#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 4.84 -0.11 2.12 1.02 -1.26 -4.74 119.74 121.61 1iin s LYS 2 Ca 0.00 1.47 -0.29 0.00 0.02 0.00 0.00 55.97 57.17 1iin s LYS 2 Cb 0.00 -3.27 -0.04 0.00 -0.52 0.00 0.00 37.83 34.00 1iin s LYS 2 CO 0.00 0.52 1.57 0.99 -0.92 0.00 0.00 175.35 177.51 1iin s THR 3 N -1.18 3.74 0.00 2.17 2.01 -0.23 -4.84 115.64 117.31 1iin s THR 3 Ca 0.41 0.88 0.00 0.00 0.31 0.00 0.00 61.69 63.29 1iin s THR 3 Cb -0.26 -3.62 0.00 0.00 0.01 0.00 0.00 72.50 68.64 1iin s THR 3 CO 0.32 -0.13 0.76 0.54 -0.69 0.00 0.00 174.62 175.41 1iin n ARG 4 N 7.16 1.53 -4.61 4.92 1.74 -1.26 -4.68 116.66 121.45 1iin n ARG 4 Ca 0.17 -1.04 -0.26 0.00 -0.77 0.00 0.00 57.85 55.95 1iin n ARG 4 Cb 0.44 -0.88 -0.14 0.00 -1.02 0.00 0.00 32.46 30.86 1iin n ARG 4 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1iin s LYS 5 N -0.57 1.40 0.03 5.56 1.02 -1.26 -3.54 119.74 122.38 1iin s LYS 5 Ca 0.00 -1.02 -0.05 0.00 0.02 0.00 0.00 55.97 54.92 1iin s LYS 5 Cb 0.00 -1.57 -0.01 0.00 -0.52 0.00 0.00 37.83 35.73 1iin s LYS 5 CO 0.00 0.39 0.08 0.20 -0.92 0.00 0.00 175.35 175.10 1iin s GLY 6 N -1.35 0.17 -0.06 -3.33 0.00 -0.54 -1.17 107.32 101.05 1iin s GLY 6 Ca 0.08 -0.50 0.04 0.00 0.00 0.00 0.00 44.72 44.34 1iin s GLY 6 CO 0.02 -0.63 -0.17 -0.42 0.00 0.00 0.00 173.10 171.90 1iin s ILE 7 N -2.22 1.46 -0.26 0.90 1.01 -0.04 -0.80 121.20 121.25 1iin s ILE 7 Ca -0.08 -0.71 -0.05 0.00 0.00 0.00 0.00 60.65 59.81 1iin s ILE 7 Cb -0.04 -1.27 0.00 0.00 0.01 0.00 0.00 42.46 41.17 1iin s ILE 7 CO -0.03 0.42 0.01 -0.63 0.00 0.00 0.00 174.94 174.71 1iin s ILE 8 N 0.22 3.60 -0.49 2.92 1.01 -0.41 -1.10 121.20 126.95 1iin s ILE 8 Ca -0.08 -0.63 -0.21 0.00 0.00 0.00 0.00 60.65 59.73 1iin s ILE 8 Cb -0.13 -2.76 0.04 0.00 0.01 0.00 0.00 42.46 39.62 1iin s ILE 8 CO 0.03 0.25 0.70 -0.22 0.00 0.00 0.00 174.94 175.70 1iin s LEU 9 N 1.47 4.58 -0.38 2.97 2.96 -0.68 -1.48 118.68 128.12 1iin s LEU 9 Ca 0.04 -0.54 0.10 0.00 -0.22 0.00 0.00 54.13 53.51 1iin s LEU 9 Cb -0.16 -2.66 0.44 0.00 0.50 0.00 0.00 46.19 44.31 1iin s LEU 9 CO -0.01 -0.92 1.06 0.00 -1.32 0.00 0.00 176.35 175.17 1iin n ALA 10 N 6.49 4.39 -2.16 5.97 0.00 0.17 -0.20 120.51 135.17 1iin n ALA 10 Ca -0.03 -3.81 0.00 0.00 0.00 0.00 0.00 53.44 49.60 1iin n ALA 10 Cb 0.47 -0.67 0.00 0.00 0.00 0.00 0.00 19.45 19.25 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 -0.36 2.44 0.00 0.00 0.00 -1.22 -4.51 105.19 101.54 1iin n GLY 11 Ca 0.28 -1.75 0.00 0.00 0.00 0.00 0.00 46.02 44.55 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 -2.15 0.00 -0.02 0.00 -1.26 -4.76 105.19 102.00 1iin n GLY 12 Ca 0.00 -1.48 0.11 0.00 0.00 0.00 0.00 46.02 44.65 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 -1.75 0.81 -3.13 1.61 3.41 -1.26 -4.86 113.62 108.44 1iin n SER 13 Ca 0.00 -0.72 -0.23 0.00 -0.26 0.00 0.00 58.87 57.66 1iin n SER 13 Cb 0.00 0.92 0.03 0.00 -0.26 0.00 0.00 64.21 64.89 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 1.47 -0.52 0.32 5.00 0.00 -1.26 -4.87 105.19 105.33 1iin n GLY 14 Ca 0.04 0.13 0.16 0.00 0.00 0.00 0.00 46.02 46.34 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 -1.34 0.56 0.00 2.61 1.35 -1.94 -1.03 112.91 113.13 1iin h THR 15 Ca -0.51 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.35 1iin h THR 15 Cb 1.35 0.89 0.00 0.00 -1.73 0.00 0.00 68.15 68.65 1iin h THR 15 CO 0.56 0.00 0.00 0.03 -0.25 0.00 0.00 175.52 175.86 1iin h ARG 16 N 0.00 0.00 -0.51 4.72 3.08 -1.90 -2.57 114.38 117.20 1iin h ARG 16 Ca 0.07 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.12 1iin h ARG 16 Cb 0.36 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.41 1iin h ARG 16 CO -0.00 0.00 0.00 1.28 -1.07 0.00 0.00 179.97 180.18 1iin n LEU 17 N -2.69 3.56 -4.68 3.04 4.77 -0.39 -4.81 117.00 115.80 1iin n LEU 17 Ca 0.01 -1.72 -0.39 0.00 -0.03 0.00 0.00 56.01 53.87 1iin n LEU 17 Cb 0.23 -0.33 0.04 0.00 -2.33 0.00 0.00 43.42 41.02 1iin n LEU 17 CO 0.22 0.83 0.79 -1.22 -1.33 0.00 0.00 177.39 176.68 1iin n TYR 18 N 1.44 1.71 1.65 -1.77 4.01 -0.97 -1.74 117.16 121.49 1iin n TYR 18 Ca 0.20 0.46 0.15 0.00 -0.16 0.00 0.00 57.90 58.55 1iin n TYR 18 Cb 0.59 -2.28 0.66 0.00 -0.31 0.00 0.00 39.34 37.99 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 -0.73 1.43 0.29 -0.72 -0.04 -1.26 -4.90 135.00 129.07 1iin n PRO 19 Ca 0.11 -0.64 0.17 0.00 -0.04 0.00 0.00 63.50 63.10 1iin n PRO 19 Cb 0.44 -1.49 0.87 0.00 -0.04 0.00 0.00 33.50 33.28 1iin n PRO 19 CO 0.00 0.00 0.00 -0.39 -0.04 0.00 0.00 175.50 175.07 1iin h VAL 20 N 1.56 0.24 -0.61 0.52 -1.51 -1.74 -1.55 116.25 113.16 1iin h VAL 20 Ca 0.00 -0.36 0.00 0.00 -1.23 0.00 0.00 66.70 65.11 1iin h VAL 20 Cb 0.34 1.29 0.00 0.00 -2.13 0.00 0.00 31.29 30.79 1iin h VAL 20 CO 0.00 0.05 0.00 0.35 -1.23 0.00 0.00 177.57 176.74 1iin n THR 21 N -3.32 1.16 -0.18 7.19 -2.24 -1.22 -4.21 114.28 111.46 1iin n THR 21 Ca -0.01 -1.06 -0.08 0.00 -2.27 0.00 0.00 64.05 60.63 1iin n THR 21 Cb 0.21 0.42 0.02 0.00 -2.10 0.00 0.00 70.33 68.87 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 3.61 0.75 -0.04 -0.78 2.86 -1.60 -3.26 114.93 116.48 1iin h MET 22 Ca 0.00 -0.11 0.00 0.00 -2.06 0.00 0.00 59.70 57.53 1iin h MET 22 Cb 1.01 -0.14 0.00 0.00 0.06 0.00 0.00 31.60 32.53 1iin h MET 22 CO 0.04 0.62 0.00 0.00 1.06 0.00 0.00 176.91 178.63 1iin n ALA 23 N -2.31 2.16 -3.38 6.32 0.00 -1.26 -5.00 120.51 117.03 1iin n ALA 23 Ca 0.02 -1.66 -0.14 0.00 0.00 0.00 0.00 53.44 51.67 1iin n ALA 23 Cb 0.12 -0.20 -0.15 0.00 0.00 0.00 0.00 19.45 19.22 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 -1.76 -0.03 0.22 0.00 1.01 -1.23 -5.12 120.40 113.48 1iin s VAL 24 Ca 0.15 0.12 -0.30 0.00 0.00 0.00 0.00 61.98 61.95 1iin s VAL 24 Cb 0.13 -0.08 -0.10 0.00 0.00 0.00 0.00 36.38 36.33 1iin s VAL 24 CO 0.03 0.05 1.43 -0.55 0.00 0.00 0.00 175.10 176.06 1iin s SER 25 N 0.62 6.70 0.29 3.32 0.15 -1.26 -4.36 113.70 119.15 1iin s SER 25 Ca -0.05 2.59 0.03 0.00 0.70 0.00 0.00 55.95 59.22 1iin s SER 25 Cb -0.07 -2.61 0.69 0.00 -1.71 0.00 0.00 66.02 62.31 1iin s SER 25 CO -0.02 -0.68 1.72 -0.61 1.20 0.00 0.00 173.24 174.84 1iin h GLN 26 N 5.48 0.47 0.00 5.44 4.15 -1.89 -0.47 115.11 128.28 1iin h GLN 26 Ca -0.45 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 58.94 1iin h GLN 26 Cb 1.21 -0.11 0.00 0.00 0.21 0.00 0.00 27.48 28.80 1iin h GLN 26 CO 0.80 0.31 0.00 1.04 -1.93 0.00 0.00 178.83 179.05 1iin n GLN 27 N -4.98 0.82 -0.00 1.69 3.00 -1.26 -1.85 117.38 114.81 1iin n GLN 27 Ca 0.21 0.00 0.08 0.00 -0.01 0.00 0.00 57.00 57.28 1iin n GLN 27 Cb 0.60 -1.29 -0.11 0.00 0.00 0.00 0.00 30.24 29.44 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 -0.79 0.69 -4.76 1.08 4.77 -0.19 -1.13 117.00 116.66 1iin n LEU 28 Ca 0.12 -0.41 -0.39 0.00 -0.03 0.00 0.00 56.01 55.29 1iin n LEU 28 Cb 0.05 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.17 1iin n LEU 28 CO 0.09 0.17 1.01 -0.76 -1.33 0.00 0.00 177.39 176.57 1iin s LEU 29 N -3.08 3.98 0.39 2.23 1.43 -0.77 -4.36 118.68 118.50 1iin s LEU 29 Ca 0.04 2.79 -0.24 0.00 -1.03 0.00 0.00 54.13 55.70 1iin s LEU 29 Cb 0.13 -4.12 -0.10 0.00 0.03 0.00 0.00 46.19 42.13 1iin s LEU 29 CO 0.73 -1.35 0.99 -2.16 0.23 0.00 0.00 176.35 174.79 1iin s PRO 30 N -2.69 4.27 -0.46 1.29 0.04 -1.26 0.01 135.00 136.20 1iin s PRO 30 Ca 0.66 1.35 0.03 0.00 0.04 0.00 0.00 61.00 63.09 1iin s PRO 30 Cb -0.41 -2.50 0.12 0.00 0.04 0.00 0.00 34.50 31.76 1iin s PRO 30 CO 0.50 -0.02 0.21 0.42 0.04 0.00 0.00 177.00 178.16 1iin s ILE 31 N -1.79 2.25 0.00 0.56 -1.09 -0.47 -4.80 121.20 115.85 1iin s ILE 31 Ca 0.57 -2.91 0.00 0.00 -2.23 0.00 0.00 60.65 56.08 1iin s ILE 31 Cb -0.17 -2.59 0.00 0.00 -1.58 0.00 0.00 42.46 38.12 1iin s ILE 31 CO 0.22 -0.77 0.00 0.00 -1.23 0.00 0.00 174.94 173.16 1iin n TYR 32 N 3.48 0.00 -0.32 3.97 9.36 -1.26 -3.54 117.16 128.85 1iin n TYR 32 Ca 0.05 0.00 0.04 0.00 3.32 0.00 0.00 57.90 61.31 1iin n TYR 32 Cb 0.35 0.00 0.07 0.00 -0.63 0.00 0.00 39.34 39.13 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 3.30 2.35 -3.47 2.98 5.75 -1.26 -5.04 116.55 121.17 1iin n ASP 33 Ca 0.00 -2.30 -0.14 0.00 -0.01 0.00 0.00 54.79 52.34 1iin n ASP 33 Cb 0.00 -0.17 -0.04 0.00 -1.03 0.00 0.00 41.12 39.89 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 -1.52 1.15 0.57 0.11 -2.85 -1.23 -5.00 119.74 110.96 1iin s LYS 34 Ca 0.13 -0.15 -0.20 0.00 -1.00 0.00 0.00 55.97 54.76 1iin s LYS 34 Cb 0.10 0.53 -0.04 0.00 -2.06 0.00 0.00 37.83 36.37 1iin s LYS 34 CO 0.04 -0.45 1.26 -1.25 0.10 0.00 0.00 175.35 175.06 1iin s PRO 35 N -2.60 3.06 0.27 1.78 0.04 -1.26 -1.37 135.00 134.91 1iin s PRO 35 Ca -0.04 1.99 -0.01 0.00 0.04 0.00 0.00 61.00 62.98 1iin s PRO 35 Cb -0.01 -2.08 0.59 0.00 0.04 0.00 0.00 34.50 33.04 1iin s PRO 35 CO -0.03 -1.18 1.70 1.98 0.04 0.00 0.00 177.00 179.51 1iin h MET 36 N 1.16 0.36 -0.26 4.56 4.05 -0.44 -1.40 114.93 122.96 1iin h MET 36 Ca -0.51 -0.02 0.08 0.00 -0.28 0.00 0.00 59.70 58.97 1iin h MET 36 Cb 1.30 -0.08 -0.01 0.00 -0.80 0.00 0.00 31.60 32.01 1iin h MET 36 CO 0.56 0.24 0.22 0.97 0.23 0.00 0.00 176.91 179.13 1iin h ILE 37 N 0.37 0.65 -0.12 1.77 6.09 -1.36 -0.54 117.51 124.38 1iin h ILE 37 Ca 0.48 0.00 0.03 0.00 -1.37 0.00 0.00 64.86 64.00 1iin h ILE 37 Cb 0.86 0.83 -0.01 0.00 0.47 0.00 0.00 36.82 38.98 1iin h ILE 37 CO -0.50 0.00 0.08 1.88 -3.07 0.00 0.00 178.15 176.54 1iin h TYR 38 N 0.00 0.04 0.54 2.19 -1.99 -1.55 -2.42 116.97 113.77 1iin h TYR 38 Ca 0.12 0.00 -0.03 0.00 2.00 0.00 0.00 58.73 60.83 1iin h TYR 38 Cb 0.57 -0.01 0.01 0.00 2.00 0.00 0.00 36.73 39.29 1iin h TYR 38 CO 0.00 0.02 -0.26 1.88 -0.00 0.00 0.00 178.16 179.80 1iin h TYR 39 N 0.04 -0.67 0.00 4.88 -1.99 -1.25 -0.65 116.97 117.33 1iin h TYR 39 Ca 0.05 -0.02 -0.02 0.00 2.00 0.00 0.00 58.73 60.74 1iin h TYR 39 Cb 0.16 0.22 -0.00 0.00 2.00 0.00 0.00 36.73 39.11 1iin h TYR 39 CO -0.00 -0.38 -0.12 -1.00 -0.00 0.00 0.00 178.16 176.67 1iin h PRO 40 N -1.13 0.00 -0.36 4.88 0.13 -1.68 -0.87 132.00 132.97 1iin h PRO 40 Ca -0.07 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.01 1iin h PRO 40 Cb 0.60 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.72 1iin h PRO 40 CO 0.12 0.12 0.03 1.25 -0.23 0.00 0.00 178.00 179.29 1iin h LEU 41 N 0.00 0.59 -1.37 1.56 7.12 -1.40 -2.50 115.31 119.31 1iin h LEU 41 Ca -0.00 -0.29 -0.03 0.00 0.13 0.00 0.00 57.88 57.69 1iin h LEU 41 Cb 0.24 -0.16 -0.02 0.00 -0.53 0.00 0.00 40.66 40.19 1iin h LEU 41 CO 0.02 0.73 0.08 0.28 -0.13 0.00 0.00 178.44 179.42 1iin h SER 42 N 0.43 0.46 -0.63 1.25 0.02 -0.34 -1.73 113.55 113.00 1iin h SER 42 Ca 0.10 -0.06 0.00 0.00 -0.84 0.00 0.00 61.79 61.00 1iin h SER 42 Cb 0.41 -0.12 -0.03 0.00 0.14 0.00 0.00 62.40 62.80 1iin h SER 42 CO 0.01 0.47 0.41 0.74 -1.14 0.00 0.00 176.83 177.32 1iin h THR 43 N 0.50 1.17 -0.23 -2.27 2.02 -0.76 0.40 112.91 113.74 1iin h THR 43 Ca 0.12 -0.34 -0.04 0.00 0.77 0.00 0.00 66.41 66.92 1iin h THR 43 Cb 0.20 0.26 -0.01 0.00 -1.74 0.00 0.00 68.15 66.86 1iin h THR 43 CO -0.00 0.17 -0.01 -0.07 0.37 0.00 0.00 175.52 175.98 1iin h LEU 44 N 0.86 0.41 -0.74 2.58 3.38 -1.10 -2.78 115.31 117.92 1iin h LEU 44 Ca 0.23 -0.32 0.09 0.00 0.09 0.00 0.00 57.88 57.97 1iin h LEU 44 Cb -0.07 -0.11 -0.07 0.00 0.09 0.00 0.00 40.66 40.50 1iin h LEU 44 CO -0.05 0.63 0.38 0.24 0.09 0.00 0.00 178.44 179.74 1iin h MET 45 N 0.18 0.63 0.00 1.13 2.86 -1.01 0.53 114.93 119.26 1iin h MET 45 Ca 0.06 -0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.66 1iin h MET 45 Cb 0.43 -0.14 -0.00 0.00 0.06 0.00 0.00 31.60 31.94 1iin h MET 45 CO 0.01 0.42 -0.02 -0.07 1.06 0.00 0.00 176.91 178.31 1iin h LEU 46 N 0.65 0.00 -0.55 1.22 3.38 -0.73 0.17 115.31 119.46 1iin h LEU 46 Ca 0.36 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.33 1iin h LEU 46 Cb 0.36 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.11 1iin h LEU 46 CO -0.26 0.02 -0.06 0.00 0.09 0.00 0.00 178.44 178.24 1iin n ALA 47 N -2.16 2.70 -0.53 1.53 0.00 0.10 -4.80 120.51 117.35 1iin n ALA 47 Ca -0.02 -0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.07 1iin n ALA 47 Cb 0.15 -1.27 0.00 0.00 0.00 0.00 0.00 19.45 18.33 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 1.18 0.75 3.67 0.00 0.00 0.59 -4.97 105.19 106.41 1iin n GLY 48 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.54 4.83 -0.01 -0.61 1.01 -0.73 -4.91 121.20 118.23 1iin s ILE 49 Ca 0.00 1.74 0.00 0.00 0.00 0.00 0.00 60.65 62.39 1iin s ILE 49 Cb 0.00 -4.18 -0.00 0.00 0.01 0.00 0.00 42.46 38.28 1iin s ILE 49 CO 0.00 -0.02 0.03 0.54 0.00 0.00 0.00 174.94 175.49 1iin n ARG 50 N 5.45 6.64 -3.70 2.79 1.74 -1.26 -3.68 116.66 124.65 1iin n ARG 50 Ca 0.06 -0.02 -0.39 0.00 -0.77 0.00 0.00 57.85 56.74 1iin n ARG 50 Cb 0.48 -0.53 -0.12 0.00 -1.02 0.00 0.00 32.46 31.27 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 -0.99 5.46 -0.02 0.55 2.15 -1.23 -0.59 116.67 122.00 1iin s ASP 51 Ca 0.00 -1.16 0.03 0.00 0.43 0.00 0.00 52.55 51.86 1iin s ASP 51 Cb 0.00 -1.92 -0.01 0.00 -0.30 0.00 0.00 42.92 40.70 1iin s ASP 51 CO 0.01 -0.37 -0.12 -0.63 -0.17 0.00 0.00 175.17 173.90 1iin s ILE 52 N 1.44 0.94 -0.18 4.11 1.01 -0.35 -1.47 121.20 126.70 1iin s ILE 52 Ca -0.00 -0.49 -0.04 0.00 0.00 0.00 0.00 60.65 60.13 1iin s ILE 52 Cb -0.20 -0.80 -0.02 0.00 0.01 0.00 0.00 42.46 41.46 1iin s ILE 52 CO 0.04 0.27 -0.04 -0.22 0.00 0.00 0.00 174.94 174.99 1iin s LEU 53 N -0.13 3.06 -0.21 2.97 0.20 0.02 -1.01 118.68 123.58 1iin s LEU 53 Ca 0.02 -0.25 -0.08 0.00 0.69 0.00 0.00 54.13 54.51 1iin s LEU 53 Cb -0.06 -1.75 -0.04 0.00 -0.43 0.00 0.00 46.19 43.91 1iin s LEU 53 CO -0.00 0.09 0.08 -0.63 -0.29 0.00 0.00 176.35 175.59 1iin s ILE 54 N 0.85 4.72 -0.15 6.68 1.01 0.77 -1.29 121.20 133.79 1iin s ILE 54 Ca -0.01 -0.05 -0.00 0.00 0.00 0.00 0.00 60.65 60.59 1iin s ILE 54 Cb -0.15 -3.16 -0.01 0.00 0.01 0.00 0.00 42.46 39.15 1iin s ILE 54 CO 0.01 0.41 -0.13 -0.63 0.00 0.00 0.00 174.94 174.60 1iin s ILE 55 N 0.84 2.98 0.00 2.92 1.01 -0.55 -1.32 121.20 127.08 1iin s ILE 55 Ca 0.04 -0.67 0.00 0.00 0.00 0.00 0.00 60.65 60.02 1iin s ILE 55 Cb -0.13 -2.26 0.00 0.00 0.01 0.00 0.00 42.46 40.07 1iin s ILE 55 CO 0.02 0.51 0.00 -0.24 0.00 0.00 0.00 174.94 175.24 1iin n SER 56 N 3.81 0.00 -4.85 3.58 2.88 -0.99 0.43 113.62 118.48 1iin n SER 56 Ca -0.18 -0.86 -0.30 0.00 -1.33 0.00 0.00 58.87 56.20 1iin n SER 56 Cb 0.52 0.00 0.05 0.00 -0.75 0.00 0.00 64.21 64.03 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 -2.21 3.74 0.51 2.46 -4.23 -1.26 0.06 115.64 114.71 1iin s THR 57 Ca 0.00 0.56 0.25 0.00 -1.18 0.00 0.00 61.69 61.33 1iin s THR 57 Cb 0.00 -3.46 0.30 0.00 1.34 0.00 0.00 72.50 70.68 1iin s THR 57 CO 0.00 -0.74 2.16 1.55 -0.54 0.00 0.00 174.62 177.05 1iin h PRO 58 N -0.69 0.00 0.16 3.99 0.13 -1.89 -1.18 132.00 132.52 1iin h PRO 58 Ca -0.45 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.37 1iin h PRO 58 Cb 1.24 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.38 1iin h PRO 58 CO 0.61 0.06 -1.43 1.96 -0.23 0.00 0.00 178.00 178.97 1iin h GLN 59 N 0.00 0.34 0.02 0.86 7.50 -1.97 -3.39 115.11 118.47 1iin h GLN 59 Ca -0.00 -0.58 -0.29 0.00 0.50 0.00 0.00 58.65 58.28 1iin h GLN 59 Cb 0.14 0.22 -0.04 0.00 0.05 0.00 0.00 27.48 27.84 1iin h GLN 59 CO 0.01 1.25 -1.63 -0.44 -1.50 0.00 0.00 178.83 176.52 1iin h ASP 60 N 0.09 0.08 -0.62 1.46 3.32 -1.84 -3.39 116.42 115.52 1iin h ASP 60 Ca -0.21 -0.15 0.13 0.00 0.02 0.00 0.00 57.03 56.81 1iin h ASP 60 Cb 2.04 -0.03 -0.12 0.00 0.22 0.00 0.00 39.33 41.45 1iin h ASP 60 CO 0.21 1.13 -0.13 0.74 -1.72 0.00 0.00 179.24 179.47 1iin h THR 61 N 0.01 0.40 0.00 0.35 2.02 -1.43 0.29 112.91 114.56 1iin h THR 61 Ca -0.26 -0.01 -0.01 0.00 0.77 0.00 0.00 66.41 66.91 1iin h THR 61 Cb 1.98 0.38 -0.00 0.00 -1.74 0.00 0.00 68.15 68.77 1iin h THR 61 CO 0.09 0.00 -0.04 1.55 0.37 0.00 0.00 175.52 177.50 1iin h PRO 62 N 0.01 0.00 -0.02 6.66 0.13 -1.80 -1.46 132.00 135.52 1iin h PRO 62 Ca 0.30 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 65.24 1iin h PRO 62 Cb 0.47 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.59 1iin h PRO 62 CO -0.62 0.04 -0.81 0.00 -0.23 0.00 0.00 178.00 176.38 1iin h ARG 63 N 0.00 0.26 -0.24 0.86 3.08 -0.64 -0.92 114.38 116.78 1iin h ARG 63 Ca -0.00 -0.25 -0.15 0.00 0.07 0.00 0.00 59.98 59.65 1iin h ARG 63 Cb 0.10 0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.21 1iin h ARG 63 CO 0.00 0.94 -0.48 0.74 -1.07 0.00 0.00 179.97 180.11 1iin h PHE 64 N 0.16 0.78 -0.39 3.04 -1.00 -0.74 -1.93 116.94 116.86 1iin h PHE 64 Ca -0.04 -0.25 -0.12 0.00 2.81 0.00 0.00 57.97 60.36 1iin h PHE 64 Cb 1.40 -0.16 -0.01 0.00 3.61 0.00 0.00 35.95 40.79 1iin h PHE 64 CO 0.03 0.99 -0.26 0.37 -1.61 0.00 0.00 178.31 177.84 1iin h GLN 65 N 0.51 0.80 -0.57 1.51 4.15 -1.29 0.51 115.11 120.74 1iin h GLN 65 Ca 0.03 -0.35 0.00 0.00 0.77 0.00 0.00 58.65 59.10 1iin h GLN 65 Cb 1.02 -0.03 -0.03 0.00 0.21 0.00 0.00 27.48 28.65 1iin h GLN 65 CO 0.10 0.97 0.36 0.37 -1.93 0.00 0.00 178.83 178.69 1iin h GLN 66 N 0.69 0.77 -0.14 1.69 4.15 -0.97 0.47 115.11 121.77 1iin h GLN 66 Ca 0.09 -0.06 -0.07 0.00 0.77 0.00 0.00 58.65 59.38 1iin h GLN 66 Cb 0.79 -0.17 -0.00 0.00 0.21 0.00 0.00 27.48 28.31 1iin h GLN 66 CO 0.07 0.54 -0.17 1.25 -1.93 0.00 0.00 178.83 178.58 1iin h LEU 67 N 0.77 0.40 0.00 -2.39 6.46 -1.04 -3.38 115.31 116.13 1iin h LEU 67 Ca 0.21 -0.50 -0.13 0.00 -0.12 0.00 0.00 57.88 57.33 1iin h LEU 67 Cb -0.04 -0.11 -0.03 0.00 -0.73 0.00 0.00 40.66 39.75 1iin h LEU 67 CO -0.04 0.82 -2.11 0.18 -0.62 0.00 0.00 178.44 176.66 1iin n LEU 68 N -4.53 0.00 0.00 2.25 4.77 0.14 -5.08 117.00 114.55 1iin n LEU 68 Ca -0.06 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 1iin n LEU 68 Cb 0.38 0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.65 1iin n LEU 68 CO 0.40 0.18 0.00 0.61 -1.33 0.00 0.00 177.39 177.25 1iin n GLY 69 N 1.47 0.94 0.31 -0.72 0.00 0.17 -2.44 105.19 104.92 1iin n GLY 69 Ca -0.14 -0.66 0.10 0.00 0.00 0.00 0.00 46.02 45.32 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 -2.26 0.92 0.00 1.61 5.68 -1.26 -4.76 116.55 116.47 1iin n ASP 70 Ca 0.00 -1.58 0.00 0.00 -0.50 0.00 0.00 54.79 52.71 1iin n ASP 70 Cb 0.00 -0.06 0.00 0.00 -1.14 0.00 0.00 41.12 39.92 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 0.98 0.88 0.28 6.12 0.00 -1.02 -0.97 105.19 111.45 1iin n GLY 71 Ca 0.15 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.29 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 0.11 1.61 4.64 -1.83 -0.46 113.55 117.63 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 0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1iin h SER 72 CO 0.00 0.01 -0.00 0.06 -0.87 0.00 0.00 176.83 176.02 1iin h GLN 73 N 0.00 0.00 -0.08 4.77 -0.00 -1.89 -1.25 115.11 116.66 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 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.49 1iin h GLN 73 CO 0.00 0.00 0.00 0.91 -0.00 0.00 0.00 178.83 179.74 1iin n TRP 74 N -3.15 0.29 -1.78 0.06 8.01 -0.29 -4.97 117.44 115.61 1iin n TRP 74 Ca -0.03 -0.93 -0.09 0.00 -1.31 0.00 0.00 57.50 55.14 1iin n TRP 74 Cb 0.10 -0.19 -0.02 0.00 -2.01 0.00 0.00 31.31 29.19 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 -1.08 0.46 3.81 6.99 0.00 -0.47 -4.72 105.19 110.17 1iin n GLY 75 Ca 0.17 -0.56 -0.24 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 -2.34 3.05 -0.28 0.99 1.43 -0.55 -4.96 118.68 116.01 1iin s LEU 76 Ca 0.00 -1.07 -0.01 0.00 -1.03 0.00 0.00 54.13 52.03 1iin s LEU 76 Cb 0.00 -1.49 0.09 0.00 0.03 0.00 0.00 46.19 44.81 1iin s LEU 76 CO 0.00 -0.72 0.06 0.21 0.23 0.00 0.00 176.35 176.14 1iin s ASN 77 N -4.04 3.87 -0.13 2.29 2.47 0.25 -2.91 114.94 116.72 1iin s ASN 77 Ca 0.39 -1.47 -0.04 0.00 0.42 0.00 0.00 52.86 52.17 1iin s ASN 77 Cb 0.01 -0.92 -0.03 0.00 -1.45 0.00 0.00 41.25 38.85 1iin s ASN 77 CO 0.23 -0.37 -0.00 -0.76 -3.72 0.00 0.00 177.10 172.48 1iin s LEU 78 N 1.57 3.50 0.24 3.21 1.43 -0.14 -1.21 118.68 127.28 1iin s LEU 78 Ca 0.06 0.03 0.05 0.00 -1.03 0.00 0.00 54.13 53.23 1iin s LEU 78 Cb -0.18 -1.83 -0.05 0.00 0.03 0.00 0.00 46.19 44.16 1iin s LEU 78 CO -0.18 0.26 -0.03 0.00 0.23 0.00 0.00 176.35 176.63 1iin s GLN 79 N -0.16 1.38 0.09 1.70 0.00 -0.18 -4.65 119.66 117.83 1iin s GLN 79 Ca 0.05 -1.70 0.05 0.00 -0.00 0.00 0.00 55.36 53.76 1iin s GLN 79 Cb -0.13 -0.78 -0.03 0.00 0.00 0.00 0.00 33.01 32.07 1iin s GLN 79 CO 0.02 -0.05 -0.14 0.71 0.00 0.00 0.00 175.29 175.83 1iin s TYR 80 N -3.29 1.28 -0.12 9.60 1.51 -1.26 -0.16 117.35 124.90 1iin s TYR 80 Ca 0.28 -0.50 -0.15 0.00 -1.01 0.00 0.00 57.07 55.70 1iin s TYR 80 Cb 0.05 -0.70 0.04 0.00 -0.11 0.00 0.00 41.96 41.23 1iin s TYR 80 CO 0.09 0.08 0.39 0.21 -1.11 0.00 0.00 175.55 175.22 1iin s LYS 81 N -2.07 0.53 -0.02 -0.62 2.20 -0.43 -4.92 119.74 114.42 1iin s LYS 81 Ca 0.02 0.40 -0.18 0.00 -0.36 0.00 0.00 55.97 55.84 1iin s LYS 81 Cb -0.08 0.25 -0.05 0.00 -1.51 0.00 0.00 37.83 36.44 1iin s LYS 81 CO 0.02 -0.09 0.51 0.08 -0.36 0.00 0.00 175.35 175.51 1iin s VAL 82 N -0.14 4.98 -0.41 4.02 1.01 -1.26 -2.35 120.40 126.24 1iin s VAL 82 Ca -0.03 1.06 -0.11 0.00 0.00 0.00 0.00 61.98 62.89 1iin s VAL 82 Cb -0.03 -3.84 0.05 0.00 0.00 0.00 0.00 36.38 32.57 1iin s VAL 82 CO 0.02 0.47 0.26 -1.58 0.00 0.00 0.00 175.10 174.27 1iin s GLN 83 N -0.41 2.77 0.20 2.72 0.74 0.11 -4.91 119.66 120.88 1iin s GLN 83 Ca 0.27 -1.27 -0.11 0.00 0.05 0.00 0.00 55.36 54.30 1iin s GLN 83 Cb -0.17 -3.83 0.27 0.00 1.10 0.00 0.00 33.01 30.38 1iin s GLN 83 CO 0.15 -0.86 1.69 -1.35 -0.55 0.00 0.00 175.29 174.37 1iin h PRO 84 N 8.49 0.20 -3.75 1.67 0.11 -1.97 -3.39 132.00 133.36 1iin h PRO 84 Ca -0.25 -0.01 -0.19 0.00 0.11 0.00 0.00 66.00 65.66 1iin h PRO 84 Cb 1.10 -0.04 -0.24 0.00 0.11 0.00 0.00 31.00 31.93 1iin h PRO 84 CO 0.74 0.13 -0.65 -1.54 -0.21 0.00 0.00 178.00 176.47 1iin s SER 85 N -5.28 0.09 -0.72 -2.05 1.04 -1.26 -4.84 113.70 100.67 1iin s SER 85 Ca -0.13 -0.21 -0.23 0.00 0.48 0.00 0.00 55.95 55.86 1iin s SER 85 Cb 0.18 0.12 -0.17 0.00 0.10 0.00 0.00 66.02 66.24 1iin s SER 85 CO 0.73 -0.20 1.90 -0.81 0.98 0.00 0.00 173.24 175.85 1iin n PRO 86 N 2.17 1.38 0.00 4.02 -0.04 -1.26 -4.73 135.00 136.55 1iin n PRO 86 Ca -0.19 -1.80 0.09 0.00 -0.04 0.00 0.00 63.50 61.56 1iin n PRO 86 Cb 0.57 -2.92 0.51 0.00 -0.04 0.00 0.00 33.50 31.63 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 7.90 0.00 0.00 3.54 8.00 -1.26 -4.95 116.55 129.78 1iin n ASP 87 Ca 0.49 -1.23 0.00 0.00 0.71 0.00 0.00 54.79 54.77 1iin n ASP 87 Cb 0.41 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.51 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 0.62 3.91 0.28 0.44 0.00 -1.26 -0.49 105.19 108.69 1iin n GLY 88 Ca 0.13 -1.50 0.08 0.00 0.00 0.00 0.00 46.02 44.73 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 0.01 -2.30 0.99 4.07 -1.91 -0.14 115.31 116.02 1iin h LEU 89 Ca 0.00 0.16 0.00 0.00 0.08 0.00 0.00 57.88 58.12 1iin h LEU 89 Cb 0.00 0.22 0.00 0.00 1.08 0.00 0.00 40.66 41.96 1iin h LEU 89 CO 0.00 -0.07 0.00 0.00 -1.08 0.00 0.00 178.44 177.29 1iin h ALA 90 N 1.67 1.00 0.00 1.53 0.00 -1.82 -0.23 119.26 121.41 1iin h ALA 90 Ca 0.46 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.37 1iin h ALA 90 Cb 0.83 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.62 1iin h ALA 90 CO -0.56 0.00 0.00 0.37 0.00 0.00 0.00 179.25 179.06 1iin h GLN 91 N 0.00 0.00 -0.76 0.00 4.15 -1.25 -2.56 115.11 114.69 1iin h GLN 91 Ca 0.00 0.00 0.05 0.00 0.77 0.00 0.00 58.65 59.47 1iin h GLN 91 Cb 0.14 0.00 -0.05 0.00 0.21 0.00 0.00 27.48 27.78 1iin h GLN 91 CO 0.00 0.00 0.50 0.00 -1.93 0.00 0.00 178.83 177.40 1iin h ALA 92 N 2.09 1.61 0.00 3.38 0.00 -1.18 -0.89 119.26 124.28 1iin h ALA 92 Ca 0.00 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 1iin h ALA 92 Cb 0.19 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1iin h ALA 92 CO 0.00 0.29 -0.17 0.74 0.00 0.00 0.00 179.25 180.11 1iin h PHE 93 N 0.87 0.00 0.00 0.00 -1.00 -1.67 0.36 116.94 115.49 1iin h PHE 93 Ca 0.32 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 61.07 1iin h PHE 93 Cb 0.15 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.71 1iin h PHE 93 CO -0.00 0.17 -0.16 0.82 -1.61 0.00 0.00 178.31 177.53 1iin h ILE 94 N 0.00 1.24 -0.87 -0.55 2.04 -1.45 -2.29 117.51 115.63 1iin h ILE 94 Ca -0.00 -1.99 0.03 0.00 1.00 0.00 0.00 64.86 63.90 1iin h ILE 94 Cb 0.85 2.41 -0.05 0.00 -0.74 0.00 0.00 36.82 39.29 1iin h ILE 94 CO 0.02 0.42 0.57 0.40 0.00 0.00 0.00 178.15 179.57 1iin h ILE 95 N -1.00 1.15 -0.42 -0.67 2.04 -1.19 -1.99 117.51 115.43 1iin h ILE 95 Ca -0.04 -0.37 0.00 0.00 1.00 0.00 0.00 64.86 65.45 1iin h ILE 95 Cb 0.80 -0.04 0.00 0.00 -0.74 0.00 0.00 36.82 36.84 1iin h ILE 95 CO -0.02 0.20 0.00 0.61 0.00 0.00 0.00 178.15 178.93 1iin n GLY 96 N -1.40 1.94 0.26 5.37 0.00 0.13 -4.54 105.19 106.94 1iin n GLY 96 Ca 0.11 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.57 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 2.69 0.58 -0.53 1.61 4.81 -0.74 -0.44 114.58 122.55 1iin h GLU 97 Ca 0.00 -0.03 -0.07 0.00 -0.13 0.00 0.00 59.36 59.12 1iin h GLU 97 Cb 1.11 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 30.34 1iin h GLU 97 CO 0.18 0.38 0.04 1.49 -0.73 0.00 0.00 179.01 180.38 1iin h GLU 98 N 0.59 0.91 -0.29 1.92 4.81 -1.83 -0.93 114.58 119.77 1iin h GLU 98 Ca 0.33 -0.27 0.00 0.00 -0.13 0.00 0.00 59.36 59.29 1iin h GLU 98 Cb 0.32 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.59 1iin h GLU 98 CO -0.25 0.91 0.19 0.35 -0.73 0.00 0.00 179.01 179.48 1iin h PHE 99 N 0.79 0.37 -0.56 0.92 3.57 -1.74 -3.08 116.94 117.21 1iin h PHE 99 Ca 0.16 0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.58 1iin h PHE 99 Cb 0.47 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 39.07 1iin h PHE 99 CO 0.03 0.25 0.04 0.82 -2.23 0.00 0.00 178.31 177.23 1iin h ILE 100 N 0.38 1.26 0.00 1.41 2.04 -0.90 -3.48 117.51 118.23 1iin h ILE 100 Ca 0.11 -1.05 0.00 0.00 1.00 0.00 0.00 64.86 64.92 1iin h ILE 100 Cb -0.03 0.84 0.00 0.00 -0.74 0.00 0.00 36.82 36.90 1iin h ILE 100 CO -0.02 0.38 0.00 0.61 0.00 0.00 0.00 178.15 179.12 1iin n GLY 101 N -0.47 3.52 1.08 5.37 0.00 -0.37 -1.69 105.19 112.63 1iin n GLY 101 Ca 0.02 -0.09 0.10 0.00 0.00 0.00 0.00 46.02 46.05 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 13.79 0.66 -2.66 1.61 8.25 -1.26 -4.99 115.22 130.62 1iin n HIS 102 Ca 0.00 -0.39 -0.22 0.00 -0.26 0.00 0.00 57.72 56.85 1iin n HIS 102 Cb 0.00 -0.01 0.06 0.00 1.12 0.00 0.00 29.99 31.16 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 -1.14 5.00 0.67 0.41 1.01 -0.68 -4.72 116.67 117.21 1iin s ASP 103 Ca 0.38 -0.18 -0.10 0.00 0.71 0.00 0.00 52.55 53.35 1iin s ASP 103 Cb 0.21 -0.54 0.00 0.00 1.01 0.00 0.00 42.92 43.60 1iin s ASP 103 CO 0.28 -1.36 1.05 -1.81 0.21 0.00 0.00 175.17 173.54 1iin s ASP 104 N -4.53 5.61 -0.10 0.27 1.01 -1.26 -3.89 116.67 113.78 1iin s ASP 104 Ca 0.60 1.10 -0.26 0.00 0.71 0.00 0.00 52.55 54.70 1iin s ASP 104 Cb -0.09 -1.98 0.06 0.00 1.01 0.00 0.00 42.92 41.92 1iin s ASP 104 CO 0.40 -1.21 0.62 0.00 0.21 0.00 0.00 175.17 175.19 1iin s ALA 106 N -0.80 3.59 -0.08 0.00 0.00 -0.31 -1.13 121.76 123.02 1iin s ALA 106 Ca -0.08 -1.22 0.02 0.00 0.00 0.00 0.00 51.96 50.67 1iin s ALA 106 Cb -0.02 -1.38 0.02 0.00 0.00 0.00 0.00 23.12 21.74 1iin s ALA 106 CO 0.07 0.49 -0.11 -1.17 0.00 0.00 0.00 175.76 175.04 1iin s LEU 107 N -3.16 1.55 0.02 0.00 2.96 0.92 -0.86 118.68 120.11 1iin s LEU 107 Ca 0.31 -0.30 0.05 0.00 -0.22 0.00 0.00 54.13 53.97 1iin s LEU 107 Cb -0.10 -0.82 -0.02 0.00 0.50 0.00 0.00 46.19 45.75 1iin s LEU 107 CO 0.24 -0.00 -0.14 0.54 -1.32 0.00 0.00 176.35 175.67 1iin s VAL 108 N 0.89 1.10 0.28 1.68 0.11 -0.26 -0.66 120.40 123.54 1iin s VAL 108 Ca -0.10 -0.85 -0.28 0.00 -2.93 0.00 0.00 61.98 57.81 1iin s VAL 108 Cb -0.15 -0.97 -0.09 0.00 -1.53 0.00 0.00 36.38 33.64 1iin s VAL 108 CO 0.01 0.11 0.98 -0.76 -3.33 0.00 0.00 175.10 172.11 1iin s LEU 109 N -0.85 4.50 0.55 2.54 1.43 -0.31 -1.68 118.68 124.85 1iin s LEU 109 Ca 0.03 1.98 0.36 0.00 -1.03 0.00 0.00 54.13 55.47 1iin s LEU 109 Cb -0.07 -3.78 1.74 0.00 0.03 0.00 0.00 46.19 44.11 1iin s LEU 109 CO 0.01 -0.01 2.08 1.23 0.23 0.00 0.00 176.35 179.89 1iin h GLY 110 N 3.67 0.00 -1.87 -3.19 0.00 -0.91 -2.69 103.07 98.09 1iin h GLY 110 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.87 1iin h GLY 110 CO 0.66 0.00 0.00 2.09 0.00 0.00 0.00 176.54 179.29 1iin n ASP 111 N -2.92 3.97 -4.83 0.19 5.68 -1.26 -4.51 116.55 112.87 1iin n ASP 111 Ca -0.01 -2.75 -0.37 0.00 -0.50 0.00 0.00 54.79 51.16 1iin n ASP 111 Cb 0.18 -0.50 -0.07 0.00 -1.14 0.00 0.00 41.12 39.59 1iin n ASP 111 CO 0.00 0.00 0.00 0.20 -1.33 0.00 0.00 177.20 176.07 1iin s ASN 112 N -1.53 6.40 -0.24 -1.12 0.02 -1.01 -4.58 114.94 112.87 1iin s ASN 112 Ca 0.40 0.47 0.02 0.00 -1.02 0.00 0.00 52.86 52.74 1iin s ASN 112 Cb 0.30 -2.10 0.06 0.00 0.02 0.00 0.00 41.25 39.53 1iin s ASN 112 CO 0.12 0.33 -0.10 -0.63 0.02 0.00 0.00 177.10 176.84 1iin s ILE 113 N -0.62 1.98 -0.14 0.60 1.01 -1.26 -3.98 121.20 118.79 1iin s ILE 113 Ca 0.15 -1.45 -0.05 0.00 0.00 0.00 0.00 60.65 59.29 1iin s ILE 113 Cb -0.12 -2.10 -0.04 0.00 0.01 0.00 0.00 42.46 40.21 1iin s ILE 113 CO 0.04 0.01 0.05 -0.36 0.00 0.00 0.00 174.94 174.67 1iin s PHE 114 N 1.20 3.28 -0.01 3.97 0.40 -1.26 -1.87 117.98 123.69 1iin s PHE 114 Ca -0.07 0.19 0.01 0.00 -0.60 0.00 0.00 56.93 56.46 1iin s PHE 114 Cb -0.19 -1.94 -0.00 0.00 0.51 0.00 0.00 43.02 41.39 1iin s PHE 114 CO -0.06 0.37 -0.04 -0.47 0.70 0.00 0.00 175.22 175.72 1iin s TYR 115 N -0.34 0.39 0.00 0.36 5.04 -0.29 -4.99 117.35 117.53 1iin s TYR 115 Ca 0.08 -0.07 0.00 0.00 -2.44 0.00 0.00 57.07 54.64 1iin s TYR 115 Cb -0.12 -0.27 0.00 0.00 0.35 0.00 0.00 41.96 41.92 1iin s TYR 115 CO 0.02 -0.02 0.00 0.41 -1.34 0.00 0.00 175.55 174.62 1iin n GLY 116 N 3.07 2.45 0.36 8.97 0.00 -1.26 -0.96 105.19 117.81 1iin n GLY 116 Ca -0.14 0.17 0.09 0.00 0.00 0.00 0.00 46.02 46.14 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 0.71 -0.56 1.61 2.76 -2.01 -2.19 115.15 115.46 1iin h HIS 117 Ca 0.00 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.19 1iin h HIS 117 Cb 0.00 -0.23 0.00 0.00 1.55 0.00 0.00 27.41 28.73 1iin h HIS 117 CO 0.00 0.35 0.00 -0.25 -1.30 0.00 0.00 177.93 176.73 1iin n ASP 118 N -4.49 3.75 -0.30 3.26 8.00 -1.26 -4.52 116.55 120.99 1iin n ASP 118 Ca 0.12 -2.24 0.00 0.00 0.71 0.00 0.00 54.79 53.38 1iin n ASP 118 Cb 0.30 -0.48 0.13 0.00 -0.02 0.00 0.00 41.12 41.05 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 3.43 0.83 -0.65 0.64 5.85 -1.77 -1.63 115.31 122.01 1iin h LEU 119 Ca 0.00 0.01 0.04 0.00 0.84 0.00 0.00 57.88 58.77 1iin h LEU 119 Cb 1.10 -0.16 -0.05 0.00 0.37 0.00 0.00 40.66 41.92 1iin h LEU 119 CO 0.13 0.54 0.39 -0.65 -0.34 0.00 0.00 178.44 178.51 1iin h PRO 120 N 0.97 0.73 -0.38 5.25 0.11 -1.82 0.88 132.00 137.74 1iin h PRO 120 Ca 0.36 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 66.36 1iin h PRO 120 Cb 0.14 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.08 1iin h PRO 120 CO -0.16 0.48 -0.04 0.87 -0.21 0.00 0.00 178.00 178.94 1iin h LYS 121 N 0.75 0.70 -0.79 1.05 6.56 -1.82 -1.38 116.57 121.64 1iin h LYS 121 Ca 0.27 -0.24 0.07 0.00 -1.06 0.00 0.00 60.65 59.69 1iin h LYS 121 Cb 0.08 -0.05 -0.06 0.00 -0.57 0.00 0.00 32.23 31.62 1iin h LYS 121 CO -0.13 0.82 0.47 1.25 -2.06 0.00 0.00 179.45 179.80 1iin h LEU 122 N 0.52 0.72 -0.37 2.94 5.85 -0.76 -1.38 115.31 122.82 1iin h LEU 122 Ca 0.10 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.85 1iin h LEU 122 Cb 0.53 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.44 1iin h LEU 122 CO 0.03 0.45 0.00 0.24 -0.34 0.00 0.00 178.44 178.82 1iin h MET 123 N 0.85 0.00 -0.71 1.25 2.86 -0.59 -3.27 114.93 115.32 1iin h MET 123 Ca 0.36 0.00 0.03 0.00 -2.06 0.00 0.00 59.70 58.03 1iin h MET 123 Cb 0.22 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 31.83 1iin h MET 123 CO -0.19 0.00 0.44 1.49 1.06 0.00 0.00 176.91 179.71 1iin h GLU 124 N 0.00 0.84 -0.49 1.72 4.81 -0.10 -0.12 114.58 121.24 1iin h GLU 124 Ca 0.00 -0.05 0.01 0.00 -0.13 0.00 0.00 59.36 59.19 1iin h GLU 124 Cb 0.71 -0.19 -0.03 0.00 0.63 0.00 0.00 28.75 29.88 1iin h GLU 124 CO 0.00 0.56 0.32 0.00 -0.73 0.00 0.00 179.01 179.16 1iin h ALA 125 N 1.31 0.62 -0.67 2.92 0.00 -1.62 -2.03 119.26 119.78 1iin h ALA 125 Ca 0.29 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.13 1iin h ALA 125 Cb 0.03 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 1iin h ALA 125 CO -0.11 0.06 0.27 0.00 0.00 0.00 0.00 179.25 179.47 1iin h ALA 126 N 1.18 0.87 -0.43 0.00 0.00 -1.52 -1.37 119.26 117.99 1iin h ALA 126 Ca 0.18 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 1iin h ALA 126 Cb -0.07 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.44 1iin h ALA 126 CO -0.04 0.48 0.07 0.28 0.00 0.00 0.00 179.25 180.04 1iin h VAL 127 N 0.95 1.20 -0.01 0.00 2.07 -0.80 -2.91 116.25 116.74 1iin h VAL 127 Ca 0.22 -0.75 0.00 0.00 0.82 0.00 0.00 66.70 66.99 1iin h VAL 127 Cb 0.20 0.80 0.00 0.00 -1.52 0.00 0.00 31.29 30.77 1iin h VAL 127 CO -0.02 0.27 -0.20 0.59 0.02 0.00 0.00 177.57 178.24 1iin n ASN 128 N -4.29 1.01 -4.72 0.57 3.02 -0.79 -1.07 115.26 108.99 1iin n ASN 128 Ca 0.03 -0.94 -0.42 0.00 -0.03 0.00 0.00 54.58 53.22 1iin n ASN 128 Cb 0.22 0.08 -0.03 0.00 -0.61 0.00 0.00 39.78 39.45 1iin n ASN 128 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 1iin s LYS 129 N -2.42 4.18 0.20 3.52 2.20 -0.56 -4.85 119.74 122.01 1iin s LYS 129 Ca 0.27 2.46 -0.07 0.00 -0.36 0.00 0.00 55.97 58.28 1iin s LYS 129 Cb 0.20 -3.11 0.14 0.00 -1.51 0.00 0.00 37.83 33.54 1iin s LYS 129 CO 0.48 -0.65 1.66 0.93 -0.36 0.00 0.00 175.35 177.41 1iin h GLU 130 N 6.61 0.98 -3.24 4.03 4.39 -1.91 -3.43 114.58 122.00 1iin h GLU 130 Ca -0.43 -0.31 -0.01 0.00 0.34 0.00 0.00 59.36 58.95 1iin h GLU 130 Cb 1.20 -0.09 -0.10 0.00 -0.10 0.00 0.00 28.75 29.67 1iin h GLU 130 CO 0.92 0.98 0.07 -1.54 -1.16 0.00 0.00 179.01 178.29 1iin s SER 131 N -6.62 -0.29 0.00 1.42 1.04 -1.26 -4.59 113.70 103.40 1iin s SER 131 Ca -0.11 -0.46 0.00 0.00 0.48 0.00 0.00 55.95 55.86 1iin s SER 131 Cb 0.14 0.60 0.00 0.00 0.10 0.00 0.00 66.02 66.86 1iin s SER 131 CO 0.85 -1.09 0.00 0.61 0.98 0.00 0.00 173.24 174.58 1iin n GLY 132 N -0.37 -1.66 3.08 7.32 0.00 -1.26 -4.95 105.19 107.35 1iin n GLY 132 Ca -0.10 -1.91 -0.09 0.00 0.00 0.00 0.00 46.02 43.92 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 -1.89 0.01 -0.05 4.61 0.00 -0.40 -1.73 121.76 122.32 1iin s ALA 133 Ca 0.00 -0.58 0.03 0.00 0.00 0.00 0.00 51.96 51.41 1iin s ALA 133 Cb 0.00 0.21 0.00 0.00 0.00 0.00 0.00 23.12 23.34 1iin s ALA 133 CO 0.00 -0.28 -0.14 0.99 0.00 0.00 0.00 175.76 176.34 1iin s THR 134 N -2.35 1.20 0.34 0.00 2.01 -0.02 -0.35 115.64 116.46 1iin s THR 134 Ca -0.07 -0.56 0.07 0.00 0.31 0.00 0.00 61.69 61.43 1iin s THR 134 Cb -0.03 -1.05 -0.07 0.00 0.01 0.00 0.00 72.50 71.36 1iin s THR 134 CO -0.04 0.36 -0.03 0.68 -0.69 0.00 0.00 174.62 174.90 1iin s VAL 135 N 0.28 1.83 -0.19 3.82 -7.23 -0.43 -1.45 120.40 117.02 1iin s VAL 135 Ca -0.07 -2.09 0.01 0.00 -1.81 0.00 0.00 61.98 58.01 1iin s VAL 135 Cb -0.12 -2.71 0.03 0.00 0.56 0.00 0.00 36.38 34.15 1iin s VAL 135 CO 0.02 -0.14 -0.14 -0.36 -0.31 0.00 0.00 175.10 174.17 1iin s PHE 136 N -2.87 2.63 0.07 2.82 0.40 -1.25 -0.19 117.98 119.59 1iin s PHE 136 Ca 0.33 -1.66 -0.03 0.00 -0.60 0.00 0.00 56.93 54.97 1iin s PHE 136 Cb 0.06 -1.77 -0.05 0.00 0.51 0.00 0.00 43.02 41.77 1iin s PHE 136 CO 0.15 -0.77 0.27 0.00 0.70 0.00 0.00 175.22 175.57 1iin s ALA 137 N 1.33 3.90 -0.11 5.36 0.00 -0.25 -1.36 121.76 130.63 1iin s ALA 137 Ca 0.01 -0.69 -0.07 0.00 0.00 0.00 0.00 51.96 51.21 1iin s ALA 137 Cb -0.15 -1.98 0.04 0.00 0.00 0.00 0.00 23.12 21.03 1iin s ALA 137 CO -0.10 0.74 0.27 -0.47 0.00 0.00 0.00 175.76 176.20 1iin s TYR 138 N -1.51 -0.35 0.10 0.00 5.04 -0.58 -1.02 117.35 119.02 1iin s TYR 138 Ca 0.35 0.83 -0.31 0.00 -2.44 0.00 0.00 57.07 55.51 1iin s TYR 138 Cb -0.13 0.09 -0.07 0.00 0.35 0.00 0.00 41.96 42.21 1iin s TYR 138 CO 0.24 -0.22 1.23 -1.58 -1.34 0.00 0.00 175.55 173.88 1iin s HIS 139 N 0.96 3.40 0.21 4.97 5.65 -1.26 -0.44 115.29 128.78 1iin s HIS 139 Ca -0.07 1.27 0.02 0.00 0.25 0.00 0.00 55.06 56.54 1iin s HIS 139 Cb -0.08 -3.47 -0.05 0.00 -1.18 0.00 0.00 32.58 27.81 1iin s HIS 139 CO -0.07 -1.44 0.02 0.14 -0.65 0.00 0.00 174.74 172.74 1iin s VAL 140 N 0.81 0.78 -1.04 0.89 -7.23 -0.05 -4.91 120.40 109.64 1iin s VAL 140 Ca 0.58 -2.00 0.23 0.00 -1.81 0.00 0.00 61.98 58.98 1iin s VAL 140 Cb -0.31 -2.28 -0.08 0.00 0.56 0.00 0.00 36.38 34.26 1iin s VAL 140 CO 0.31 -0.34 1.20 0.59 -0.31 0.00 0.00 175.10 176.55 1iin n ASN 141 N -0.34 0.75 -3.10 4.85 3.02 -1.26 -4.46 115.26 114.72 1iin n ASN 141 Ca -0.05 -0.60 -0.24 0.00 -0.03 0.00 0.00 54.58 53.66 1iin n ASN 141 Cb 0.64 0.56 -0.04 0.00 -0.61 0.00 0.00 39.78 40.32 1iin n ASN 141 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 1iin n ASP 142 N -1.44 2.82 0.13 6.41 5.68 -1.26 -4.91 116.55 123.97 1iin n ASP 142 Ca 0.05 -3.35 0.13 0.00 -0.50 0.00 0.00 54.79 51.12 1iin n ASP 142 Cb 0.34 -0.60 0.64 0.00 -1.14 0.00 0.00 41.12 40.36 1iin n ASP 142 CO 0.00 0.00 0.00 -0.65 -1.33 0.00 0.00 177.20 175.22 1iin h PRO 143 N 3.22 0.05 0.00 0.11 0.11 -1.87 -1.61 132.00 132.01 1iin h PRO 143 Ca 0.12 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.23 1iin h PRO 143 Cb 0.71 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.81 1iin h PRO 143 CO 0.69 0.03 0.03 1.05 -0.21 0.00 0.00 178.00 179.59 1iin h GLU 144 N 0.05 0.00 0.00 1.05 9.09 -1.91 -0.44 114.58 122.42 1iin h GLU 144 Ca 0.12 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.53 1iin h GLU 144 Cb 0.41 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.51 1iin h GLU 144 CO -0.01 0.00 -0.33 0.54 0.05 0.00 0.00 179.01 179.26 1iin n ARG 145 N -2.44 0.07 -4.09 1.06 1.74 -0.60 -4.27 116.66 108.14 1iin n ARG 145 Ca -0.02 0.03 -0.22 0.00 -0.77 0.00 0.00 57.85 56.87 1iin n ARG 145 Cb 0.07 -1.56 -0.06 0.00 -1.02 0.00 0.00 32.46 29.89 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 -1.67 0.19 -2.45 -1.55 4.02 -0.18 -4.81 117.16 110.70 1iin n TYR 146 Ca 0.06 -2.25 -0.40 0.00 -0.01 0.00 0.00 57.90 55.30 1iin n TYR 146 Cb 0.36 -0.03 -0.04 0.00 -0.02 0.00 0.00 39.34 39.62 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 -3.18 3.01 -0.06 2.72 0.00 -1.26 -0.57 107.32 107.98 1iin s GLY 147 Ca 0.16 0.89 0.04 0.00 0.00 0.00 0.00 44.72 45.82 1iin s GLY 147 CO 0.12 1.47 -0.18 0.14 0.00 0.00 0.00 173.10 174.65 1iin s VAL 148 N -1.25 1.51 -0.15 1.40 1.01 0.81 -0.50 120.40 123.23 1iin s VAL 148 Ca 0.47 -0.74 -0.02 0.00 0.00 0.00 0.00 61.98 61.70 1iin s VAL 148 Cb -0.31 -1.31 -0.02 0.00 0.00 0.00 0.00 36.38 34.74 1iin s VAL 148 CO 0.40 0.43 -0.09 0.54 0.00 0.00 0.00 175.10 176.38 1iin s VAL 149 N 0.20 3.33 -0.12 2.92 0.11 -0.69 -1.67 120.40 124.48 1iin s VAL 149 Ca -0.08 -0.55 -0.05 0.00 -2.93 0.00 0.00 61.98 58.37 1iin s VAL 149 Cb -0.14 -2.43 -0.04 0.00 -1.53 0.00 0.00 36.38 32.25 1iin s VAL 149 CO 0.04 0.51 0.04 -0.70 -3.33 0.00 0.00 175.10 171.66 1iin s GLU 150 N 0.45 3.39 0.12 1.54 2.12 -0.63 -4.39 118.70 121.31 1iin s GLU 150 Ca -0.07 -0.34 0.07 0.00 0.36 0.00 0.00 54.97 54.99 1iin s GLU 150 Cb -0.15 -3.00 -0.04 0.00 0.26 0.00 0.00 34.13 31.20 1iin s GLU 150 CO 0.04 0.58 -0.07 -0.06 -0.54 0.00 0.00 175.26 175.21 1iin s PHE 151 N -0.50 2.78 0.11 5.30 0.40 -1.26 0.05 117.98 124.86 1iin s PHE 151 Ca 0.10 -0.14 -0.00 0.00 -0.60 0.00 0.00 56.93 56.28 1iin s PHE 151 Cb -0.12 -1.42 0.02 0.00 0.51 0.00 0.00 43.02 42.01 1iin s PHE 151 CO 0.02 0.46 0.15 -0.40 0.70 0.00 0.00 175.22 176.15 1iin n ASP 152 N 0.47 0.15 -0.32 1.36 5.68 -0.23 -4.87 116.55 118.80 1iin n ASP 152 Ca -0.12 -1.14 0.01 0.00 -0.50 0.00 0.00 54.79 53.04 1iin n ASP 152 Cb 0.53 -0.10 0.19 0.00 -1.14 0.00 0.00 41.12 40.60 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 1.13 -0.55 0.11 7.50 -2.01 -1.76 115.11 119.54 1iin h GLN 153 Ca -0.05 -0.07 -0.04 0.00 0.50 0.00 0.00 58.65 59.00 1iin h GLN 153 Cb 0.17 -0.26 -0.03 0.00 0.05 0.00 0.00 27.48 27.42 1iin h GLN 153 CO 0.05 0.75 0.19 0.87 -1.50 0.00 0.00 178.83 179.19 1iin h LYS 154 N 1.17 0.81 0.00 1.46 1.57 -2.05 -3.46 116.57 116.07 1iin h LYS 154 Ca 0.36 -0.13 0.00 0.00 -1.87 0.00 0.00 60.65 59.01 1iin h LYS 154 Cb -0.01 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.16 1iin h LYS 154 CO -0.10 0.68 0.00 0.41 -0.57 0.00 0.00 179.45 179.87 1iin n GLY 155 N -1.00 1.38 3.78 3.86 0.00 -0.66 -5.10 105.19 107.44 1iin n GLY 155 Ca 0.04 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.67 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 4.55 -0.06 2.61 2.01 -1.26 -4.75 115.64 116.73 1iin s THR 156 Ca 0.00 1.51 -0.30 0.00 0.31 0.00 0.00 61.69 63.21 1iin s THR 156 Cb 0.00 -4.05 -0.05 0.00 0.01 0.00 0.00 72.50 68.42 1iin s THR 156 CO 0.00 0.52 1.52 0.00 -0.69 0.00 0.00 174.62 175.97 1iin s ALA 157 N -1.00 3.63 -0.12 7.40 0.00 -1.26 -1.06 121.76 129.33 1iin s ALA 157 Ca 0.33 0.84 0.07 0.00 0.00 0.00 0.00 51.96 53.20 1iin s ALA 157 Cb -0.21 -3.69 -0.10 0.00 0.00 0.00 0.00 23.12 19.11 1iin s ALA 157 CO 0.23 -1.25 0.21 1.33 0.00 0.00 0.00 175.76 176.29 1iin n VAL 158 N 5.27 0.00 -3.60 0.00 0.24 0.11 -4.94 118.33 115.41 1iin n VAL 158 Ca 0.16 -0.22 -0.13 0.00 -2.04 0.00 0.00 64.34 62.10 1iin n VAL 158 Cb 0.43 0.56 -0.05 0.00 -1.47 0.00 0.00 33.84 33.31 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 -2.44 -0.36 -0.04 -1.34 1.04 -1.20 -4.99 113.70 104.37 1iin s SER 159 Ca -0.01 0.02 -0.00 0.00 0.48 0.00 0.00 55.95 56.44 1iin s SER 159 Cb 0.05 0.48 0.03 0.00 0.10 0.00 0.00 66.02 66.67 1iin s SER 159 CO 0.30 -0.75 0.01 -0.76 0.98 0.00 0.00 173.24 173.03 1iin s LEU 160 N -2.19 0.94 -0.01 2.42 1.43 -1.26 -1.60 118.68 118.41 1iin s LEU 160 Ca -0.03 -0.02 0.00 0.00 -1.03 0.00 0.00 54.13 53.05 1iin s LEU 160 Cb -0.00 -0.24 0.01 0.00 0.03 0.00 0.00 46.19 45.98 1iin s LEU 160 CO -0.05 -0.13 -0.01 -1.61 0.23 0.00 0.00 176.35 174.78 1iin s GLU 161 N 1.31 0.13 -0.38 1.70 2.02 -0.67 -4.97 118.70 117.85 1iin s GLU 161 Ca -0.06 -0.02 -0.20 0.00 0.02 0.00 0.00 54.97 54.72 1iin s GLU 161 Cb -0.13 -0.18 0.01 0.00 0.10 0.00 0.00 34.13 33.93 1iin s GLU 161 CO -0.02 -0.01 0.61 -2.00 0.02 0.00 0.00 175.26 173.86 1iin s GLU 162 N 0.19 3.52 -1.18 1.61 2.56 -1.26 -0.14 118.70 124.01 1iin s GLU 162 Ca -0.02 -0.16 -0.12 0.00 0.00 0.00 0.00 54.97 54.67 1iin s GLU 162 Cb -0.03 -3.86 -0.02 0.00 2.00 0.00 0.00 34.13 32.22 1iin s GLU 162 CO -0.01 -0.81 0.77 1.63 -0.56 0.00 0.00 175.26 176.28 1iin n LYS 163 N 6.04 -2.37 -2.11 4.30 5.02 0.26 -4.91 118.16 124.39 1iin n LYS 163 Ca -0.02 0.57 -0.41 0.00 -2.02 0.00 0.00 58.31 56.42 1iin n LYS 163 Cb 0.48 -4.70 -0.02 0.00 -0.02 0.00 0.00 35.03 30.77 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 -5.72 4.34 0.35 1.97 0.04 -1.26 -4.90 135.00 129.82 1iin s PRO 164 Ca 0.34 2.22 0.16 0.00 0.04 0.00 0.00 61.00 63.76 1iin s PRO 164 Cb -0.10 -3.08 0.58 0.00 0.04 0.00 0.00 34.50 31.94 1iin s PRO 164 CO 0.83 -0.23 1.70 -0.07 0.04 0.00 0.00 177.00 179.27 1iin h LEU 165 N 3.74 0.00 -6.89 -3.56 3.38 -1.91 -3.31 115.31 106.75 1iin h LEU 165 Ca -0.48 0.00 -0.61 0.00 0.09 0.00 0.00 57.88 56.88 1iin h LEU 165 Cb 1.22 0.00 -0.41 0.00 0.09 0.00 0.00 40.66 41.57 1iin h LEU 165 CO 0.68 0.44 -0.69 -1.10 0.09 0.00 0.00 178.44 177.86 1iin s GLN 166 N -3.60 2.01 0.27 1.13 -0.21 -1.26 -5.03 119.66 112.97 1iin s GLN 166 Ca -0.00 -2.97 -0.30 0.00 0.02 0.00 0.00 55.36 52.11 1iin s GLN 166 Cb 0.11 -2.86 -0.13 0.00 1.00 0.00 0.00 33.01 31.13 1iin s GLN 166 CO 0.71 -1.31 1.31 -2.30 -2.12 0.00 0.00 175.29 171.58 1iin n PRO 167 N 2.26 1.94 0.00 2.91 -0.02 -1.25 -4.87 135.00 135.98 1iin n PRO 167 Ca 0.22 0.69 0.14 0.00 -2.02 0.00 0.00 63.50 62.53 1iin n PRO 167 Cb 0.38 -2.28 0.59 0.00 -0.02 0.00 0.00 33.50 32.18 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 1.41 0.99 -3.92 -0.52 5.02 -1.26 -4.93 118.16 114.96 1iin n LYS 168 Ca 0.09 -0.42 0.00 0.00 -2.02 0.00 0.00 58.31 55.96 1iin n LYS 168 Cb 0.33 -1.49 0.01 0.00 -0.02 0.00 0.00 35.03 33.86 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 -0.00 -0.18 4.39 1.04 -1.26 -4.87 113.70 110.52 1iin s SER 169 Ca 0.33 -0.40 0.16 0.00 0.48 0.00 0.00 55.95 56.52 1iin s SER 169 Cb 0.20 0.30 0.60 0.00 0.10 0.00 0.00 66.02 67.22 1iin s SER 169 CO 0.44 -0.59 1.51 0.59 0.98 0.00 0.00 173.24 176.16 1iin n ASN 170 N -1.09 4.34 -4.54 7.02 3.02 -1.26 -4.84 115.26 117.91 1iin n ASN 170 Ca 0.00 -2.89 -0.42 0.00 -0.03 0.00 0.00 54.58 51.24 1iin n ASN 170 Cb 0.59 -0.56 -0.08 0.00 -0.61 0.00 0.00 39.78 39.12 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 -2.62 3.16 0.28 3.10 1.51 -1.26 -0.87 117.35 120.65 1iin s TYR 171 Ca 0.45 0.06 -0.22 0.00 -1.01 0.00 0.00 57.07 56.35 1iin s TYR 171 Cb 0.34 -2.99 -0.09 0.00 -0.11 0.00 0.00 41.96 39.11 1iin s TYR 171 CO 0.12 -0.62 0.82 0.00 -1.11 0.00 0.00 175.55 174.77 1iin s ALA 172 N 2.43 3.31 -0.52 3.71 0.00 0.41 -1.70 121.76 129.39 1iin s ALA 172 Ca 0.18 0.31 -0.19 0.00 0.00 0.00 0.00 51.96 52.26 1iin s ALA 172 Cb -0.15 -2.97 0.07 0.00 0.00 0.00 0.00 23.12 20.06 1iin s ALA 172 CO 0.14 0.26 0.64 0.08 0.00 0.00 0.00 175.76 176.88 1iin s VAL 173 N -1.63 4.87 1.20 0.00 1.01 0.34 -1.53 120.40 124.66 1iin s VAL 173 Ca 0.48 -0.60 -0.17 0.00 0.00 0.00 0.00 61.98 61.69 1iin s VAL 173 Cb -0.17 -4.33 0.28 0.00 0.00 0.00 0.00 36.38 32.16 1iin s VAL 173 CO 0.21 -0.87 1.04 0.42 0.00 0.00 0.00 175.10 175.91 1iin s THR 174 N 2.63 1.70 -0.16 3.92 -4.23 -0.46 -4.45 115.64 114.59 1iin s THR 174 Ca 0.14 0.00 -0.02 0.00 -1.18 0.00 0.00 61.69 60.64 1iin s THR 174 Cb -0.20 -2.30 0.05 0.00 1.34 0.00 0.00 72.50 71.39 1iin s THR 174 CO 0.11 0.00 2.31 0.61 -0.54 0.00 0.00 174.62 177.10 1iin n GLY 175 N -0.06 3.35 2.80 3.99 0.00 -1.26 -4.75 105.19 109.26 1iin n GLY 175 Ca 0.09 -0.76 -0.22 0.00 0.00 0.00 0.00 46.02 45.12 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 -0.89 0.77 0.00 0.99 2.96 -1.26 -1.16 118.68 120.09 1iin s LEU 176 Ca 0.26 -0.10 0.00 0.00 -0.22 0.00 0.00 54.13 54.08 1iin s LEU 176 Cb 0.17 -0.45 -0.00 0.00 0.50 0.00 0.00 46.19 46.40 1iin s LEU 176 CO -0.02 -0.16 -0.01 -0.31 -1.32 0.00 0.00 176.35 174.52 1iin s TYR 177 N 1.73 0.09 -0.17 5.38 1.51 0.17 -3.88 117.35 122.19 1iin s TYR 177 Ca 0.02 -0.10 0.01 0.00 -1.01 0.00 0.00 57.07 55.98 1iin s TYR 177 Cb -0.13 -0.06 0.01 0.00 -0.11 0.00 0.00 41.96 41.67 1iin s TYR 177 CO -0.04 -0.03 -0.18 -0.06 -1.11 0.00 0.00 175.55 174.12 1iin s PHE 178 N -0.28 2.77 0.14 2.71 0.40 -0.53 -0.06 117.98 123.13 1iin s PHE 178 Ca -0.03 -1.38 0.10 0.00 -0.60 0.00 0.00 56.93 55.02 1iin s PHE 178 Cb -0.02 -1.90 -0.04 0.00 0.51 0.00 0.00 43.02 41.57 1iin s PHE 178 CO -0.00 -0.67 -0.23 0.71 0.70 0.00 0.00 175.22 175.74 1iin s TYR 179 N 1.08 2.03 0.43 0.36 1.51 -0.29 -0.84 117.35 121.64 1iin s TYR 179 Ca -0.00 -0.41 -0.05 0.00 -1.01 0.00 0.00 57.07 55.60 1iin s TYR 179 Cb -0.14 -1.07 0.10 0.00 -0.11 0.00 0.00 41.96 40.74 1iin s TYR 179 CO -0.06 0.32 0.59 -0.40 -1.11 0.00 0.00 175.55 174.89 1iin n ASP 180 N 0.72 0.27 0.00 2.29 5.68 -0.70 -1.33 116.55 123.47 1iin n ASP 180 Ca -0.16 -1.35 0.08 0.00 -0.50 0.00 0.00 54.79 52.85 1iin n ASP 180 Cb 0.55 -0.43 0.40 0.00 -1.14 0.00 0.00 41.12 40.49 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 -3.25 0.00 0.04 -1.12 4.05 -1.25 -3.08 115.26 110.64 1iin n ASN 181 Ca 0.08 0.08 0.13 0.00 0.45 0.00 0.00 54.58 55.32 1iin n ASN 181 Cb 0.28 -0.30 0.51 0.00 1.23 0.00 0.00 39.78 41.50 1iin n ASN 181 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 177.26 172.67 1iin n SER 182 N -1.30 0.28 0.06 1.20 3.41 -1.26 -3.55 113.62 112.47 1iin n SER 182 Ca 0.07 0.53 0.02 0.00 -0.26 0.00 0.00 58.87 59.23 1iin n SER 182 Cb 0.13 -0.61 0.36 0.00 -0.26 0.00 0.00 64.21 63.83 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 1.17 -0.38 -3.33 3.04 -1.92 -2.80 116.25 112.04 1iin h VAL 183 Ca 0.00 -0.71 -0.00 0.00 -1.01 0.00 0.00 66.70 64.98 1iin h VAL 183 Cb 0.52 1.04 -0.02 0.00 -2.01 0.00 0.00 31.29 30.82 1iin h VAL 183 CO 0.00 0.23 0.23 0.58 -1.01 0.00 0.00 177.57 177.60 1iin h VAL 184 N 0.36 1.12 -0.08 1.51 2.07 -1.84 -0.48 116.25 118.91 1iin h VAL 184 Ca 0.08 -0.29 -0.14 0.00 0.82 0.00 0.00 66.70 67.17 1iin h VAL 184 Cb 0.31 0.64 -0.01 0.00 -1.52 0.00 0.00 31.29 30.70 1iin h VAL 184 CO 0.01 0.13 -0.56 -0.08 0.02 0.00 0.00 177.57 177.09 1iin h GLU 185 N 0.49 0.23 -0.52 1.57 4.57 -1.77 -1.95 114.58 117.20 1iin h GLU 185 Ca 0.13 -0.15 -0.01 0.00 -1.18 0.00 0.00 59.36 58.16 1iin h GLU 185 Cb 0.01 0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.59 1iin h GLU 185 CO -0.03 0.73 0.29 0.52 -1.18 0.00 0.00 179.01 179.34 1iin h MET 186 N 0.18 0.72 -0.71 1.92 2.86 -1.21 -2.54 114.93 116.14 1iin h MET 186 Ca -0.00 -0.08 -0.02 0.00 -2.06 0.00 0.00 59.70 57.54 1iin h MET 186 Cb 1.04 -0.14 -0.03 0.00 0.06 0.00 0.00 31.60 32.53 1iin h MET 186 CO 0.09 0.56 0.36 0.00 1.06 0.00 0.00 176.91 178.97 1iin h ALA 187 N 1.12 0.92 0.00 6.32 0.00 -0.71 -2.03 119.26 124.89 1iin h ALA 187 Ca 0.18 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1iin h ALA 187 Cb 0.04 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.55 1iin h ALA 187 CO -0.03 0.46 0.00 0.87 0.00 0.00 0.00 179.25 180.55 1iin h LYS 188 N 0.99 0.00 -0.02 0.00 1.57 -0.99 -2.31 116.57 115.82 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 0.09 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.40 1iin h LYS 188 CO -0.03 0.00 -0.42 0.09 -0.57 0.00 0.00 179.45 178.51 1iin n ASN 189 N -2.88 2.11 -4.77 0.86 3.02 -0.79 -4.98 115.26 107.83 1iin n ASN 189 Ca -0.01 -1.55 -0.38 0.00 -0.03 0.00 0.00 54.58 52.61 1iin n ASN 189 Cb 0.14 0.42 -0.03 0.00 -0.61 0.00 0.00 39.78 39.71 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 -2.43 4.20 0.00 3.41 1.43 -0.87 -5.05 118.68 119.37 1iin s LEU 190 Ca 0.20 2.23 0.02 0.00 -1.03 0.00 0.00 54.13 55.54 1iin s LEU 190 Cb 0.18 -4.05 -0.04 0.00 0.03 0.00 0.00 46.19 42.31 1iin s LEU 190 CO 0.54 -0.57 -0.02 -0.54 0.23 0.00 0.00 176.35 175.99 1iin s LYS 191 N -2.31 2.70 0.39 1.70 1.02 -1.26 -5.03 119.74 116.95 1iin s LYS 191 Ca 0.56 -0.65 -0.27 0.00 0.02 0.00 0.00 55.97 55.63 1iin s LYS 191 Cb -0.28 -2.61 -0.11 0.00 -0.52 0.00 0.00 37.83 34.32 1iin s LYS 191 CO 0.35 0.62 1.32 -0.35 -0.92 0.00 0.00 175.35 176.36 1iin n PRO 192 N 1.44 2.11 -1.15 -1.68 -0.04 -1.26 -4.78 135.00 129.65 1iin n PRO 192 Ca -0.15 0.75 -0.20 0.00 -0.04 0.00 0.00 63.50 63.86 1iin n PRO 192 Cb 0.53 -2.42 0.14 0.00 -0.04 0.00 0.00 33.50 31.71 1iin n PRO 192 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1iin n SER 193 N 0.40 -0.31 -0.34 3.54 3.41 -0.49 -4.78 113.62 115.05 1iin n SER 193 Ca 0.05 -1.24 0.10 0.00 -0.26 0.00 0.00 58.87 57.52 1iin n SER 193 Cb 0.38 -0.68 0.30 0.00 -0.26 0.00 0.00 64.21 63.96 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 -1.99 1.65 -0.06 7.33 0.00 -1.94 0.33 119.26 124.57 1iin h ALA 194 Ca -0.28 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1iin h ALA 194 Cb 0.80 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1iin h ALA 194 CO 0.20 0.06 0.00 2.89 0.00 0.00 0.00 179.25 182.40 1iin n ARG 195 N -4.65 1.19 -1.78 0.00 1.85 -1.26 -4.88 116.66 107.12 1iin n ARG 195 Ca 0.20 -0.24 -0.07 0.00 -1.00 0.00 0.00 57.85 56.73 1iin n ARG 195 Cb 0.46 -1.15 -0.01 0.00 -1.05 0.00 0.00 32.46 30.71 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 0.50 0.41 3.28 2.89 0.00 0.12 -5.04 105.19 107.34 1iin n GLY 196 Ca 0.02 -0.63 -0.20 0.00 0.00 0.00 0.00 46.02 45.22 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 -3.70 1.12 -0.38 1.61 2.02 -1.26 -4.75 118.70 113.35 1iin s GLU 197 Ca 0.00 -1.28 -0.27 0.00 0.02 0.00 0.00 54.97 53.43 1iin s GLU 197 Cb 0.00 -1.10 0.02 0.00 0.10 0.00 0.00 34.13 33.15 1iin s GLU 197 CO 0.00 0.22 1.00 -0.51 0.02 0.00 0.00 175.26 176.00 1iin s LEU 198 N -2.46 3.91 -0.05 1.80 1.43 0.35 -1.40 118.68 122.27 1iin s LEU 198 Ca 0.11 0.64 -0.23 0.00 -1.03 0.00 0.00 54.13 53.62 1iin s LEU 198 Cb -0.06 -3.38 -0.04 0.00 0.03 0.00 0.00 46.19 42.74 1iin s LEU 198 CO 0.04 -0.95 0.69 -1.61 0.23 0.00 0.00 176.35 174.75 1iin s GLU 199 N 3.73 4.43 0.43 1.70 0.41 -1.26 -2.80 118.70 125.34 1iin s GLU 199 Ca 0.42 0.87 0.13 0.00 -0.41 0.00 0.00 54.97 55.97 1iin s GLU 199 Cb -0.11 -3.43 0.94 0.00 -1.78 0.00 0.00 34.13 29.75 1iin s GLU 199 CO 0.21 0.12 1.98 0.97 -0.49 0.00 0.00 175.26 178.04 1iin h ILE 200 N 4.64 1.14 0.00 -1.63 6.09 -1.94 -2.00 117.51 123.81 1iin h ILE 200 Ca -0.42 -0.63 -0.05 0.00 -1.37 0.00 0.00 64.86 62.39 1iin h ILE 200 Cb 1.20 1.26 -0.01 0.00 0.47 0.00 0.00 36.82 39.74 1iin h ILE 200 CO 0.74 0.19 -0.23 0.74 -3.07 0.00 0.00 178.15 176.53 1iin h THR 201 N 0.09 0.90 -0.31 2.19 2.02 -1.99 -0.78 112.91 115.03 1iin h THR 201 Ca 0.02 -0.86 -0.16 0.00 0.77 0.00 0.00 66.41 66.18 1iin h THR 201 Cb 0.31 1.50 -0.00 0.00 -1.74 0.00 0.00 68.15 68.22 1iin h THR 201 CO 0.02 0.22 -0.42 0.44 0.37 0.00 0.00 175.52 176.15 1iin h ASP 202 N 0.00 0.92 -0.10 4.18 3.32 -1.77 -0.58 116.42 122.40 1iin h ASP 202 Ca -0.00 -0.50 0.00 0.00 0.02 0.00 0.00 57.03 56.55 1iin h ASP 202 Cb 0.48 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 1iin h ASP 202 CO 0.03 1.24 0.06 0.40 -1.72 0.00 0.00 179.24 179.24 1iin h ILE 203 N 0.62 1.02 -0.35 0.35 2.04 -1.35 -1.66 117.51 118.19 1iin h ILE 203 Ca 0.04 -0.04 -0.04 0.00 1.00 0.00 0.00 64.86 65.81 1iin h ILE 203 Cb 1.02 0.88 -0.02 0.00 -0.74 0.00 0.00 36.82 37.97 1iin h ILE 203 CO 0.10 0.02 0.03 0.78 0.00 0.00 0.00 178.15 179.09 1iin h ASN 204 N 0.12 0.49 -0.44 1.72 2.35 -1.06 -1.99 115.58 116.78 1iin h ASN 204 Ca 0.04 -0.08 -0.08 0.00 -0.55 0.00 0.00 56.30 55.63 1iin h ASN 204 Cb -0.01 -0.13 -0.02 0.00 0.05 0.00 0.00 38.32 38.21 1iin h ASN 204 CO -0.01 0.54 -0.00 -0.09 -1.65 0.00 0.00 177.43 176.21 1iin h ARG 205 N 0.52 0.85 0.22 0.81 2.43 -0.76 -0.49 114.38 117.95 1iin h ARG 205 Ca 0.11 -0.24 -0.01 0.00 -0.81 0.00 0.00 59.98 59.03 1iin h ARG 205 Cb 0.28 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.74 1iin h ARG 205 CO 0.00 0.85 -0.10 0.82 -1.51 0.00 0.00 179.97 180.03 1iin h ILE 206 N 0.79 0.79 -0.82 1.20 2.04 -0.57 0.24 117.51 121.17 1iin h ILE 206 Ca 0.15 -0.01 0.07 0.00 1.00 0.00 0.00 64.86 66.07 1iin h ILE 206 Cb 0.48 0.80 -0.06 0.00 -0.74 0.00 0.00 36.82 37.30 1iin h ILE 206 CO 0.02 0.00 0.49 1.88 0.00 0.00 0.00 178.15 180.55 1iin h TYR 207 N -0.30 0.91 -0.17 1.37 -1.99 -1.26 -0.94 116.97 114.59 1iin h TYR 207 Ca -0.03 0.03 0.00 0.00 2.00 0.00 0.00 58.73 60.73 1iin h TYR 207 Cb 0.23 -0.29 -0.01 0.00 2.00 0.00 0.00 36.73 38.66 1iin h TYR 207 CO -0.06 0.44 0.11 1.98 -0.00 0.00 0.00 178.16 180.63 1iin h MET 208 N 0.88 0.23 0.00 4.88 4.05 -0.54 0.15 114.93 124.58 1iin h MET 208 Ca 0.37 -0.01 -0.03 0.00 -0.28 0.00 0.00 59.70 59.75 1iin h MET 208 Cb 0.22 -0.05 -0.00 0.00 -0.80 0.00 0.00 31.60 30.97 1iin h MET 208 CO -0.19 0.15 -0.14 0.93 0.23 0.00 0.00 176.91 177.89 1iin h GLU 209 N 0.23 0.00 -0.01 0.39 5.08 0.35 0.04 114.58 120.67 1iin h GLU 209 Ca 0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1iin h GLU 209 Cb -0.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.22 1iin h GLU 209 CO -0.01 0.14 0.00 1.04 -1.00 0.00 0.00 179.01 179.18 1iin n GLN 210 N -4.04 1.39 -2.43 2.33 6.02 -0.44 -4.91 117.38 115.30 1iin n GLN 210 Ca -0.02 -0.57 -0.14 0.00 -0.01 0.00 0.00 57.00 56.26 1iin n GLN 210 Cb 0.22 -1.48 0.00 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 1.10 -0.17 0.27 1.08 0.00 0.00 -4.92 105.19 102.54 1iin n GLY 211 Ca 0.21 -0.26 0.09 0.00 0.00 0.00 0.00 46.02 46.05 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 1.45 -4.39 1.61 1.74 -0.02 -5.02 116.66 109.51 1iin n ARG 212 Ca -0.14 -2.79 -0.34 0.00 -0.77 0.00 0.00 57.85 53.82 1iin n ARG 212 Cb 0.61 -1.55 -0.11 0.00 -1.02 0.00 0.00 32.46 30.39 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 -2.98 3.38 0.05 0.55 2.96 -1.22 -1.27 118.68 120.15 1iin s LEU 213 Ca 0.34 -0.02 0.05 0.00 -0.22 0.00 0.00 54.13 54.28 1iin s LEU 213 Cb 0.31 -1.80 -0.04 0.00 0.50 0.00 0.00 46.19 45.17 1iin s LEU 213 CO 0.01 0.25 -0.07 -0.44 -1.32 0.00 0.00 176.35 174.78 1iin s SER 214 N -0.12 4.62 -0.19 3.68 0.01 0.52 -4.97 113.70 117.24 1iin s SER 214 Ca 0.03 -0.22 0.01 0.00 1.31 0.00 0.00 55.95 57.08 1iin s SER 214 Cb -0.13 -1.02 0.04 0.00 0.21 0.00 0.00 66.02 65.12 1iin s SER 214 CO 0.02 0.23 -0.10 -0.69 0.41 0.00 0.00 173.24 173.12 1iin s VAL 215 N -1.11 1.57 -0.09 3.43 1.01 -1.26 -1.31 120.40 122.64 1iin s VAL 215 Ca 0.20 -0.94 -0.18 0.00 0.00 0.00 0.00 61.98 61.06 1iin s VAL 215 Cb -0.11 -1.65 -0.05 0.00 0.00 0.00 0.00 36.38 34.58 1iin s VAL 215 CO 0.11 0.18 0.49 0.00 0.00 0.00 0.00 175.10 175.88 1iin s ALA 216 N 1.43 3.50 -0.17 5.51 0.00 0.73 -4.93 121.76 127.84 1iin s ALA 216 Ca -0.01 -0.16 -0.19 0.00 0.00 0.00 0.00 51.96 51.61 1iin s ALA 216 Cb -0.16 -2.63 -0.04 0.00 0.00 0.00 0.00 23.12 20.30 1iin s ALA 216 CO -0.08 0.09 0.51 -1.64 0.00 0.00 0.00 175.76 174.64 1iin s MET 217 N 0.28 4.25 -0.43 0.00 -1.94 -1.26 -1.09 119.30 119.10 1iin s MET 217 Ca 0.26 0.44 -0.13 0.00 -1.71 0.00 0.00 55.69 54.56 1iin s MET 217 Cb -0.16 -3.52 0.06 0.00 2.01 0.00 0.00 34.83 33.23 1iin s MET 217 CO 0.12 -0.05 0.31 -1.64 -0.01 0.00 0.00 175.02 173.75 1iin s MET 218 N 1.29 2.82 0.00 2.03 -1.94 -0.19 -4.95 119.30 118.36 1iin s MET 218 Ca 0.25 -1.31 0.00 0.00 -1.71 0.00 0.00 55.69 52.93 1iin s MET 218 Cb -0.15 -3.93 0.00 0.00 2.01 0.00 0.00 34.83 32.76 1iin s MET 218 CO 0.10 -0.92 0.00 0.41 -0.01 0.00 0.00 175.02 174.60 1iin n GLY 219 N 5.07 0.97 0.37 -0.03 0.00 -1.26 -4.44 105.19 105.86 1iin n GLY 219 Ca -0.11 -1.70 0.16 0.00 0.00 0.00 0.00 46.02 44.36 1iin n GLY 219 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1iin h ARG 220 N 0.00 0.25 0.00 1.61 -0.00 -2.02 -1.46 114.38 112.76 1iin h ARG 220 Ca 0.00 -0.01 0.00 0.00 -0.50 0.00 0.00 59.98 59.47 1iin h ARG 220 Cb 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 29.97 29.91 1iin h ARG 220 CO 0.00 0.16 0.00 0.41 0.00 0.00 0.00 179.97 180.54 1iin n GLY 221 N -1.56 -0.76 3.81 0.04 0.00 -1.26 -4.80 105.19 100.67 1iin n GLY 221 Ca 0.11 -0.11 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.24 2.88 -0.00 1.61 1.51 -0.55 -4.36 117.35 116.20 1iin s TYR 222 Ca 0.25 -0.29 0.01 0.00 -1.01 0.00 0.00 57.07 56.03 1iin s TYR 222 Cb 0.14 -1.69 -0.00 0.00 -0.11 0.00 0.00 41.96 40.30 1iin s TYR 222 CO 0.26 0.28 -0.03 0.00 -1.11 0.00 0.00 175.55 174.94 1iin s ALA 223 N -2.31 0.29 -0.34 3.71 0.00 -0.14 -4.95 121.76 118.02 1iin s ALA 223 Ca 0.39 -0.16 -0.00 0.00 0.00 0.00 0.00 51.96 52.18 1iin s ALA 223 Cb -0.05 -0.07 0.11 0.00 0.00 0.00 0.00 23.12 23.11 1iin s ALA 223 CO 0.25 0.06 0.13 -0.46 0.00 0.00 0.00 175.76 175.75 1iin s TRP 224 N -0.12 1.57 0.10 0.00 -0.00 -1.26 -1.13 118.94 118.10 1iin s TRP 224 Ca 0.01 -1.79 -0.30 0.00 -0.00 0.00 0.00 56.10 54.02 1iin s TRP 224 Cb -0.02 -1.62 -0.06 0.00 -0.00 0.00 0.00 33.47 31.78 1iin s TRP 224 CO -0.00 -0.85 1.02 -0.51 -0.00 0.00 0.00 176.95 176.60 1iin s LEU 225 N 1.38 4.46 0.04 5.86 1.43 -0.78 -4.98 118.68 126.09 1iin s LEU 225 Ca 0.12 1.85 -0.30 0.00 -1.03 0.00 0.00 54.13 54.77 1iin s LEU 225 Cb -0.19 -3.59 -0.04 0.00 0.03 0.00 0.00 46.19 42.40 1iin s LEU 225 CO -0.19 -0.18 1.05 -0.62 0.23 0.00 0.00 176.35 176.64 1iin s ASP 226 N 0.29 7.29 -0.11 2.29 -1.08 -1.26 -4.17 116.67 119.92 1iin s ASP 226 Ca 0.50 1.80 0.16 0.00 -0.52 0.00 0.00 52.55 54.49 1iin s ASP 226 Cb -0.25 -2.58 0.26 0.00 -1.46 0.00 0.00 42.92 38.89 1iin s ASP 226 CO 0.30 -0.30 1.13 0.35 0.52 0.00 0.00 175.17 177.17 1iin n THR 227 N 3.71 1.60 0.17 1.71 -2.24 -1.26 -4.09 114.28 113.88 1iin n THR 227 Ca 0.06 -1.97 0.06 0.00 -2.27 0.00 0.00 64.05 59.93 1iin n THR 227 Cb 0.49 -0.11 0.10 0.00 -2.10 0.00 0.00 70.33 68.71 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 0.07 0.00 -2.01 3.38 0.00 -1.92 -3.44 103.07 99.15 1iin h GLY 228 Ca -0.00 0.00 -0.45 0.00 0.00 0.00 0.00 47.33 46.87 1iin h GLY 228 CO 0.00 0.00 -0.60 -0.51 0.00 0.00 0.00 176.54 175.43 1iin s THR 229 N -3.09 0.98 0.19 4.70 -4.23 -1.26 -4.64 115.64 108.29 1iin s THR 229 Ca 0.05 -2.00 -0.12 0.00 -1.18 0.00 0.00 61.69 58.44 1iin s THR 229 Cb 0.07 -2.71 0.11 0.00 1.34 0.00 0.00 72.50 71.31 1iin s THR 229 CO 0.71 0.00 1.83 0.45 -0.54 0.00 0.00 174.62 177.08 1iin h HIS 230 N 2.14 0.72 -0.51 3.99 3.86 -1.91 -0.55 115.15 122.88 1iin h HIS 230 Ca -0.40 0.02 -0.05 0.00 -1.16 0.00 0.00 60.37 58.79 1iin h HIS 230 Cb 1.25 -0.23 -0.02 0.00 1.06 0.00 0.00 27.41 29.46 1iin h HIS 230 CO 0.66 0.41 0.13 1.96 0.86 0.00 0.00 177.93 181.95 1iin h GLN 231 N 0.75 0.82 -0.16 2.45 7.50 -1.99 -2.69 115.11 121.79 1iin h GLN 231 Ca 0.25 -0.19 -0.10 0.00 0.50 0.00 0.00 58.65 59.10 1iin h GLN 231 Cb 0.02 -0.11 -0.01 0.00 0.05 0.00 0.00 27.48 27.43 1iin h GLN 231 CO -0.10 0.78 -0.34 0.66 -1.50 0.00 0.00 178.83 178.33 1iin h SER 232 N 0.71 0.34 -0.72 1.46 4.64 -1.73 -1.23 113.55 117.02 1iin h SER 232 Ca 0.16 -0.13 0.01 0.00 -0.47 0.00 0.00 61.79 61.36 1iin h SER 232 Cb 0.32 -0.09 -0.04 0.00 -0.31 0.00 0.00 62.40 62.28 1iin h SER 232 CO 0.00 0.67 0.48 -0.07 -0.87 0.00 0.00 176.83 177.03 1iin h LEU 233 N 0.29 0.82 -0.60 5.97 3.38 -0.89 0.15 115.31 124.43 1iin h LEU 233 Ca 0.03 -0.02 -0.15 0.00 0.09 0.00 0.00 57.88 57.84 1iin h LEU 233 Cb 0.74 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 1iin h LEU 233 CO 0.06 0.59 -0.68 -0.29 0.09 0.00 0.00 178.44 178.21 1iin h ILE 234 N 0.96 1.44 -0.61 1.22 6.09 -1.17 -0.91 117.51 124.53 1iin h ILE 234 Ca 0.27 -2.22 -0.09 0.00 -1.37 0.00 0.00 64.86 61.45 1iin h ILE 234 Cb -0.09 2.18 -0.02 0.00 0.47 0.00 0.00 36.82 39.36 1iin h ILE 234 CO -0.07 0.64 0.04 -0.33 -3.07 0.00 0.00 178.15 175.37 1iin h GLU 235 N 0.09 1.04 -0.35 2.19 5.08 -0.51 0.12 114.58 122.24 1iin h GLU 235 Ca -0.01 -0.30 -0.10 0.00 -1.00 0.00 0.00 59.36 57.94 1iin h GLU 235 Cb 1.21 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.34 1iin h GLU 235 CO 0.10 0.99 -0.17 0.00 -1.00 0.00 0.00 179.01 178.93 1iin h ALA 236 N 1.07 0.49 -0.69 3.43 0.00 -0.57 -1.24 119.26 121.74 1iin h ALA 236 Ca 0.18 -0.35 -0.04 0.00 0.00 0.00 0.00 54.91 54.70 1iin h ALA 236 Cb 0.50 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 1iin h ALA 236 CO 0.02 0.42 0.27 0.77 0.00 0.00 0.00 179.25 180.73 1iin h SER 237 N 0.51 0.95 -0.53 0.00 0.02 -0.93 -1.82 113.55 111.76 1iin h SER 237 Ca 0.08 -0.14 -0.07 0.00 -0.84 0.00 0.00 61.79 60.81 1iin h SER 237 Cb 0.72 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.99 1iin h SER 237 CO 0.05 0.85 0.06 0.78 -1.14 0.00 0.00 176.83 177.44 1iin h ASN 238 N 1.01 0.90 0.15 3.07 2.35 -0.49 -1.42 115.58 121.15 1iin h ASN 238 Ca 0.23 -0.21 -0.01 0.00 -0.55 0.00 0.00 56.30 55.77 1iin h ASN 238 Cb 0.21 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.34 1iin h ASN 238 CO -0.02 0.92 -0.07 0.15 -1.65 0.00 0.00 177.43 176.77 1iin h PHE 239 N 0.88 -0.18 -0.48 1.19 3.57 -0.88 -1.44 116.94 119.60 1iin h PHE 239 Ca 0.18 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.69 1iin h PHE 239 Cb 0.43 0.06 -0.03 0.00 2.79 0.00 0.00 35.95 39.20 1iin h PHE 239 CO 0.03 0.02 0.29 0.82 -2.23 0.00 0.00 178.31 177.24 1iin h ILE 240 N -0.35 1.06 -0.41 1.41 1.08 -1.20 -1.29 117.51 117.80 1iin h ILE 240 Ca -0.02 -0.20 0.00 0.00 -0.39 0.00 0.00 64.86 64.25 1iin h ILE 240 Cb 0.28 0.42 -0.02 0.00 -3.07 0.00 0.00 36.82 34.43 1iin h ILE 240 CO 0.03 0.11 0.26 0.00 -0.69 0.00 0.00 178.15 177.86 1iin h ALA 241 N 1.21 0.52 -0.32 1.87 0.00 -1.19 -0.43 119.26 120.92 1iin h ALA 241 Ca 0.19 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.98 1iin h ALA 241 Cb 0.01 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1iin h ALA 241 CO -0.08 -0.01 -0.10 1.15 0.00 0.00 0.00 179.25 180.21 1iin h THR 242 N 0.54 1.28 -0.11 0.00 2.02 -1.07 -1.14 112.91 114.43 1iin h THR 242 Ca 0.15 -1.17 -0.01 0.00 0.77 0.00 0.00 66.41 66.15 1iin h THR 242 Cb -0.03 1.38 -0.01 0.00 -1.74 0.00 0.00 68.15 67.76 1iin h THR 242 CO -0.03 0.38 0.05 0.40 0.37 0.00 0.00 175.52 176.68 1iin h ILE 243 N 0.40 1.14 -0.42 3.11 5.03 -1.17 0.08 117.51 125.68 1iin h ILE 243 Ca 0.08 -0.43 0.02 0.00 -0.12 0.00 0.00 64.86 64.41 1iin h ILE 243 Cb 0.61 1.22 -0.03 0.00 -3.03 0.00 0.00 36.82 35.59 1iin h ILE 243 CO 0.04 0.13 0.24 -0.33 -0.68 0.00 0.00 178.15 177.54 1iin h GLU 244 N 0.03 0.47 -0.14 2.37 5.08 -1.06 0.11 114.58 121.45 1iin h GLU 244 Ca 0.04 -0.03 -0.10 0.00 -1.00 0.00 0.00 59.36 58.27 1iin h GLU 244 Cb 0.16 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.31 1iin h GLU 244 CO -0.00 0.31 -0.30 0.93 -1.00 0.00 0.00 179.01 178.94 1iin h GLU 245 N 0.48 0.45 -0.05 2.33 4.39 -1.15 -1.73 114.58 119.30 1iin h GLU 245 Ca 0.17 -0.30 -0.17 0.00 0.34 0.00 0.00 59.36 59.41 1iin h GLU 245 Cb 0.03 0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.71 1iin h GLU 245 CO -0.09 0.91 -0.70 0.00 -1.16 0.00 0.00 179.01 177.97 1iin h ARG 246 N 0.05 0.24 -0.23 2.33 2.47 -0.94 -3.28 114.38 115.02 1iin h ARG 246 Ca 0.00 -0.20 0.00 0.00 -1.26 0.00 0.00 59.98 58.52 1iin h ARG 246 Cb 0.90 0.04 0.00 0.00 -1.65 0.00 0.00 29.97 29.26 1iin h ARG 246 CO 0.07 0.85 0.00 1.04 0.56 0.00 0.00 179.97 182.48 1iin n GLN 247 N -3.80 2.38 -3.46 0.04 6.02 0.39 -5.00 117.38 113.94 1iin n GLN 247 Ca -0.03 -2.11 -0.18 0.00 -0.01 0.00 0.00 57.00 54.67 1iin n GLN 247 Cb 0.68 -1.48 0.08 0.00 1.02 0.00 0.00 30.24 30.54 1iin n GLN 247 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1iin n GLY 248 N 1.40 -0.45 3.58 1.08 0.00 -0.68 -5.01 105.19 105.12 1iin n GLY 248 Ca 0.17 0.17 -0.13 0.00 0.00 0.00 0.00 46.02 46.22 1iin n GLY 248 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1iin s LEU 249 N -6.31 0.76 -0.03 0.99 0.05 -1.05 -5.07 118.68 108.02 1iin s LEU 249 Ca 0.06 -1.43 0.06 0.00 0.05 0.00 0.00 54.13 52.87 1iin s LEU 249 Cb -0.01 1.87 -0.01 0.00 -2.05 0.00 0.00 46.19 45.99 1iin s LEU 249 CO 0.75 -1.43 -0.22 -0.54 -0.55 0.00 0.00 176.35 174.35 1iin s LYS 250 N -2.74 1.97 -0.20 1.48 -0.14 -1.26 -4.40 119.74 114.44 1iin s LYS 250 Ca 0.26 -0.79 -0.13 0.00 -1.36 0.00 0.00 55.97 53.95 1iin s LYS 250 Cb -0.02 -1.81 -0.05 0.00 -1.68 0.00 0.00 37.83 34.27 1iin s LYS 250 CO 0.19 0.42 0.27 0.08 -0.76 0.00 0.00 175.35 175.55 1iin s VAL 251 N -0.36 5.30 -1.23 3.17 1.01 -1.26 -4.45 120.40 122.57 1iin s VAL 251 Ca 0.04 0.46 -0.06 0.00 0.00 0.00 0.00 61.98 62.41 1iin s VAL 251 Cb -0.10 -3.61 -0.01 0.00 0.00 0.00 0.00 36.38 32.66 1iin s VAL 251 CO 0.01 0.34 0.74 -1.20 0.00 0.00 0.00 175.10 174.98 1iin n SER 252 N 4.07 -2.99 -4.37 3.32 7.64 -1.26 -4.95 113.62 115.07 1iin n SER 252 Ca -0.12 -0.87 -0.44 0.00 1.01 0.00 0.00 58.87 58.45 1iin n SER 252 Cb 0.52 -3.98 -0.08 0.00 -1.01 0.00 0.00 64.21 59.66 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 8.73 0.64 -0.71 0.00 0.13 -1.92 -1.37 132.00 137.50 1iin h PRO 254 Ca -0.28 -0.04 -0.06 0.00 -0.87 0.00 0.00 66.00 64.75 1iin h PRO 254 Cb 1.11 -0.14 -0.03 0.00 0.13 0.00 0.00 31.00 32.06 1iin h PRO 254 CO 0.88 0.42 0.22 0.93 -0.23 0.00 0.00 178.00 180.22 1iin h GLU 255 N 0.66 1.11 -0.27 0.86 3.07 -1.97 0.49 114.58 118.53 1iin h GLU 255 Ca 0.43 -0.24 -0.06 0.00 -0.50 0.00 0.00 59.36 58.99 1iin h GLU 255 Cb 0.72 -0.16 -0.01 0.00 -0.84 0.00 0.00 28.75 28.46 1iin h GLU 255 CO -0.19 0.95 -0.05 1.49 -1.40 0.00 0.00 179.01 179.81 1iin h GLU 256 N 1.05 0.52 -0.43 2.33 4.81 -1.78 -1.43 114.58 119.65 1iin h GLU 256 Ca 0.23 -0.19 -0.03 0.00 -0.13 0.00 0.00 59.36 59.24 1iin h GLU 256 Cb 0.31 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.64 1iin h GLU 256 CO -0.01 0.72 0.15 0.82 -0.73 0.00 0.00 179.01 179.96 1iin h ILE 257 N 0.27 1.21 -0.89 2.32 2.04 -1.12 0.27 117.51 121.61 1iin h ILE 257 Ca 0.07 -0.67 0.02 0.00 1.00 0.00 0.00 64.86 65.27 1iin h ILE 257 Cb 0.52 0.84 -0.05 0.00 -0.74 0.00 0.00 36.82 37.40 1iin h ILE 257 CO 0.02 0.24 0.59 0.00 0.00 0.00 0.00 178.15 179.01 1iin h ALA 258 N 1.00 1.14 -0.05 1.87 0.00 -0.87 -0.53 119.26 121.83 1iin h ALA 258 Ca 0.14 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1iin h ALA 258 Cb 0.23 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 1iin h ALA 258 CO -0.01 0.50 -0.03 0.35 0.00 0.00 0.00 179.25 180.06 1iin h PHE 259 N 1.18 0.13 -0.11 0.00 3.57 -0.89 0.37 116.94 121.19 1iin h PHE 259 Ca 0.34 -0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.77 1iin h PHE 259 Cb -0.10 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 38.60 1iin h PHE 259 CO -0.01 0.51 -0.05 0.00 -2.23 0.00 0.00 178.31 176.53 1iin h ARG 260 N -0.29 0.15 -0.62 1.11 2.47 -0.67 -0.88 114.38 115.65 1iin h ARG 260 Ca 0.01 -0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.71 1iin h ARG 260 Cb 0.48 -0.03 0.00 0.00 -1.65 0.00 0.00 29.97 28.78 1iin h ARG 260 CO 0.01 0.22 0.00 1.63 0.56 0.00 0.00 179.97 182.39 1iin n LYS 261 N -4.39 3.12 -2.34 0.04 5.02 -0.23 -4.94 118.16 114.44 1iin n LYS 261 Ca -0.01 -2.19 -0.18 0.00 -2.02 0.00 0.00 58.31 53.90 1iin n LYS 261 Cb 0.18 -1.76 -0.01 0.00 -0.02 0.00 0.00 35.03 33.42 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 0.81 -5.29 0.09 4.39 3.02 -0.34 -4.87 115.26 113.08 1iin n ASN 262 Ca 0.20 0.08 -0.06 0.00 -0.03 0.00 0.00 54.58 54.77 1iin n ASN 262 Cb 0.72 -4.44 0.08 0.00 -0.61 0.00 0.00 39.78 35.52 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 0.00 0.23 -3.97 3.10 0.05 -0.49 -3.46 116.94 112.40 1iin h PHE 263 Ca -0.43 -0.10 -0.23 0.00 3.82 0.00 0.00 57.97 61.02 1iin h PHE 263 Cb 1.31 -0.04 -0.15 0.00 2.00 0.00 0.00 35.95 39.08 1iin h PHE 263 CO 0.60 0.82 -0.67 0.96 -0.18 0.00 0.00 178.31 179.84 1iin s ILE 264 N -3.52 0.51 0.53 -0.55 -4.36 -1.04 -4.45 121.20 108.33 1iin s ILE 264 Ca -0.03 -1.94 0.08 0.00 -0.26 0.00 0.00 60.65 58.51 1iin s ILE 264 Cb 0.11 -1.93 0.05 0.00 1.25 0.00 0.00 42.46 41.95 1iin s ILE 264 CO 0.80 -0.63 0.63 0.54 0.24 0.00 0.00 174.94 176.52 1iin s ASN 265 N -3.09 5.06 0.39 4.36 6.03 -1.26 -4.47 114.94 121.96 1iin s ASN 265 Ca 0.19 -0.87 0.07 0.00 -1.03 0.00 0.00 52.86 51.22 1iin s ASN 265 Cb 0.06 0.10 0.78 0.00 -3.03 0.00 0.00 41.25 39.17 1iin s ASN 265 CO -0.00 -1.13 1.98 0.00 -2.03 0.00 0.00 177.10 175.91 1iin h ALA 266 N 0.46 1.58 -0.42 3.54 0.00 -1.99 -1.70 119.26 120.73 1iin h ALA 266 Ca -0.34 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.39 1iin h ALA 266 Cb 1.29 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.92 1iin h ALA 266 CO 0.47 0.33 -0.00 1.96 0.00 0.00 0.00 179.25 182.01 1iin h GLN 267 N 0.47 0.75 -0.54 0.00 7.50 -2.00 -2.06 115.11 119.23 1iin h GLN 267 Ca 0.11 -0.24 -0.07 0.00 0.50 0.00 0.00 58.65 58.96 1iin h GLN 267 Cb 0.13 -0.07 -0.02 0.00 0.05 0.00 0.00 27.48 27.57 1iin h GLN 267 CO -0.01 0.82 0.06 1.96 -1.50 0.00 0.00 178.83 180.17 1iin h GLN 268 N 0.59 0.87 -0.32 1.46 4.20 -1.84 -2.02 115.11 118.05 1iin h GLN 268 Ca 0.12 -0.22 0.01 0.00 0.06 0.00 0.00 58.65 58.62 1iin h GLN 268 Cb 0.49 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 28.14 1iin h GLN 268 CO 0.02 0.83 0.20 0.28 -0.67 0.00 0.00 178.83 179.49 1iin h VAL 269 N 0.83 1.06 -0.89 -0.54 2.07 -1.04 -0.76 116.25 116.97 1iin h VAL 269 Ca 0.17 -0.14 -0.01 0.00 0.82 0.00 0.00 66.70 67.53 1iin h VAL 269 Cb 0.40 0.62 -0.04 0.00 -1.52 0.00 0.00 31.29 30.75 1iin h VAL 269 CO 0.01 0.07 0.50 0.40 0.02 0.00 0.00 177.57 178.58 1iin h ILE 270 N 0.41 1.25 -0.68 4.57 2.04 -1.16 0.26 117.51 124.21 1iin h ILE 270 Ca 0.12 -0.60 -0.03 0.00 1.00 0.00 0.00 64.86 65.35 1iin h ILE 270 Cb -0.03 0.04 -0.03 0.00 -0.74 0.00 0.00 36.82 36.06 1iin h ILE 270 CO -0.04 0.28 0.32 -0.08 0.00 0.00 0.00 178.15 178.63 1iin h GLU 271 N 1.23 0.98 -0.05 2.37 4.81 -1.02 -1.72 114.58 121.19 1iin h GLU 271 Ca 0.31 -0.15 -0.13 0.00 -0.13 0.00 0.00 59.36 59.27 1iin h GLU 271 Cb 0.00 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.19 1iin h GLU 271 CO -0.05 0.78 -0.57 -0.07 -0.73 0.00 0.00 179.01 178.37 1iin h LEU 272 N 0.95 0.17 -0.87 1.64 3.38 -0.46 -3.17 115.31 116.95 1iin h LEU 272 Ca 0.23 -0.09 -0.06 0.00 0.09 0.00 0.00 57.88 58.05 1iin h LEU 272 Cb 0.12 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 1iin h LEU 272 CO -0.03 0.70 -0.27 0.00 0.09 0.00 0.00 178.44 178.93 1iin h ALA 273 N 1.30 0.96 -0.09 1.53 0.00 0.15 -3.35 119.26 119.75 1iin h ALA 273 Ca -0.00 -0.25 0.03 0.00 0.00 0.00 0.00 54.91 54.69 1iin h ALA 273 Cb 1.04 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.72 1iin h ALA 273 CO 0.08 0.34 -0.52 0.78 0.00 0.00 0.00 179.25 179.93 1iin h GLY 274 N 2.39 -1.03 2.00 0.00 0.00 -1.30 0.11 103.07 105.24 1iin h GLY 274 Ca -0.00 0.64 -0.00 0.00 0.00 0.00 0.00 47.33 47.97 1iin h GLY 274 CO 0.04 -0.21 -0.01 -2.55 0.00 0.00 0.00 176.54 173.80 1iin h PRO 275 N -0.60 0.00 -0.17 4.80 0.11 -1.78 -2.30 132.00 132.06 1iin h PRO 275 Ca 0.03 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.14 1iin h PRO 275 Cb 0.69 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.80 1iin h PRO 275 CO -0.40 0.01 0.00 1.28 -0.21 0.00 0.00 178.00 178.67 1iin n LEU 276 N -3.19 3.11 0.00 2.35 4.77 -0.53 -4.63 117.00 118.88 1iin n LEU 276 Ca -0.02 -1.20 0.06 0.00 -0.03 0.00 0.00 56.01 54.81 1iin n LEU 276 Cb 0.11 -0.10 0.36 0.00 -2.33 0.00 0.00 43.42 41.46 1iin n LEU 276 CO 0.22 0.59 0.71 -1.54 -1.33 0.00 0.00 177.39 176.04 1iin n SER 277 N 1.35 0.00 -0.00 -1.43 3.41 0.27 -1.80 113.62 115.41 1iin n SER 277 Ca 0.15 -1.55 0.14 0.00 -0.26 0.00 0.00 58.87 57.36 1iin n SER 277 Cb 0.58 0.00 0.59 0.00 -0.26 0.00 0.00 64.21 65.12 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 -0.70 0.06 -4.01 4.33 5.02 -1.26 -4.63 118.16 116.98 1iin n LYS 278 Ca 0.09 -0.01 -0.19 0.00 -2.02 0.00 0.00 58.31 56.18 1iin n LYS 278 Cb 0.04 -1.50 -0.07 0.00 -0.02 0.00 0.00 35.03 33.49 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 -1.46 0.03 0.20 4.39 0.23 -1.21 -5.05 115.26 112.39 1iin n ASN 279 Ca 0.08 -2.92 0.14 0.00 -0.53 0.00 0.00 54.58 51.35 1iin n ASN 279 Cb 0.33 1.27 0.62 0.00 -2.08 0.00 0.00 39.78 39.92 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 1.66 0.00 0.04 0.53 1.82 -1.90 -2.36 116.42 116.21 1iin h ASP 280 Ca -0.23 0.00 -0.00 0.00 -0.39 0.00 0.00 57.03 56.41 1iin h ASP 280 Cb 1.06 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.07 1iin h ASP 280 CO 0.35 0.00 -0.02 0.22 -1.61 0.00 0.00 179.24 178.18 1iin h TYR 281 N 0.00 -0.05 -0.22 0.28 3.20 -1.95 -0.47 116.97 117.76 1iin h TYR 281 Ca 0.00 -0.00 -0.14 0.00 3.14 0.00 0.00 58.73 61.73 1iin h TYR 281 Cb 0.34 0.02 0.00 0.00 1.54 0.00 0.00 36.73 38.63 1iin h TYR 281 CO 0.00 0.11 -0.41 0.78 -1.64 0.00 0.00 178.16 177.00 1iin h GLY 282 N -0.20 0.73 1.57 1.82 0.00 -1.16 -3.12 103.07 102.69 1iin h GLY 282 Ca -0.01 -0.85 -0.03 0.00 0.00 0.00 0.00 47.33 46.44 1iin h GLY 282 CO 0.01 0.76 0.11 0.50 0.00 0.00 0.00 176.54 177.93 1iin h LYS 283 N 0.36 0.56 -0.48 4.80 1.57 -1.42 -1.80 116.57 120.16 1iin h LYS 283 Ca 0.01 -0.08 -0.01 0.00 -1.87 0.00 0.00 60.65 58.70 1iin h LYS 283 Cb 1.01 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 33.20 1iin h LYS 283 CO 0.09 0.50 0.27 -0.92 -0.57 0.00 0.00 179.45 178.81 1iin h TYR 284 N 0.55 0.66 -0.72 -1.35 3.20 -1.08 -1.11 116.97 117.11 1iin h TYR 284 Ca 0.13 -0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.95 1iin h TYR 284 Cb 0.18 -0.21 -0.03 0.00 1.54 0.00 0.00 36.73 38.21 1iin h TYR 284 CO 0.01 0.49 0.30 -0.07 -1.64 0.00 0.00 178.16 177.25 1iin h LEU 285 N 0.64 0.99 -0.66 2.82 3.38 -1.30 0.33 115.31 121.50 1iin h LEU 285 Ca 0.17 -0.16 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 1iin h LEU 285 Cb 0.05 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.52 1iin h LEU 285 CO -0.03 0.88 0.21 -0.07 0.09 0.00 0.00 178.44 179.52 1iin h LEU 286 N 1.03 0.96 -0.62 1.67 3.38 -1.17 -2.38 115.31 118.18 1iin h LEU 286 Ca 0.24 -0.21 -0.12 0.00 0.09 0.00 0.00 57.88 57.89 1iin h LEU 286 Cb 0.19 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 1iin h LEU 286 CO -0.02 0.91 -0.20 0.50 0.09 0.00 0.00 178.44 179.72 1iin h LYS 287 N 0.96 0.89 -0.81 1.13 3.64 -0.69 -3.09 116.57 118.59 1iin h LYS 287 Ca 0.21 -0.36 0.13 0.00 -1.27 0.00 0.00 60.65 59.36 1iin h LYS 287 Cb 0.29 -0.04 -0.09 0.00 -0.41 0.00 0.00 32.23 31.98 1iin h LYS 287 CO -0.01 1.00 0.42 1.98 -2.27 0.00 0.00 179.45 180.57 1iin h MET 288 N 0.77 0.62 -0.02 1.90 4.05 0.14 -3.51 114.93 118.88 1iin h MET 288 Ca 0.11 -0.04 0.00 0.00 -0.28 0.00 0.00 59.70 59.49 1iin h MET 288 Cb 0.74 -0.14 0.00 0.00 -0.80 0.00 0.00 31.60 31.40 1iin h MET 288 CO 0.06 0.41 0.00 1.33 0.23 0.00 0.00 176.91 178.94