00 1.55 0.00 0.00 27.41 29.04 1iin h HIS 117 CO 0.00 -0.64 0.03 -0.25 -1.30 0.00 0.00 177.93 175.77 1iin n ASP 118 N -5.21 5.90 -0.18 3.26 10.43 -1.26 -4.81 116.55 124.68 1iin n ASP 118 Ca -0.13 -3.77 -0.03 0.00 2.57 0.00 0.00 54.79 53.43 1iin n ASP 118 Cb 0.44 -0.72 0.07 0.00 1.84 0.00 0.00 41.12 42.75 1iin n ASP 118 CO 0.00 0.00 0.00 0.25 -1.07 0.00 0.00 177.20 176.38 1iin h LEU 119 N 2.76 0.35 -0.63 0.64 5.85 -2.00 -0.46 115.31 121.82 1iin h LEU 119 Ca 0.41 0.04 0.06 0.00 0.84 0.00 0.00 57.88 59.23 1iin h LEU 119 Cb 0.54 -0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.49 1iin h LEU 119 CO 1.10 0.24 0.34 -0.65 -0.34 0.00 0.00 178.44 179.12 1iin h PRO 120 N 0.50 0.61 -0.42 5.25 0.11 -1.87 -1.98 132.00 134.20 1iin h PRO 120 Ca 0.25 -0.04 -0.10 0.00 0.11 0.00 0.00 66.00 66.23 1iin h PRO 120 Cb 0.20 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 31.15 1iin h PRO 120 CO -0.19 0.40 -0.14 0.87 -0.21 0.00 0.00 178.00 178.73 1iin h LYS 121 N 0.63 0.76 -0.77 1.05 6.56 -1.79 -1.92 116.57 121.09 1iin h LYS 121 Ca 0.29 -0.27 0.03 0.00 -1.06 0.00 0.00 60.65 59.64 1iin h LYS 121 Cb 0.19 -0.06 -0.04 0.00 -0.57 0.00 0.00 32.23 31.75 1iin h LYS 121 CO -0.19 0.86 0.51 1.25 -2.06 0.00 0.00 179.45 179.82 1iin h LEU 122 N 0.69 0.83 0.00 2.94 6.46 -0.53 -2.71 115.31 122.99 1iin h LEU 122 Ca 0.11 -0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.86 1iin h LEU 122 Cb 0.62 -0.20 0.00 0.00 -0.73 0.00 0.00 40.66 40.36 1iin h LEU 122 CO 0.04 0.58 -0.55 0.23 -0.62 0.00 0.00 178.44 178.12 1iin n MET 123 N -4.44 0.21 -0.24 1.25 2.81 -0.80 -4.50 117.12 111.41 1iin n MET 123 Ca 0.09 0.06 0.01 0.00 -1.81 0.00 0.00 57.70 56.06 1iin n MET 123 Cb 0.09 -1.63 0.14 0.00 -0.71 0.00 0.00 33.22 31.10 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 0.00 0.57 -0.70 0.03 4.81 -1.01 -0.31 114.58 117.97 1iin h GLU 124 Ca 0.00 -0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 59.15 1iin h GLU 124 Cb 0.67 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.90 1iin h GLU 124 CO 0.00 0.37 0.24 0.00 -0.73 0.00 0.00 179.01 178.90 1iin h ALA 125 N 1.43 0.91 -0.29 2.92 0.00 -1.79 -2.19 119.26 120.27 1iin h ALA 125 Ca 0.35 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1iin h ALA 125 Cb 0.37 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1iin h ALA 125 CO -0.27 0.57 0.19 0.00 0.00 0.00 0.00 179.25 179.73 1iin h ALA 126 N 1.11 0.36 -0.89 0.00 0.00 -1.49 0.72 119.26 119.07 1iin h ALA 126 Ca 0.23 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.13 1iin h ALA 126 Cb 0.27 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 17.90 1iin h ALA 126 CO -0.01 -0.16 0.59 0.28 0.00 0.00 0.00 179.25 179.95 1iin h VAL 127 N 0.38 1.21 -0.01 0.00 2.07 -0.95 -2.96 116.25 116.00 1iin h VAL 127 Ca 0.10 -0.41 0.00 0.00 0.82 0.00 0.00 66.70 67.22 1iin h VAL 127 Cb -0.03 -0.08 0.00 0.00 -1.52 0.00 0.00 31.29 29.66 1iin h VAL 127 CO -0.02 0.22 -0.26 0.59 0.02 0.00 0.00 177.57 178.11 1iin n ASN 128 N -4.41 1.50 -4.69 0.57 3.02 -0.84 -0.73 115.26 109.67 1iin n ASN 128 Ca 0.11 -1.22 -0.44 0.00 -0.03 0.00 0.00 54.58 53.00 1iin n ASN 128 Cb 0.04 0.20 -0.03 0.00 -0.61 0.00 0.00 39.78 39.37 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 -0.22 2.58 -0.14 3.52 4.81 0.22 -4.77 118.16 124.16 1iin n LYS 129 Ca 0.13 0.94 -0.08 0.00 -0.87 0.00 0.00 58.31 58.42 1iin n LYS 129 Cb 0.40 -2.78 0.00 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 7.42 0.57 -3.47 1.64 4.39 -1.90 -3.43 114.58 119.80 1iin h GLU 130 Ca -0.45 -0.06 -0.06 0.00 0.34 0.00 0.00 59.36 59.13 1iin h GLU 130 Cb 1.23 -0.11 -0.13 0.00 -0.10 0.00 0.00 28.75 29.64 1iin h GLU 130 CO 0.94 0.44 -0.11 -1.54 -1.16 0.00 0.00 179.01 177.57 1iin s SER 131 N -5.68 -0.17 0.00 1.42 1.04 -1.26 -4.58 113.70 104.47 1iin s SER 131 Ca -0.13 -0.44 0.00 0.00 0.48 0.00 0.00 55.95 55.86 1iin s SER 131 Cb 0.11 0.47 0.00 0.00 0.10 0.00 0.00 66.02 66.70 1iin s SER 131 CO 0.74 -0.88 0.00 0.61 0.98 0.00 0.00 173.24 174.69 1iin n GLY 132 N -0.22 -0.40 3.22 7.32 0.00 -1.26 -5.00 105.19 108.84 1iin n GLY 132 Ca -0.14 -1.95 -0.09 0.00 0.00 0.00 0.00 46.02 43.83 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 -2.00 -0.33 -0.02 4.61 0.00 -0.63 -2.07 121.76 121.31 1iin s ALA 133 Ca 0.00 -0.51 0.01 0.00 0.00 0.00 0.00 51.96 51.45 1iin s ALA 133 Cb 0.00 0.50 0.02 0.00 0.00 0.00 0.00 23.12 23.64 1iin s ALA 133 CO 0.00 -0.52 -0.01 0.99 0.00 0.00 0.00 175.76 176.22 1iin s THR 134 N -3.76 0.22 0.30 0.00 2.01 0.04 -0.85 115.64 113.60 1iin s THR 134 Ca 0.04 0.02 0.05 0.00 0.31 0.00 0.00 61.69 62.11 1iin s THR 134 Cb 0.04 -0.28 -0.06 0.00 0.01 0.00 0.00 72.50 72.21 1iin s THR 134 CO -0.11 0.13 0.00 0.68 -0.69 0.00 0.00 174.62 174.64 1iin s VAL 135 N 0.76 1.37 -0.08 3.82 -7.23 -0.82 -0.73 120.40 117.50 1iin s VAL 135 Ca -0.08 -2.05 0.04 0.00 -1.81 0.00 0.00 61.98 58.08 1iin s VAL 135 Cb -0.11 -2.61 0.00 0.00 0.56 0.00 0.00 36.38 34.22 1iin s VAL 135 CO -0.01 -0.16 -0.21 -0.36 -0.31 0.00 0.00 175.10 174.05 1iin s PHE 136 N -3.18 2.19 -0.12 2.82 0.40 -1.26 -1.36 117.98 117.47 1iin s PHE 136 Ca 0.33 -0.80 -0.05 0.00 -0.60 0.00 0.00 56.93 55.80 1iin s PHE 136 Cb 0.07 -1.48 -0.04 0.00 0.51 0.00 0.00 43.02 42.08 1iin s PHE 136 CO 0.13 -0.32 0.07 0.00 0.70 0.00 0.00 175.22 175.80 1iin s ALA 137 N 0.27 3.54 -0.02 5.36 0.00 -0.52 -0.89 121.76 129.50 1iin s ALA 137 Ca -0.13 -0.73 0.01 0.00 0.00 0.00 0.00 51.96 51.11 1iin s ALA 137 Cb -0.16 -1.77 0.01 0.00 0.00 0.00 0.00 23.12 21.20 1iin s ALA 137 CO 0.06 0.50 -0.03 -0.47 0.00 0.00 0.00 175.76 175.82 1iin s TYR 138 N -0.63 0.42 -0.07 0.00 5.04 0.01 -1.02 117.35 121.10 1iin s TYR 138 Ca 0.11 -0.07 -0.30 0.00 -2.44 0.00 0.00 57.07 54.38 1iin s TYR 138 Cb -0.12 -0.38 -0.04 0.00 0.35 0.00 0.00 41.96 41.77 1iin s TYR 138 CO 0.02 -0.09 1.36 -1.58 -1.34 0.00 0.00 175.55 173.93 1iin s HIS 139 N 0.51 2.77 0.28 4.97 5.65 -1.26 -1.13 115.29 127.08 1iin s HIS 139 Ca -0.05 0.85 0.06 0.00 0.25 0.00 0.00 55.06 56.17 1iin s HIS 139 Cb -0.09 -3.61 -0.06 0.00 -1.18 0.00 0.00 32.58 27.65 1iin s HIS 139 CO -0.01 -2.22 -0.05 0.14 -0.65 0.00 0.00 174.74 171.96 1iin s VAL 140 N 2.99 1.57 -0.09 0.89 -7.23 0.02 -4.96 120.40 113.59 1iin s VAL 140 Ca 0.61 -2.11 0.15 0.00 -1.81 0.00 0.00 61.98 58.82 1iin s VAL 140 Cb -0.27 -2.47 0.05 0.00 0.56 0.00 0.00 36.38 34.25 1iin s VAL 140 CO 0.22 -0.28 1.47 -1.13 -0.31 0.00 0.00 175.10 175.07 1iin h ASN 141 N 2.28 0.00 -2.18 4.85 -1.24 -1.95 -3.40 115.58 113.94 1iin h ASN 141 Ca -0.40 0.00 -0.59 0.00 0.71 0.00 0.00 56.30 56.02 1iin h ASN 141 Cb 1.23 0.00 -0.41 0.00 0.73 0.00 0.00 38.32 39.88 1iin h ASN 141 CO 0.67 0.53 -0.79 -0.90 -1.29 0.00 0.00 177.43 175.65 1iin n ASP 142 N -3.27 2.25 0.02 1.15 5.75 -1.26 -4.95 116.55 116.24 1iin n ASP 142 Ca 0.02 -3.12 0.14 0.00 -0.01 0.00 0.00 54.79 51.82 1iin n ASP 142 Cb 0.73 -0.66 0.60 0.00 -1.03 0.00 0.00 41.12 40.76 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 4.24 0.16 -0.93 0.11 0.11 -1.87 -2.52 132.00 131.30 1iin h PRO 143 Ca 0.15 -0.01 0.25 0.00 0.11 0.00 0.00 66.00 66.50 1iin h PRO 143 Cb 0.76 -0.04 -0.05 0.00 0.11 0.00 0.00 31.00 31.78 1iin h PRO 143 CO 0.68 0.11 0.65 0.93 -0.21 0.00 0.00 178.00 180.15 1iin h GLU 144 N 0.17 0.15 0.00 1.05 3.07 -1.92 0.21 114.58 117.31 1iin h GLU 144 Ca 0.21 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.06 1iin h GLU 144 Cb 0.59 -0.03 0.00 0.00 -0.84 0.00 0.00 28.75 28.47 1iin h GLU 144 CO -0.03 0.10 0.00 0.54 -1.40 0.00 0.00 179.01 178.22 1iin n ARG 145 N -4.37 0.41 -4.54 2.33 1.74 -0.95 -4.16 116.66 107.12 1iin n ARG 145 Ca 0.20 0.01 -0.27 0.00 -0.77 0.00 0.00 57.85 57.02 1iin n ARG 145 Cb 0.90 -1.50 -0.08 0.00 -1.02 0.00 0.00 32.46 30.77 1iin n ARG 145 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1iin s TYR 146 N -2.58 1.78 0.16 -1.55 1.51 0.75 -4.83 117.35 112.59 1iin s TYR 146 Ca 0.27 -1.34 -0.30 0.00 -1.01 0.00 0.00 57.07 54.70 1iin s TYR 146 Cb 0.20 -1.16 -0.07 0.00 -0.11 0.00 0.00 41.96 40.81 1iin s TYR 146 CO 0.45 -0.34 1.06 0.20 -1.11 0.00 0.00 175.55 175.81 1iin s GLY 147 N -3.65 2.89 -0.07 0.71 0.00 -1.26 -0.29 107.32 105.65 1iin s GLY 147 Ca 0.20 0.75 0.05 0.00 0.00 0.00 0.00 44.72 45.72 1iin s GLY 147 CO 0.14 1.60 -0.22 0.14 0.00 0.00 0.00 173.10 174.76 1iin s VAL 148 N -0.21 2.36 -0.18 1.40 1.01 0.13 -0.50 120.40 124.40 1iin s VAL 148 Ca 0.49 -0.96 -0.01 0.00 0.00 0.00 0.00 61.98 61.50 1iin s VAL 148 Cb -0.28 -1.89 0.00 0.00 0.00 0.00 0.00 36.38 34.22 1iin s VAL 148 CO 0.34 0.57 -0.14 0.54 0.00 0.00 0.00 175.10 176.40 1iin s VAL 149 N -0.18 2.65 -0.07 2.92 0.11 -0.67 -1.49 120.40 123.68 1iin s VAL 149 Ca -0.02 -0.75 -0.11 0.00 -2.93 0.00 0.00 61.98 58.17 1iin s VAL 149 Cb -0.14 -2.15 -0.05 0.00 -1.53 0.00 0.00 36.38 32.52 1iin s VAL 149 CO 0.03 0.50 0.26 -0.70 -3.33 0.00 0.00 175.10 171.87 1iin s GLU 150 N 1.16 3.70 0.06 1.54 2.12 -0.55 -4.49 118.70 122.24 1iin s GLU 150 Ca 0.01 0.11 0.06 0.00 0.36 0.00 0.00 54.97 55.51 1iin s GLU 150 Cb -0.14 -3.22 -0.04 0.00 0.26 0.00 0.00 34.13 30.99 1iin s GLU 150 CO -0.05 0.71 -0.10 -0.06 -0.54 0.00 0.00 175.26 175.22 1iin s PHE 151 N -0.95 2.77 0.72 5.30 0.40 -1.26 -0.27 117.98 124.67 1iin s PHE 151 Ca 0.19 -0.13 -0.06 0.00 -0.60 0.00 0.00 56.93 56.33 1iin s PHE 151 Cb -0.14 -1.50 0.15 0.00 0.51 0.00 0.00 43.02 42.05 1iin s PHE 151 CO 0.08 0.38 0.98 -0.40 0.70 0.00 0.00 175.22 176.96 1iin n ASP 152 N 1.10 0.72 -0.27 1.36 5.68 -0.50 -4.87 116.55 119.77 1iin n ASP 152 Ca -0.14 -1.75 0.15 0.00 -0.50 0.00 0.00 54.79 52.55 1iin n ASP 152 Cb 0.52 -0.69 0.42 0.00 -1.14 0.00 0.00 41.12 40.24 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 0.57 0.00 0.11 7.50 -2.01 0.12 115.11 121.41 1iin h GLN 153 Ca -0.32 -0.03 0.00 0.00 0.50 0.00 0.00 58.65 58.80 1iin h GLN 153 Cb 1.04 -0.13 0.00 0.00 0.05 0.00 0.00 27.48 28.44 1iin h GLN 153 CO 0.29 0.38 0.00 0.87 -1.50 0.00 0.00 178.83 178.87 1iin h LYS 154 N 0.59 0.00 0.00 1.46 1.57 -2.05 -3.46 116.57 114.68 1iin h LYS 154 Ca 0.48 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.26 1iin h LYS 154 Cb 0.93 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.24 1iin h LYS 154 CO -0.23 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.06 1iin n GLY 155 N 0.58 0.73 3.75 3.86 0.00 0.41 -5.07 105.19 109.45 1iin n GLY 155 Ca 0.04 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 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 -2.19 4.42 -0.29 2.61 2.01 -1.26 -4.75 115.64 116.19 1iin s THR 156 Ca 0.00 1.85 -0.29 0.00 0.31 0.00 0.00 61.69 63.56 1iin s THR 156 Cb 0.00 -4.22 -0.01 0.00 0.01 0.00 0.00 72.50 68.28 1iin s THR 156 CO 0.00 0.44 1.57 0.00 -0.69 0.00 0.00 174.62 175.93 1iin s ALA 157 N -0.64 3.16 -0.86 7.40 0.00 -1.26 -1.40 121.76 128.15 1iin s ALA 157 Ca 0.40 0.25 0.17 0.00 0.00 0.00 0.00 51.96 52.78 1iin s ALA 157 Cb -0.23 -3.89 -0.18 0.00 0.00 0.00 0.00 23.12 18.82 1iin s ALA 157 CO 0.28 -2.15 0.74 1.33 0.00 0.00 0.00 175.76 175.95 1iin n VAL 158 N 6.72 0.00 -3.44 0.00 0.24 0.62 -4.98 118.33 117.50 1iin n VAL 158 Ca 0.19 -0.11 -0.12 0.00 -2.04 0.00 0.00 64.34 62.26 1iin n VAL 158 Cb 0.46 1.01 -0.02 0.00 -1.47 0.00 0.00 33.84 33.82 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 -2.59 -0.55 -0.05 -1.34 1.04 -1.18 -4.98 113.70 104.04 1iin s SER 159 Ca 0.07 0.09 -0.02 0.00 0.48 0.00 0.00 55.95 56.57 1iin s SER 159 Cb 0.13 0.56 0.04 0.00 0.10 0.00 0.00 66.02 66.85 1iin s SER 159 CO 0.69 -0.88 0.09 -0.76 0.98 0.00 0.00 173.24 173.37 1iin s LEU 160 N -2.52 0.75 0.01 2.42 1.43 -1.26 -1.48 118.68 118.04 1iin s LEU 160 Ca 0.00 0.18 0.03 0.00 -1.03 0.00 0.00 54.13 53.32 1iin s LEU 160 Cb -0.01 0.15 -0.01 0.00 0.03 0.00 0.00 46.19 46.34 1iin s LEU 160 CO -0.10 -0.16 -0.10 -1.61 0.23 0.00 0.00 176.35 174.62 1iin s GLU 161 N 1.31 0.74 -0.35 1.70 2.02 -0.55 -4.97 118.70 118.60 1iin s GLU 161 Ca -0.07 -0.49 -0.17 0.00 0.02 0.00 0.00 54.97 54.26 1iin s GLU 161 Cb -0.12 -0.70 -0.01 0.00 0.10 0.00 0.00 34.13 33.41 1iin s GLU 161 CO -0.05 0.18 0.46 -2.00 0.02 0.00 0.00 175.26 173.87 1iin s GLU 162 N -0.65 3.58 -1.11 1.61 2.56 -1.26 0.17 118.70 123.60 1iin s GLU 162 Ca 0.01 -0.28 -0.23 0.00 0.00 0.00 0.00 54.97 54.47 1iin s GLU 162 Cb -0.05 -3.81 0.02 0.00 2.00 0.00 0.00 34.13 32.28 1iin s GLU 162 CO 0.00 -0.61 0.71 1.63 -0.56 0.00 0.00 175.26 176.43 1iin n LYS 163 N 5.61 -0.84 -2.22 4.30 5.02 0.60 -4.92 118.16 125.72 1iin n LYS 163 Ca -0.06 0.38 -0.38 0.00 -2.02 0.00 0.00 58.31 56.23 1iin n LYS 163 Cb 0.49 -3.20 -0.01 0.00 -0.02 0.00 0.00 35.03 32.29 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 -6.33 3.82 0.29 1.97 0.04 -1.26 -4.92 135.00 128.60 1iin s PRO 164 Ca 0.39 1.85 0.13 0.00 0.04 0.00 0.00 61.00 63.41 1iin s PRO 164 Cb -0.18 -2.50 0.37 0.00 0.04 0.00 0.00 34.50 32.23 1iin s PRO 164 CO 0.91 -0.52 1.60 -0.07 0.04 0.00 0.00 177.00 178.96 1iin h LEU 165 N 2.22 0.00 -6.82 -3.56 3.38 -1.91 -3.34 115.31 105.27 1iin h LEU 165 Ca -0.49 0.00 -0.61 0.00 0.09 0.00 0.00 57.88 56.87 1iin h LEU 165 Cb 1.25 0.00 -0.41 0.00 0.09 0.00 0.00 40.66 41.58 1iin h LEU 165 CO 0.61 0.58 -0.64 0.00 0.09 0.00 0.00 178.44 179.07 1iin n GLN 166 N -3.62 1.69 -1.62 1.13 6.02 -1.26 -4.99 117.38 114.74 1iin n GLN 166 Ca -0.00 -4.31 -0.48 0.00 -0.01 0.00 0.00 57.00 52.19 1iin n GLN 166 Cb 0.63 -2.17 -0.04 0.00 1.02 0.00 0.00 30.24 29.68 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 1.89 1.51 0.00 -1.09 -0.02 -1.25 -4.84 135.00 131.19 1iin n PRO 167 Ca 0.23 0.54 0.15 0.00 -2.02 0.00 0.00 63.50 62.40 1iin n PRO 167 Cb 0.38 -2.15 0.78 0.00 -0.02 0.00 0.00 33.50 32.50 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 2.24 0.67 -3.82 -0.52 5.02 -1.26 -4.88 118.16 115.61 1iin n LYS 168 Ca 0.15 -0.07 -0.03 0.00 -2.02 0.00 0.00 58.31 56.34 1iin n LYS 168 Cb 0.25 -1.50 0.01 0.00 -0.02 0.00 0.00 35.03 33.77 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 -2.37 -0.07 -0.11 4.39 1.04 -1.26 -4.83 113.70 110.50 1iin s SER 169 Ca 0.35 -0.57 0.17 0.00 0.48 0.00 0.00 55.95 56.37 1iin s SER 169 Cb 0.21 0.50 0.62 0.00 0.10 0.00 0.00 66.02 67.45 1iin s SER 169 CO 0.43 -0.96 1.54 0.59 0.98 0.00 0.00 173.24 175.82 1iin n ASN 170 N -0.92 4.34 -4.52 7.02 3.02 -1.26 -4.80 115.26 118.14 1iin n ASN 170 Ca -0.05 -2.48 -0.42 0.00 -0.03 0.00 0.00 54.58 51.61 1iin n ASN 170 Cb 0.60 -0.52 -0.09 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 -1.89 3.18 0.20 3.10 1.51 -1.26 -0.80 117.35 121.40 1iin s TYR 171 Ca 0.45 -0.16 -0.13 0.00 -1.01 0.00 0.00 57.07 56.22 1iin s TYR 171 Cb 0.30 -2.84 -0.07 0.00 -0.11 0.00 0.00 41.96 39.23 1iin s TYR 171 CO 0.20 -0.59 0.58 0.00 -1.11 0.00 0.00 175.55 174.63 1iin s ALA 172 N 2.16 3.53 -0.35 3.71 0.00 -0.29 -1.66 121.76 128.87 1iin s ALA 172 Ca 0.13 -0.14 -0.19 0.00 0.00 0.00 0.00 51.96 51.76 1iin s ALA 172 Cb -0.16 -2.54 -0.00 0.00 0.00 0.00 0.00 23.12 20.41 1iin s ALA 172 CO 0.13 0.45 0.58 0.08 0.00 0.00 0.00 175.76 177.00 1iin s VAL 173 N -1.67 4.95 1.31 0.00 1.01 0.34 -0.81 120.40 125.53 1iin s VAL 173 Ca 0.44 0.52 -0.21 0.00 0.00 0.00 0.00 61.98 62.73 1iin s VAL 173 Cb -0.13 -4.02 0.32 0.00 0.00 0.00 0.00 36.38 32.56 1iin s VAL 173 CO 0.20 -0.25 1.03 0.42 0.00 0.00 0.00 175.10 176.50 1iin s THR 174 N 2.56 1.42 -0.44 3.92 -4.23 -0.07 -4.58 115.64 114.22 1iin s THR 174 Ca 0.22 0.00 0.02 0.00 -1.18 0.00 0.00 61.69 60.75 1iin s THR 174 Cb -0.15 -2.29 0.20 0.00 1.34 0.00 0.00 72.50 71.59 1iin s THR 174 CO 0.14 0.00 1.05 0.61 -0.54 0.00 0.00 174.62 175.87 1iin n GLY 175 N 0.13 2.29 3.11 3.99 0.00 -1.26 -4.78 105.19 108.68 1iin n GLY 175 Ca 0.13 -0.27 -0.30 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.80 1.90 0.01 0.99 2.96 -1.26 -1.00 118.68 121.47 1iin s LEU 176 Ca 0.15 -0.51 0.02 0.00 -0.22 0.00 0.00 54.13 53.56 1iin s LEU 176 Cb 0.12 -1.26 -0.01 0.00 0.50 0.00 0.00 46.19 45.54 1iin s LEU 176 CO 0.03 0.04 -0.05 -0.31 -1.32 0.00 0.00 176.35 174.74 1iin s TYR 177 N 0.94 0.48 -0.16 5.38 1.51 0.49 -4.02 117.35 121.96 1iin s TYR 177 Ca -0.06 -0.17 0.01 0.00 -1.01 0.00 0.00 57.07 55.84 1iin s TYR 177 Cb -0.15 -0.30 0.01 0.00 -0.11 0.00 0.00 41.96 41.41 1iin s TYR 177 CO -0.02 -0.03 -0.20 -0.06 -1.11 0.00 0.00 175.55 174.13 1iin s PHE 178 N -0.38 2.73 0.16 2.71 0.40 0.09 0.25 117.98 123.94 1iin s PHE 178 Ca -0.01 -1.43 0.09 0.00 -0.60 0.00 0.00 56.93 54.98 1iin s PHE 178 Cb -0.04 -1.87 -0.04 0.00 0.51 0.00 0.00 43.02 41.58 1iin s PHE 178 CO -0.00 -0.68 -0.19 0.71 0.70 0.00 0.00 175.22 175.75 1iin s TYR 179 N 1.03 1.90 0.78 0.36 1.51 -0.38 -0.78 117.35 121.77 1iin s TYR 179 Ca -0.02 -0.45 -0.03 0.00 -1.01 0.00 0.00 57.07 55.57 1iin s TYR 179 Cb -0.14 -0.95 0.15 0.00 -0.11 0.00 0.00 41.96 40.90 1iin s TYR 179 CO -0.06 0.35 1.07 0.16 -1.11 0.00 0.00 175.55 175.95 1iin s ASP 180 N -2.60 4.03 0.54 2.29 1.47 -0.88 -1.05 116.67 120.48 1iin s ASP 180 Ca 0.16 -0.34 0.36 0.00 1.18 0.00 0.00 52.55 53.91 1iin s ASP 180 Cb -0.06 0.08 1.88 0.00 -0.34 0.00 0.00 42.92 44.48 1iin s ASP 180 CO 0.07 -2.09 2.11 -1.13 0.68 0.00 0.00 175.17 174.81 1iin h ASN 181 N -0.76 0.00 0.57 2.11 -0.73 -1.85 -2.81 115.58 112.11 1iin h ASN 181 Ca -0.37 0.00 0.00 0.00 1.87 0.00 0.00 56.30 57.80 1iin h ASN 181 Cb 1.26 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.85 1iin h ASN 181 CO 0.38 0.00 0.00 -1.54 -0.37 0.00 0.00 177.43 175.90 1iin n SER 182 N -2.84 0.34 0.13 1.15 3.41 -1.26 -3.13 113.62 111.42 1iin n SER 182 Ca -0.02 0.59 0.04 0.00 -0.26 0.00 0.00 58.87 59.23 1iin n SER 182 Cb 0.11 -0.66 0.46 0.00 -0.26 0.00 0.00 64.21 63.87 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 1.11 -0.26 -3.33 3.04 -1.88 -3.00 116.25 111.94 1iin h VAL 183 Ca 0.00 -0.43 0.02 0.00 -1.01 0.00 0.00 66.70 65.28 1iin h VAL 183 Cb 0.29 0.97 -0.02 0.00 -2.01 0.00 0.00 31.29 30.52 1iin h VAL 183 CO 0.00 0.14 0.12 0.58 -1.01 0.00 0.00 177.57 177.40 1iin h VAL 184 N 0.25 0.98 -0.07 1.51 2.07 -1.82 -0.85 116.25 118.33 1iin h VAL 184 Ca 0.06 -0.09 -0.10 0.00 0.82 0.00 0.00 66.70 67.39 1iin h VAL 184 Cb 0.16 0.70 -0.01 0.00 -1.52 0.00 0.00 31.29 30.62 1iin h VAL 184 CO 0.00 0.05 -0.40 -0.08 0.02 0.00 0.00 177.57 177.16 1iin h GLU 185 N 0.26 0.15 -0.14 1.57 4.57 -1.78 -1.86 114.58 117.35 1iin h GLU 185 Ca 0.11 -0.07 -0.01 0.00 -1.18 0.00 0.00 59.36 58.21 1iin h GLU 185 Cb 0.04 -0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.62 1iin h GLU 185 CO -0.08 0.53 0.06 0.52 -1.18 0.00 0.00 179.01 178.87 1iin h MET 186 N 0.13 0.21 -0.68 1.92 2.86 -1.29 -2.64 114.93 115.44 1iin h MET 186 Ca 0.01 -0.03 0.01 0.00 -2.06 0.00 0.00 59.70 57.62 1iin h MET 186 Cb 0.77 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 32.36 1iin h MET 186 CO 0.06 0.28 0.45 0.00 1.06 0.00 0.00 176.91 178.76 1iin h ALA 187 N 0.92 0.86 0.00 6.32 0.00 -0.92 -2.00 119.26 124.45 1iin h ALA 187 Ca 0.05 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1iin h ALA 187 Cb 0.15 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 1iin h ALA 187 CO -0.01 0.30 -0.05 0.87 0.00 0.00 0.00 179.25 180.36 1iin h LYS 188 N 0.92 0.00 -0.08 0.00 1.57 -1.22 -2.71 116.57 115.07 1iin h LYS 188 Ca 0.25 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.03 1iin h LYS 188 Cb -0.10 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.21 1iin h LYS 188 CO -0.05 0.05 0.00 0.09 -0.57 0.00 0.00 179.45 178.97 1iin n ASN 189 N -3.30 2.78 -4.77 0.86 3.02 -0.88 -4.98 115.26 107.98 1iin n ASN 189 Ca -0.01 -1.86 -0.39 0.00 -0.03 0.00 0.00 54.58 52.28 1iin n ASN 189 Cb 0.22 -0.04 -0.04 0.00 -0.61 0.00 0.00 39.78 39.31 1iin n ASN 189 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1iin s LEU 190 N -1.64 4.41 -0.09 3.41 1.43 -0.80 -5.04 118.68 120.36 1iin s LEU 190 Ca 0.25 2.24 -0.05 0.00 -1.03 0.00 0.00 54.13 55.55 1iin s LEU 190 Cb 0.17 -3.81 -0.04 0.00 0.03 0.00 0.00 46.19 42.55 1iin s LEU 190 CO 0.26 -0.31 0.11 -0.54 0.23 0.00 0.00 176.35 176.10 1iin s LYS 191 N -1.81 3.30 0.66 1.70 1.02 -1.26 -5.02 119.74 118.33 1iin s LYS 191 Ca 0.49 -0.25 -0.17 0.00 0.02 0.00 0.00 55.97 56.07 1iin s LYS 191 Cb -0.30 -3.06 -0.04 0.00 -0.52 0.00 0.00 37.83 33.91 1iin s LYS 191 CO 0.38 0.74 0.76 -0.35 -0.92 0.00 0.00 175.35 175.96 1iin n PRO 192 N 1.82 0.56 -2.14 -1.68 -0.04 -1.26 -4.82 135.00 127.44 1iin n PRO 192 Ca -0.18 0.23 -0.28 0.00 -0.04 0.00 0.00 63.50 63.24 1iin n PRO 192 Cb 0.54 -2.00 0.16 0.00 -0.04 0.00 0.00 33.50 32.16 1iin n PRO 192 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1iin s SER 193 N -1.39 3.51 0.39 3.54 1.04 0.18 -4.76 113.70 116.21 1iin s SER 193 Ca 0.71 0.06 0.16 0.00 0.48 0.00 0.00 55.95 57.36 1iin s SER 193 Cb -0.39 -0.21 1.03 0.00 0.10 0.00 0.00 66.02 66.56 1iin s SER 193 CO 0.52 -2.45 1.81 0.00 0.98 0.00 0.00 173.24 174.10 1iin h ALA 194 N -1.28 2.13 -0.18 5.32 0.00 -1.94 0.63 119.26 123.93 1iin h ALA 194 Ca -0.42 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1iin h ALA 194 Cb 1.24 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1iin h ALA 194 CO 0.39 -0.47 0.00 2.89 0.00 0.00 0.00 179.25 182.05 1iin n ARG 195 N -4.58 1.49 -2.73 0.00 1.85 -1.26 -4.91 116.66 106.52 1iin n ARG 195 Ca 0.22 -0.76 -0.07 0.00 -1.00 0.00 0.00 57.85 56.24 1iin n ARG 195 Cb 0.74 -1.23 0.03 0.00 -1.05 0.00 0.00 32.46 30.95 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 0.90 0.37 3.04 2.89 0.00 0.22 -5.06 105.19 107.54 1iin n GLY 196 Ca 0.10 -0.34 -0.08 0.00 0.00 0.00 0.00 46.02 45.69 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 -5.11 0.46 -0.54 1.61 2.02 -1.25 -4.77 118.70 111.12 1iin s GLU 197 Ca 0.13 -0.90 -0.22 0.00 0.02 0.00 0.00 54.97 53.99 1iin s GLU 197 Cb -0.06 0.16 0.05 0.00 0.10 0.00 0.00 34.13 34.38 1iin s GLU 197 CO 0.24 -0.08 0.84 -0.51 0.02 0.00 0.00 175.26 175.77 1iin s LEU 198 N -2.17 4.38 -0.04 1.80 1.43 0.58 -0.65 118.68 124.01 1iin s LEU 198 Ca -0.05 -0.54 -0.30 0.00 -1.03 0.00 0.00 54.13 52.21 1iin s LEU 198 Cb -0.01 -2.70 -0.03 0.00 0.03 0.00 0.00 46.19 43.48 1iin s LEU 198 CO -0.05 -1.12 1.09 -1.61 0.23 0.00 0.00 176.35 174.89 1iin s GLU 199 N 3.52 4.43 0.40 1.70 0.41 -1.26 -1.72 118.70 126.18 1iin s GLU 199 Ca 0.25 1.54 0.13 0.00 -0.41 0.00 0.00 54.97 56.49 1iin s GLU 199 Cb -0.15 -3.50 0.84 0.00 -1.78 0.00 0.00 34.13 29.53 1iin s GLU 199 CO 0.17 -0.30 1.89 0.97 -0.49 0.00 0.00 175.26 177.50 1iin h ILE 200 N 4.93 1.21 -0.20 -1.63 6.09 -1.95 -2.05 117.51 123.91 1iin h ILE 200 Ca -0.35 -1.02 -0.05 0.00 -1.37 0.00 0.00 64.86 62.07 1iin h ILE 200 Cb 1.18 1.55 -0.01 0.00 0.47 0.00 0.00 36.82 40.00 1iin h ILE 200 CO 0.84 0.29 -0.11 0.74 -3.07 0.00 0.00 178.15 176.84 1iin h THR 201 N 0.00 1.19 -0.46 2.19 2.02 -1.99 -0.14 112.91 115.73 1iin h THR 201 Ca -0.00 -0.82 -0.12 0.00 0.77 0.00 0.00 66.41 66.24 1iin h THR 201 Cb 0.53 1.16 -0.01 0.00 -1.74 0.00 0.00 68.15 68.08 1iin h THR 201 CO 0.04 0.26 -0.18 0.44 0.37 0.00 0.00 175.52 176.45 1iin h ASP 202 N 0.30 0.95 -0.54 4.18 3.32 -1.78 -0.42 116.42 122.43 1iin h ASP 202 Ca 0.06 -0.39 0.01 0.00 0.02 0.00 0.00 57.03 56.74 1iin h ASP 202 Cb 0.38 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.64 1iin h ASP 202 CO 0.02 1.12 0.35 0.40 -1.72 0.00 0.00 179.24 179.41 1iin h ILE 203 N 0.77 1.11 -0.15 0.35 2.04 -1.21 -1.75 117.51 118.67 1iin h ILE 203 Ca 0.11 -0.24 -0.08 0.00 1.00 0.00 0.00 64.86 65.65 1iin h ILE 203 Cb 0.74 0.34 -0.01 0.00 -0.74 0.00 0.00 36.82 37.16 1iin h ILE 203 CO 0.06 0.13 -0.26 0.78 0.00 0.00 0.00 178.15 178.86 1iin h ASN 204 N 0.70 0.26 0.14 1.72 2.35 -0.77 -2.52 115.58 117.47 1iin h ASN 204 Ca 0.21 -0.08 -0.12 0.00 -0.55 0.00 0.00 56.30 55.75 1iin h ASN 204 Cb -0.04 -0.07 -0.01 0.00 0.05 0.00 0.00 38.32 38.25 1iin h ASN 204 CO -0.07 0.53 -0.44 -0.09 -1.65 0.00 0.00 177.43 175.71 1iin h ARG 205 N 0.24 0.38 -0.29 0.81 2.43 -0.61 -0.44 114.38 116.89 1iin h ARG 205 Ca 0.04 -0.20 0.00 0.00 -0.81 0.00 0.00 59.98 59.01 1iin h ARG 205 Cb 0.59 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.13 1iin h ARG 205 CO 0.04 0.75 0.18 0.82 -1.51 0.00 0.00 179.97 180.26 1iin h ILE 206 N 0.31 1.09 -0.34 1.20 2.04 -0.90 0.27 117.51 121.18 1iin h ILE 206 Ca 0.02 -0.20 -0.03 0.00 1.00 0.00 0.00 64.86 65.65 1iin h ILE 206 Cb 0.90 0.70 -0.01 0.00 -0.74 0.00 0.00 36.82 37.67 1iin h ILE 206 CO 0.08 0.09 0.11 1.88 0.00 0.00 0.00 178.15 180.31 1iin h TYR 207 N 0.38 0.55 -0.40 1.37 -1.99 -1.33 -2.58 116.97 112.97 1iin h TYR 207 Ca 0.11 -0.05 0.04 0.00 2.00 0.00 0.00 58.73 60.83 1iin h TYR 207 Cb -0.01 -0.16 -0.04 0.00 2.00 0.00 0.00 36.73 38.52 1iin h TYR 207 CO -0.05 0.54 0.16 1.98 -0.00 0.00 0.00 178.16 180.78 1iin h MET 208 N 0.40 0.32 0.00 4.88 1.85 -0.58 -0.75 114.93 121.05 1iin h MET 208 Ca 0.11 -0.02 0.00 0.00 -0.61 0.00 0.00 59.70 59.18 1iin h MET 208 Cb 0.25 -0.07 0.00 0.00 0.43 0.00 0.00 31.60 32.20 1iin h MET 208 CO -0.00 0.21 0.00 0.93 -0.40 0.00 0.00 176.91 177.65 1iin h GLU 209 N 0.33 0.00 -0.13 0.39 5.08 -0.33 -0.21 114.58 119.71 1iin h GLU 209 Ca 0.18 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.54 1iin h GLU 209 Cb 0.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.40 1iin h GLU 209 CO -0.17 0.00 0.00 1.04 -1.00 0.00 0.00 179.01 178.88 1iin n GLN 210 N -2.82 1.82 -1.52 2.33 6.02 -0.63 -4.90 117.38 117.68 1iin n GLN 210 Ca -0.00 -1.22 -0.11 0.00 -0.01 0.00 0.00 57.00 55.66 1iin n GLN 210 Cb 0.21 -1.43 -0.04 0.00 1.02 0.00 0.00 30.24 30.00 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 1.19 0.90 0.63 1.08 0.00 -0.09 -4.91 105.19 103.99 1iin n GLY 211 Ca 0.17 -0.52 0.06 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.53 2.85 -3.77 1.61 1.74 -0.38 -4.98 116.66 111.19 1iin n ARG 212 Ca -0.11 -2.23 -0.36 0.00 -0.77 0.00 0.00 57.85 54.38 1iin n ARG 212 Cb 0.41 -1.41 -0.11 0.00 -1.02 0.00 0.00 32.46 30.33 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 -1.54 3.77 -0.10 0.55 2.96 -1.21 -1.61 118.68 121.50 1iin s LEU 213 Ca 0.26 -0.04 -0.08 0.00 -0.22 0.00 0.00 54.13 54.05 1iin s LEU 213 Cb 0.17 -2.01 -0.04 0.00 0.50 0.00 0.00 46.19 44.81 1iin s LEU 213 CO 0.12 0.03 0.18 -0.44 -1.32 0.00 0.00 176.35 174.92 1iin s SER 214 N 1.25 6.45 -0.28 3.68 0.01 -0.03 -4.91 113.70 119.86 1iin s SER 214 Ca 0.06 0.54 0.02 0.00 1.31 0.00 0.00 55.95 57.87 1iin s SER 214 Cb -0.14 -2.09 0.06 0.00 0.21 0.00 0.00 66.02 64.06 1iin s SER 214 CO 0.05 0.40 -0.06 -0.69 0.41 0.00 0.00 173.24 173.35 1iin s VAL 215 N -1.04 2.41 -0.19 3.43 1.01 -1.26 -1.94 120.40 122.82 1iin s VAL 215 Ca 0.16 -1.68 -0.21 0.00 0.00 0.00 0.00 61.98 60.25 1iin s VAL 215 Cb -0.13 -2.46 -0.03 0.00 0.00 0.00 0.00 36.38 33.77 1iin s VAL 215 CO 0.05 -0.14 0.63 0.00 0.00 0.00 0.00 175.10 175.64 1iin s ALA 216 N 1.11 3.53 0.01 5.51 0.00 -0.46 -4.91 121.76 126.55 1iin s ALA 216 Ca -0.05 -0.25 -0.30 0.00 0.00 0.00 0.00 51.96 51.35 1iin s ALA 216 Cb -0.20 -2.96 -0.04 0.00 0.00 0.00 0.00 23.12 19.92 1iin s ALA 216 CO -0.04 -0.52 1.11 1.41 0.00 0.00 0.00 175.76 177.71 1iin s MET 217 N 1.82 4.47 -0.42 0.00 1.75 -1.26 -1.44 119.30 124.22 1iin s MET 217 Ca 0.29 1.60 -0.10 0.00 -1.25 0.00 0.00 55.69 56.23 1iin s MET 217 Cb -0.16 -3.43 0.07 0.00 2.84 0.00 0.00 34.83 34.15 1iin s MET 217 CO 0.11 -0.21 0.27 1.41 -0.65 0.00 0.00 175.02 175.95 1iin s MET 218 N 1.26 2.69 1.17 4.11 0.00 -0.19 -4.91 119.30 123.44 1iin s MET 218 Ca 0.55 -1.39 -0.13 0.00 0.00 0.00 0.00 55.69 54.73 1iin s MET 218 Cb -0.25 -3.83 0.28 0.00 0.00 0.00 0.00 34.83 31.03 1iin s MET 218 CO 0.27 -0.93 0.98 0.41 0.00 0.00 0.00 175.02 175.75 1iin n GLY 219 N 4.97 -1.98 0.00 2.11 0.00 -1.26 -4.50 105.19 104.53 1iin n GLY 219 Ca -0.11 -1.15 0.07 0.00 0.00 0.00 0.00 46.02 44.84 1iin n GLY 219 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1iin n ARG 220 N -4.84 0.06 0.01 1.61 1.85 -1.26 -1.61 116.66 112.48 1iin n ARG 220 Ca 0.03 0.23 0.10 0.00 -1.00 0.00 0.00 57.85 57.21 1iin n ARG 220 Cb 0.54 -1.50 0.45 0.00 -1.05 0.00 0.00 32.46 30.90 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 -0.06 -1.24 3.89 2.89 0.00 -1.26 -4.74 105.19 104.67 1iin n GLY 221 Ca 0.04 -0.06 -0.25 0.00 0.00 0.00 0.00 46.02 45.75 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 -3.02 3.33 -0.08 1.61 1.51 -0.63 -4.68 117.35 115.39 1iin s TYR 222 Ca 0.10 0.03 0.04 0.00 -1.01 0.00 0.00 57.07 56.22 1iin s TYR 222 Cb 0.13 -1.58 -0.02 0.00 -0.11 0.00 0.00 41.96 40.39 1iin s TYR 222 CO 0.39 0.51 -0.19 0.00 -1.11 0.00 0.00 175.55 175.15 1iin s ALA 223 N -1.82 2.44 -0.46 3.71 0.00 -0.16 -4.97 121.76 120.49 1iin s ALA 223 Ca 0.33 -0.98 0.04 0.00 0.00 0.00 0.00 51.96 51.35 1iin s ALA 223 Cb -0.10 -0.91 0.12 0.00 0.00 0.00 0.00 23.12 22.23 1iin s ALA 223 CO 0.27 0.41 0.20 -0.46 0.00 0.00 0.00 175.76 176.17 1iin s TRP 224 N -0.17 3.20 -0.07 0.00 -0.00 -1.26 -0.95 118.94 119.69 1iin s TRP 224 Ca -0.02 -3.04 -0.30 0.00 -0.00 0.00 0.00 56.10 52.74 1iin s TRP 224 Cb -0.14 -2.75 -0.05 0.00 -0.00 0.00 0.00 33.47 30.54 1iin s TRP 224 CO 0.04 -0.80 1.50 -0.51 -0.00 0.00 0.00 176.95 177.17 1iin s LEU 225 N 0.10 4.29 0.41 5.86 1.43 -0.71 -4.99 118.68 125.07 1iin s LEU 225 Ca 0.15 2.08 -0.25 0.00 -1.03 0.00 0.00 54.13 55.08 1iin s LEU 225 Cb -0.24 -3.54 -0.08 0.00 0.03 0.00 0.00 46.19 42.36 1iin s LEU 225 CO -0.03 -0.84 1.17 -0.62 0.23 0.00 0.00 176.35 176.26 1iin s ASP 226 N 2.65 6.45 -0.07 2.29 2.15 -1.26 -4.41 116.67 124.47 1iin s ASP 226 Ca 0.67 2.33 0.10 0.00 0.43 0.00 0.00 52.55 56.08 1iin s ASP 226 Cb -0.30 -2.61 0.16 0.00 -0.30 0.00 0.00 42.92 39.87 1iin s ASP 226 CO 0.25 -0.73 1.08 0.35 -0.17 0.00 0.00 175.17 175.95 1iin n THR 227 N -0.06 1.06 0.67 1.71 -2.24 -1.26 -4.30 114.28 109.87 1iin n THR 227 Ca 0.05 -1.27 0.13 0.00 -2.27 0.00 0.00 64.05 60.69 1iin n THR 227 Cb 0.47 0.10 0.40 0.00 -2.10 0.00 0.00 70.33 69.19 1iin n THR 227 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1iin n GLY 228 N -0.80 -1.63 3.22 3.38 0.00 -1.26 -4.78 105.19 103.31 1iin n GLY 228 Ca 0.09 -0.07 -0.13 0.00 0.00 0.00 0.00 46.02 45.91 1iin n GLY 228 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1iin s THR 229 N -3.10 0.50 0.33 2.61 -4.23 -1.26 -4.73 115.64 105.76 1iin s THR 229 Ca 0.10 -1.96 0.02 0.00 -1.18 0.00 0.00 61.69 58.67 1iin s THR 229 Cb 0.13 -2.13 0.22 0.00 1.34 0.00 0.00 72.50 72.07 1iin s THR 229 CO 0.61 -0.45 1.95 0.45 -0.54 0.00 0.00 174.62 176.64 1iin h HIS 230 N 2.73 0.78 -0.42 3.99 3.86 -1.91 -1.53 115.15 122.65 1iin h HIS 230 Ca -0.36 -0.02 -0.09 0.00 -1.16 0.00 0.00 60.37 58.74 1iin h HIS 230 Cb 1.20 -0.25 -0.01 0.00 1.06 0.00 0.00 27.41 29.41 1iin h HIS 230 CO 0.50 0.56 -0.09 0.37 0.86 0.00 0.00 177.93 180.14 1iin h GLN 231 N 0.79 0.79 -0.08 2.45 5.75 -1.99 -2.75 115.11 120.08 1iin h GLN 231 Ca 0.20 -0.30 -0.10 0.00 -0.15 0.00 0.00 58.65 58.30 1iin h GLN 231 Cb 0.06 -0.05 -0.01 0.00 1.07 0.00 0.00 27.48 28.55 1iin h GLN 231 CO -0.03 0.91 -0.42 0.66 -2.65 0.00 0.00 178.83 177.31 1iin h SER 232 N 0.62 0.18 -0.38 -0.69 4.64 -1.72 -1.95 113.55 114.25 1iin h SER 232 Ca 0.11 -0.07 -0.03 0.00 -0.47 0.00 0.00 61.79 61.33 1iin h SER 232 Cb 0.61 -0.05 -0.02 0.00 -0.31 0.00 0.00 62.40 62.63 1iin h SER 232 CO 0.04 0.58 0.14 -0.07 -0.87 0.00 0.00 176.83 176.64 1iin h LEU 233 N 0.14 0.53 -0.84 5.97 3.38 -1.18 0.39 115.31 123.71 1iin h LEU 233 Ca 0.01 -0.18 -0.12 0.00 0.09 0.00 0.00 57.88 57.68 1iin h LEU 233 Cb 0.80 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.39 1iin h LEU 233 CO 0.06 0.57 -0.58 0.16 0.09 0.00 0.00 178.44 178.75 1iin h ILE 234 N 0.46 1.41 -0.35 1.22 3.07 -1.29 -1.27 117.51 120.76 1iin h ILE 234 Ca 0.12 -1.98 -0.08 0.00 1.55 0.00 0.00 64.86 64.47 1iin h ILE 234 Cb 0.22 2.07 -0.02 0.00 -0.27 0.00 0.00 36.82 38.82 1iin h ILE 234 CO -0.01 0.57 -0.13 -0.33 -1.05 0.00 0.00 178.15 177.20 1iin h GLU 235 N 0.00 0.62 -0.12 0.16 5.08 -1.00 -1.12 114.58 118.20 1iin h GLU 235 Ca -0.01 -0.19 -0.02 0.00 -1.00 0.00 0.00 59.36 58.14 1iin h GLU 235 Cb 1.03 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 30.21 1iin h GLU 235 CO 0.08 0.73 -0.01 0.00 -1.00 0.00 0.00 179.01 178.80 1iin h ALA 236 N 1.30 0.16 -0.65 3.43 0.00 -0.51 -0.71 119.26 122.28 1iin h ALA 236 Ca 0.10 -0.20 0.03 0.00 0.00 0.00 0.00 54.91 54.84 1iin h ALA 236 Cb 0.55 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.26 1iin h ALA 236 CO 0.03 -0.13 0.40 0.77 0.00 0.00 0.00 179.25 180.32 1iin h SER 237 N -0.08 0.64 -0.53 0.00 0.02 -1.07 -1.66 113.55 110.87 1iin h SER 237 Ca 0.03 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 60.92 1iin h SER 237 Cb 0.39 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 62.78 1iin h SER 237 CO 0.01 0.44 0.09 0.78 -1.14 0.00 0.00 176.83 177.01 1iin h ASN 238 N 0.77 0.88 0.10 3.07 2.35 -1.11 -0.71 115.58 120.93 1iin h ASN 238 Ca 0.27 -0.19 -0.00 0.00 -0.55 0.00 0.00 56.30 55.82 1iin h ASN 238 Cb 0.04 -0.23 0.00 0.00 0.05 0.00 0.00 38.32 38.18 1iin h ASN 238 CO -0.11 0.89 -0.05 0.15 -1.65 0.00 0.00 177.43 176.66 1iin h PHE 239 N 0.87 -0.12 -0.62 1.19 3.57 -0.70 0.29 116.94 121.43 1iin h PHE 239 Ca 0.18 -0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.64 1iin h PHE 239 Cb 0.39 0.04 -0.03 0.00 2.79 0.00 0.00 35.95 39.14 1iin h PHE 239 CO 0.02 -0.07 0.23 0.82 -2.23 0.00 0.00 178.31 177.08 1iin h ILE 240 N -0.13 1.24 -0.75 1.41 1.08 -1.18 -2.52 117.51 116.66 1iin h ILE 240 Ca -0.01 -0.76 -0.02 0.00 -0.39 0.00 0.00 64.86 63.67 1iin h ILE 240 Cb 0.10 0.56 -0.04 0.00 -3.07 0.00 0.00 36.82 34.38 1iin h ILE 240 CO 0.02 0.30 0.40 0.00 -0.69 0.00 0.00 178.15 178.18 1iin h ALA 241 N 1.09 0.96 -0.41 1.87 0.00 -0.95 -0.17 119.26 121.65 1iin h ALA 241 Ca 0.21 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 55.01 1iin h ALA 241 Cb 0.23 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 1iin h ALA 241 CO -0.01 0.49 0.23 1.15 0.00 0.00 0.00 179.25 181.10 1iin h THR 242 N 1.04 1.02 -0.02 0.00 2.02 -0.74 -0.52 112.91 115.71 1iin h THR 242 Ca 0.26 -0.16 -0.00 0.00 0.77 0.00 0.00 66.41 67.28 1iin h THR 242 Cb 0.06 0.52 -0.00 0.00 -1.74 0.00 0.00 68.15 66.98 1iin h THR 242 CO -0.04 0.08 0.00 0.40 0.37 0.00 0.00 175.52 176.34 1iin h ILE 243 N 0.46 1.22 -0.41 3.11 2.04 -1.18 -2.90 117.51 119.85 1iin h ILE 243 Ca 0.17 -0.66 -0.06 0.00 1.00 0.00 0.00 64.86 65.31 1iin h ILE 243 Cb 0.04 1.64 -0.02 0.00 -0.74 0.00 0.00 36.82 37.74 1iin h ILE 243 CO -0.09 0.17 0.03 -0.33 0.00 0.00 0.00 178.15 177.93 1iin h GLU 244 N -0.24 0.71 -0.35 2.37 5.08 -0.90 -1.91 114.58 119.33 1iin h GLU 244 Ca 0.00 -0.21 -0.09 0.00 -1.00 0.00 0.00 59.36 58.06 1iin h GLU 244 Cb 0.28 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 1iin h GLU 244 CO 0.00 0.78 -0.17 0.93 -1.00 0.00 0.00 179.01 179.55 1iin h GLU 245 N 0.55 0.64 -0.24 2.33 4.39 -1.19 0.24 114.58 121.32 1iin h GLU 245 Ca 0.12 -0.22 -0.12 0.00 0.34 0.00 0.00 59.36 59.48 1iin h GLU 245 Cb 0.43 -0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 29.03 1iin h GLU 245 CO 0.02 0.78 -0.33 -0.09 -1.16 0.00 0.00 179.01 178.22 1iin h ARG 246 N 0.58 0.64 0.00 2.33 1.12 -1.42 -3.27 114.38 114.35 1iin h ARG 246 Ca 0.09 -0.37 -0.08 0.00 -1.11 0.00 0.00 59.98 58.51 1iin h ARG 246 Cb 0.61 0.03 -0.01 0.00 -0.01 0.00 0.00 29.97 30.59 1iin h ARG 246 CO 0.04 0.99 -0.45 1.96 -3.11 0.00 0.00 179.97 179.40 1iin h GLN 247 N 0.35 0.00 -0.99 0.20 4.20 -1.19 -3.47 115.11 114.21 1iin h GLN 247 Ca 0.03 0.00 -0.20 0.00 0.06 0.00 0.00 58.65 58.53 1iin h GLN 247 Cb 0.91 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.65 1iin h GLN 247 CO 0.08 0.38 -0.22 0.41 -0.67 0.00 0.00 178.83 178.80 1iin n GLY 248 N 1.21 0.51 3.17 3.46 0.00 0.83 -5.02 105.19 109.36 1iin n GLY 248 Ca 0.02 -0.52 -0.15 0.00 0.00 0.00 0.00 46.02 45.37 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 -2.60 2.38 0.16 0.99 1.43 -1.10 -5.06 118.68 114.89 1iin s LEU 249 Ca 0.00 -0.78 0.00 0.00 -1.03 0.00 0.00 54.13 52.33 1iin s LEU 249 Cb 0.00 -0.34 -0.04 0.00 0.03 0.00 0.00 46.19 45.84 1iin s LEU 249 CO 0.00 -0.23 0.33 -0.54 0.23 0.00 0.00 176.35 176.14 1iin s LYS 250 N -2.60 3.49 -0.17 1.70 1.02 -1.26 -4.20 119.74 117.71 1iin s LYS 250 Ca 0.04 -0.43 -0.08 0.00 0.02 0.00 0.00 55.97 55.52 1iin s LYS 250 Cb -0.04 -2.91 -0.04 0.00 -0.52 0.00 0.00 37.83 34.31 1iin s LYS 250 CO 0.01 0.47 0.09 0.08 -0.92 0.00 0.00 175.35 175.08 1iin s VAL 251 N -1.77 5.04 -1.28 3.17 1.01 -1.26 -4.60 120.40 120.71 1iin s VAL 251 Ca 0.37 0.05 -0.02 0.00 0.00 0.00 0.00 61.98 62.38 1iin s VAL 251 Cb -0.11 -3.26 -0.00 0.00 0.00 0.00 0.00 36.38 33.00 1iin s VAL 251 CO 0.28 0.48 0.72 -1.20 0.00 0.00 0.00 175.10 175.39 1iin n SER 252 N 3.25 -1.66 -4.42 3.32 7.64 -1.26 -4.95 113.62 115.54 1iin n SER 252 Ca -0.17 -0.82 -0.44 0.00 1.01 0.00 0.00 58.87 58.45 1iin n SER 252 Cb 0.53 -4.10 -0.07 0.00 -1.01 0.00 0.00 64.21 59.56 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 8.87 0.85 -0.69 0.00 0.13 -1.92 -1.24 132.00 137.99 1iin h PRO 254 Ca -0.28 -0.05 -0.00 0.00 -0.87 0.00 0.00 66.00 64.80 1iin h PRO 254 Cb 1.10 -0.19 -0.03 0.00 0.13 0.00 0.00 31.00 32.01 1iin h PRO 254 CO 0.91 0.56 0.42 0.93 -0.23 0.00 0.00 178.00 180.59 1iin h GLU 255 N 0.87 0.93 -0.20 0.86 3.07 -1.97 0.11 114.58 118.25 1iin h GLU 255 Ca 0.51 -0.08 -0.04 0.00 -0.50 0.00 0.00 59.36 59.25 1iin h GLU 255 Cb 0.66 -0.20 -0.01 0.00 -0.84 0.00 0.00 28.75 28.37 1iin h GLU 255 CO -0.29 0.66 -0.01 1.49 -1.40 0.00 0.00 179.01 179.46 1iin h GLU 256 N 0.94 0.37 -0.47 2.33 4.81 -1.85 -0.75 114.58 119.96 1iin h GLU 256 Ca 0.25 -0.12 0.00 0.00 -0.13 0.00 0.00 59.36 59.35 1iin h GLU 256 Cb -0.03 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.30 1iin h GLU 256 CO -0.05 0.58 0.30 0.82 -0.73 0.00 0.00 179.01 179.93 1iin h ILE 257 N 0.12 1.14 -0.34 2.32 2.04 -0.95 0.20 117.51 122.04 1iin h ILE 257 Ca 0.06 -0.29 0.05 0.00 1.00 0.00 0.00 64.86 65.67 1iin h ILE 257 Cb 0.42 0.48 -0.04 0.00 -0.74 0.00 0.00 36.82 36.94 1iin h ILE 257 CO 0.01 0.14 0.07 0.00 0.00 0.00 0.00 178.15 178.37 1iin h ALA 258 N 1.15 0.36 0.06 1.87 0.00 -0.69 -0.08 119.26 121.92 1iin h ALA 258 Ca 0.17 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 1iin h ALA 258 Cb -0.03 0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1iin h ALA 258 CO -0.03 -0.33 -0.03 0.35 0.00 0.00 0.00 179.25 179.21 1iin h PHE 259 N 0.19 -0.07 -0.40 0.00 3.57 -0.68 0.56 116.94 120.10 1iin h PHE 259 Ca 0.16 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.64 1iin h PHE 259 Cb 0.17 0.02 -0.02 0.00 2.79 0.00 0.00 35.95 38.91 1iin h PHE 259 CO -0.18 0.05 0.17 0.00 -2.23 0.00 0.00 178.31 176.12 1iin h ARG 260 N -0.18 0.56 -0.52 1.11 2.47 -0.31 -1.27 114.38 116.24 1iin h ARG 260 Ca -0.01 -0.07 0.00 0.00 -1.26 0.00 0.00 59.98 58.64 1iin h ARG 260 Cb 0.15 -0.11 0.00 0.00 -1.65 0.00 0.00 29.97 28.36 1iin h ARG 260 CO 0.01 0.46 0.00 1.63 0.56 0.00 0.00 179.97 182.63 1iin n LYS 261 N -4.39 2.36 -3.44 0.04 5.02 -0.07 -4.92 118.16 112.76 1iin n LYS 261 Ca 0.03 -1.74 -0.24 0.00 -2.02 0.00 0.00 58.31 54.33 1iin n LYS 261 Cb 0.13 -1.49 0.05 0.00 -0.02 0.00 0.00 35.03 33.71 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 0.77 -5.91 0.11 4.39 3.02 -0.48 -4.87 115.26 112.29 1iin n ASN 262 Ca 0.16 -0.48 0.00 0.00 -0.03 0.00 0.00 54.58 54.23 1iin n ASN 262 Cb 0.49 -4.71 -0.02 0.00 -0.61 0.00 0.00 39.78 34.92 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 -2.07 0.00 -4.41 3.10 0.05 -0.11 -3.47 116.94 110.03 1iin h PHE 263 Ca -0.55 0.00 -0.20 0.00 3.82 0.00 0.00 57.97 61.04 1iin h PHE 263 Cb 1.37 0.00 -0.14 0.00 2.00 0.00 0.00 35.95 39.17 1iin h PHE 263 CO 0.53 0.62 -0.57 0.96 -0.18 0.00 0.00 178.31 179.67 1iin s ILE 264 N -2.90 0.04 0.51 -0.55 -4.36 -1.13 -4.41 121.20 108.40 1iin s ILE 264 Ca 0.02 -1.88 0.05 0.00 -0.26 0.00 0.00 60.65 58.58 1iin s ILE 264 Cb 0.08 -2.29 0.01 0.00 1.25 0.00 0.00 42.46 41.52 1iin s ILE 264 CO 0.77 -0.17 0.27 0.54 0.24 0.00 0.00 174.94 176.59 1iin s ASN 265 N -3.10 4.48 0.24 4.36 2.20 -1.26 -4.46 114.94 117.40 1iin s ASN 265 Ca 0.31 -1.31 -0.04 0.00 -0.94 0.00 0.00 52.86 50.88 1iin s ASN 265 Cb 0.06 0.29 0.42 0.00 -2.00 0.00 0.00 41.25 40.03 1iin s ASN 265 CO 0.08 -0.95 1.78 0.00 -2.94 0.00 0.00 177.10 175.07 1iin h ALA 266 N 1.01 1.14 -0.75 3.54 0.00 -1.99 -1.53 119.26 120.68 1iin h ALA 266 Ca -0.40 0.06 0.04 0.00 0.00 0.00 0.00 54.91 54.61 1iin h ALA 266 Cb 1.30 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.98 1iin h ALA 266 CO 0.63 -0.01 0.47 1.96 0.00 0.00 0.00 179.25 182.30 1iin h GLN 267 N 0.67 0.87 -0.53 0.00 7.50 -2.00 -0.63 115.11 120.98 1iin h GLN 267 Ca 0.40 -0.05 -0.01 0.00 0.50 0.00 0.00 58.65 59.50 1iin h GLN 267 Cb 0.46 -0.20 -0.03 0.00 0.05 0.00 0.00 27.48 27.77 1iin h GLN 267 CO -0.30 0.58 0.31 0.37 -1.50 0.00 0.00 178.83 178.29 1iin h GLN 268 N 0.90 0.73 -0.73 1.46 5.75 -1.70 -2.89 115.11 118.63 1iin h GLN 268 Ca 0.31 -0.07 0.00 0.00 -0.15 0.00 0.00 58.65 58.74 1iin h GLN 268 Cb 0.06 -0.15 -0.04 0.00 1.07 0.00 0.00 27.48 28.42 1iin h GLN 268 CO -0.13 0.54 0.45 0.28 -2.65 0.00 0.00 178.83 177.32 1iin h VAL 269 N 0.71 1.20 -0.49 2.39 2.07 -0.56 -2.68 116.25 118.89 1iin h VAL 269 Ca 0.19 -0.41 0.05 0.00 0.82 0.00 0.00 66.70 67.35 1iin h VAL 269 Cb 0.01 0.17 -0.05 0.00 -1.52 0.00 0.00 31.29 29.90 1iin h VAL 269 CO -0.03 0.20 0.23 0.40 0.02 0.00 0.00 177.57 178.39 1iin h ILE 270 N 0.99 0.92 -0.80 4.57 2.04 -0.96 -0.52 117.51 123.75 1iin h ILE 270 Ca 0.26 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 65.97 1iin h ILE 270 Cb -0.06 0.44 -0.04 0.00 -0.74 0.00 0.00 36.82 36.41 1iin h ILE 270 CO -0.05 0.08 0.51 -0.33 0.00 0.00 0.00 178.15 178.36 1iin h GLU 271 N 0.44 1.07 -0.03 2.37 5.08 -1.40 -2.16 114.58 119.95 1iin h GLU 271 Ca 0.22 -0.08 -0.07 0.00 -1.00 0.00 0.00 59.36 58.44 1iin h GLU 271 Cb 0.17 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 1iin h GLU 271 CO -0.18 0.73 -0.30 -0.07 -1.00 0.00 0.00 179.01 178.19 1iin h LEU 272 N 1.09 0.06 -1.05 1.33 3.38 -1.05 -2.93 115.31 116.14 1iin h LEU 272 Ca 0.29 -0.02 -0.08 0.00 0.09 0.00 0.00 57.88 58.16 1iin h LEU 272 Cb -0.09 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1iin h LEU 272 CO -0.06 0.36 -0.20 0.00 0.09 0.00 0.00 178.44 178.62 1iin h ALA 273 N 1.65 1.20 -0.18 1.53 0.00 -0.45 -3.35 119.26 119.66 1iin h ALA 273 Ca 0.01 -0.31 0.02 0.00 0.00 0.00 0.00 54.91 54.63 1iin h ALA 273 Cb 0.56 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1iin h ALA 273 CO 0.04 0.52 -0.14 0.78 0.00 0.00 0.00 179.25 180.45 1iin h GLY 274 N 0.97 -2.05 1.61 0.00 0.00 -1.31 0.43 103.07 102.72 1iin h GLY 274 Ca 0.07 0.97 0.00 0.00 0.00 0.00 0.00 47.33 48.36 1iin h GLY 274 CO 0.04 -0.70 0.00 -1.05 0.00 0.00 0.00 176.54 174.83 1iin n PRO 275 N -3.46 0.05 0.00 4.80 -0.02 -1.26 -2.30 135.00 132.82 1iin n PRO 275 Ca -0.00 0.27 0.03 0.00 -2.02 0.00 0.00 63.50 61.77 1iin n PRO 275 Cb 0.07 -1.50 -0.01 0.00 -0.02 0.00 0.00 33.50 32.04 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 -1.30 0.77 0.00 2.45 4.77 -0.17 -4.77 117.00 118.75 1iin n LEU 276 Ca 0.02 -0.70 0.02 0.00 -0.03 0.00 0.00 56.01 55.32 1iin n LEU 276 Cb 0.03 0.00 0.14 0.00 -2.33 0.00 0.00 43.42 41.26 1iin n LEU 276 CO 0.03 0.17 0.41 -1.54 -1.33 0.00 0.00 177.39 175.12 1iin n SER 277 N -0.54 0.00 -0.03 -1.43 3.41 -0.04 -1.45 113.62 113.54 1iin n SER 277 Ca 0.02 -0.07 0.14 0.00 -0.26 0.00 0.00 58.87 58.70 1iin n SER 277 Cb 0.12 -0.07 0.57 0.00 -0.26 0.00 0.00 64.21 64.57 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 -1.07 0.23 -4.31 4.33 5.02 -1.26 -4.54 118.16 116.56 1iin n LYS 278 Ca 0.03 -0.06 -0.23 0.00 -2.02 0.00 0.00 58.31 56.04 1iin n LYS 278 Cb 0.02 -1.50 -0.07 0.00 -0.02 0.00 0.00 35.03 33.46 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 -1.34 0.45 0.30 4.39 0.23 -1.09 -5.03 115.26 113.18 1iin n ASN 279 Ca 0.10 -3.16 0.16 0.00 -0.53 0.00 0.00 54.58 51.15 1iin n ASN 279 Cb 0.31 1.28 0.96 0.00 -2.08 0.00 0.00 39.78 40.25 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 1.78 0.00 0.42 0.53 1.82 -1.90 -2.94 116.42 116.13 1iin h ASP 280 Ca -0.28 0.00 -0.02 0.00 -0.39 0.00 0.00 57.03 56.34 1iin h ASP 280 Cb 1.20 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 41.21 1iin h ASP 280 CO 0.43 0.00 -0.23 0.22 -1.61 0.00 0.00 179.24 178.06 1iin h TYR 281 N 0.00 -0.59 -0.66 0.28 3.20 -1.96 1.20 116.97 118.44 1iin h TYR 281 Ca -0.00 -0.01 -0.08 0.00 3.14 0.00 0.00 58.73 61.78 1iin h TYR 281 Cb 0.01 0.20 -0.03 0.00 1.54 0.00 0.00 36.73 38.46 1iin h TYR 281 CO 0.00 -0.36 0.11 0.78 -1.64 0.00 0.00 178.16 177.05 1iin h GLY 282 N -0.60 1.19 1.12 1.82 0.00 -1.13 -2.44 103.07 103.04 1iin h GLY 282 Ca -0.05 -0.79 -0.11 0.00 0.00 0.00 0.00 47.33 46.38 1iin h GLY 282 CO 0.07 0.73 -0.06 0.50 0.00 0.00 0.00 176.54 177.78 1iin h LYS 283 N 1.02 1.03 -0.33 4.80 1.57 -1.33 -2.47 116.57 120.87 1iin h LYS 283 Ca 0.20 -0.36 0.04 0.00 -1.87 0.00 0.00 60.65 58.67 1iin h LYS 283 Cb 0.45 -0.08 -0.04 0.00 0.08 0.00 0.00 32.23 32.64 1iin h LYS 283 CO 0.01 1.05 0.10 -0.92 -0.57 0.00 0.00 179.45 179.12 1iin h TYR 284 N 0.93 0.18 -0.74 -1.35 3.20 0.18 0.34 116.97 119.70 1iin h TYR 284 Ca 0.15 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.03 1iin h TYR 284 Cb 0.62 -0.03 -0.04 0.00 1.54 0.00 0.00 36.73 38.83 1iin h TYR 284 CO 0.04 0.07 0.42 -0.07 -1.64 0.00 0.00 178.16 176.99 1iin h LEU 285 N 0.24 0.92 -0.28 2.82 3.38 -1.28 0.22 115.31 121.32 1iin h LEU 285 Ca 0.15 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 1iin h LEU 285 Cb 0.13 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 1iin h LEU 285 CO -0.16 0.73 0.11 -0.07 0.09 0.00 0.00 178.44 179.14 1iin h LEU 286 N 1.02 0.39 -1.12 1.67 3.38 -1.00 -2.43 115.31 117.22 1iin h LEU 286 Ca 0.26 -0.17 0.01 0.00 0.09 0.00 0.00 57.88 58.07 1iin h LEU 286 Cb 0.01 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.61 1iin h LEU 286 CO -0.05 0.45 0.59 0.50 0.09 0.00 0.00 178.44 180.03 1iin h LYS 287 N 0.30 1.18 -0.94 1.13 3.11 -0.61 -2.56 116.57 118.18 1iin h LYS 287 Ca 0.09 -0.07 0.09 0.00 -2.81 0.00 0.00 60.65 57.96 1iin h LYS 287 Cb 0.18 -0.27 -0.07 0.00 -1.00 0.00 0.00 32.23 31.08 1iin h LYS 287 CO -0.01 0.78 0.60 1.98 -2.81 0.00 0.00 179.45 180.00 1iin h MET 288 N 1.21 0.94 -0.02 1.90 4.05 -0.09 -3.51 114.93 119.42 1iin h MET 288 Ca 0.33 -0.06 0.00 0.00 -0.28 0.00 0.00 59.70 59.69 1iin h MET 288 Cb -0.14 -0.21 0.00 0.00 -0.80 0.00 0.00 31.60 30.45 1iin h MET 288 CO -0.07 0.62 0.00 1.33 0.23 0.00 0.00 176.91 179.02