#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iim s LYS 2 N 0.00 4.09 -0.22 2.12 1.02 -1.26 -4.76 119.74 120.73 1iim s LYS 2 Ca 0.00 1.35 -0.29 0.00 0.02 0.00 0.00 55.97 57.05 1iim s LYS 2 Cb 0.00 -2.33 -0.02 0.00 -0.52 0.00 0.00 37.83 34.97 1iim s LYS 2 CO 0.00 -0.18 1.42 0.99 -0.92 0.00 0.00 175.35 176.66 1iim s THR 3 N -1.88 3.99 -0.10 2.17 2.01 -0.17 -4.84 115.64 116.82 1iim s THR 3 Ca 0.61 1.15 0.01 0.00 0.31 0.00 0.00 61.69 63.77 1iim s THR 3 Cb -0.17 -3.92 0.03 0.00 0.01 0.00 0.00 72.50 68.44 1iim s THR 3 CO 0.21 -0.30 0.94 0.54 -0.69 0.00 0.00 174.62 175.31 1iim n ARG 4 N 7.23 2.30 -4.45 4.92 5.12 -1.26 -4.69 116.66 125.83 1iim n ARG 4 Ca 0.16 -1.37 -0.22 0.00 -1.93 0.00 0.00 57.85 54.49 1iim n ARG 4 Cb 0.45 -1.02 -0.14 0.00 -1.16 0.00 0.00 32.46 30.59 1iim n ARG 4 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 1iim s LYS 5 N -0.84 1.06 0.04 5.56 1.02 -1.26 -3.79 119.74 121.54 1iim s LYS 5 Ca 0.02 -0.78 -0.04 0.00 0.02 0.00 0.00 55.97 55.19 1iim s LYS 5 Cb 0.01 -1.09 -0.02 0.00 -0.52 0.00 0.00 37.83 36.21 1iim s LYS 5 CO 0.01 0.28 0.05 0.20 -0.92 0.00 0.00 175.35 174.97 1iim s GLY 6 N -1.08 0.26 -0.04 -3.33 0.00 -0.53 -0.93 107.32 101.68 1iim s GLY 6 Ca 0.03 -0.75 0.03 0.00 0.00 0.00 0.00 44.72 44.03 1iim s GLY 6 CO 0.01 -0.87 -0.12 -0.42 0.00 0.00 0.00 173.10 171.70 1iim s ILE 7 N -2.89 1.04 -0.24 0.90 1.01 -0.05 -0.42 121.20 120.54 1iim s ILE 7 Ca -0.03 -0.49 -0.04 0.00 0.00 0.00 0.00 60.65 60.10 1iim s ILE 7 Cb 0.01 -0.92 0.00 0.00 0.01 0.00 0.00 42.46 41.56 1iim s ILE 7 CO -0.06 0.32 -0.02 -0.63 0.00 0.00 0.00 174.94 174.55 1iim s ILE 8 N 0.24 3.42 -0.73 2.92 1.01 -0.10 -1.37 121.20 126.60 1iim s ILE 8 Ca -0.05 -0.63 -0.24 0.00 0.00 0.00 0.00 60.65 59.73 1iim s ILE 8 Cb -0.11 -2.64 0.06 0.00 0.01 0.00 0.00 42.46 39.78 1iim s ILE 8 CO 0.02 0.31 1.12 -0.76 0.00 0.00 0.00 174.94 175.63 1iim s LEU 9 N 1.46 3.90 -0.36 2.97 1.43 -0.81 -1.61 118.68 125.66 1iim s LEU 9 Ca 0.04 -0.87 0.06 0.00 -1.03 0.00 0.00 54.13 52.33 1iim s LEU 9 Cb -0.15 -2.48 0.46 0.00 0.03 0.00 0.00 46.19 44.05 1iim s LEU 9 CO -0.02 -1.58 1.39 0.00 0.23 0.00 0.00 176.35 176.37 1iim n ALA 10 N 8.36 5.08 -2.75 4.21 0.00 0.14 -0.50 120.51 135.04 1iim n ALA 10 Ca 0.03 -3.61 0.00 0.00 0.00 0.00 0.00 53.44 49.86 1iim n ALA 10 Cb 0.47 -0.65 0.00 0.00 0.00 0.00 0.00 19.45 19.27 1iim n ALA 10 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1iim n GLY 11 N -0.84 1.49 1.64 0.00 0.00 -1.19 -4.51 105.19 101.79 1iim n GLY 11 Ca 0.44 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.46 1iim n GLY 11 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1iim n GLY 12 N 5.00 -2.66 0.24 -0.02 0.00 -1.26 -4.85 105.19 101.64 1iim n GLY 12 Ca 0.00 -1.74 -0.22 0.00 0.00 0.00 0.00 46.02 44.06 1iim n GLY 12 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1iim n SER 13 N -0.13 1.81 -0.94 1.61 2.88 -1.26 -4.90 113.62 112.69 1iim n SER 13 Ca 0.00 0.18 -0.08 0.00 -1.33 0.00 0.00 58.87 57.64 1iim n SER 13 Cb 0.00 -0.59 -0.00 0.00 -0.75 0.00 0.00 64.21 62.87 1iim n SER 13 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1iim n GLY 14 N 1.80 0.10 0.36 0.46 0.00 -1.26 -4.94 105.19 101.71 1iim n GLY 14 Ca -0.43 -0.55 0.07 0.00 0.00 0.00 0.00 46.02 45.10 1iim n GLY 14 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1iim h THR 15 N -0.11 1.00 0.00 2.61 1.35 -1.95 -0.69 112.91 115.12 1iim h THR 15 Ca -0.18 -0.28 0.00 0.00 -0.55 0.00 0.00 66.41 65.40 1iim h THR 15 Cb 1.13 0.10 0.00 0.00 -1.73 0.00 0.00 68.15 67.65 1iim h THR 15 CO 0.21 0.15 0.00 0.54 -0.25 0.00 0.00 175.52 176.17 1iim n ARG 16 N -4.50 0.15 -0.13 4.72 1.74 -1.26 -2.06 116.66 115.32 1iim n ARG 16 Ca 0.13 0.52 0.06 0.00 -0.77 0.00 0.00 57.85 57.79 1iim n ARG 16 Cb 0.26 -1.87 0.13 0.00 -1.02 0.00 0.00 32.46 29.96 1iim n ARG 16 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1iim n LEU 17 N -2.17 2.70 -4.76 0.55 4.77 -0.27 -4.65 117.00 113.17 1iim n LEU 17 Ca 0.00 -1.67 -0.39 0.00 -0.03 0.00 0.00 56.01 53.92 1iim n LEU 17 Cb 0.12 -0.17 0.02 0.00 -2.33 0.00 0.00 43.42 41.06 1iim n LEU 17 CO 0.13 0.63 1.05 -0.31 -1.33 0.00 0.00 177.39 177.57 1iim s TYR 18 N -1.01 2.39 -2.25 -1.77 2.02 -0.87 -0.42 117.35 115.44 1iim s TYR 18 Ca 0.22 1.28 0.21 0.00 -0.37 0.00 0.00 57.07 58.41 1iim s TYR 18 Cb 0.12 -3.91 0.79 0.00 -0.40 0.00 0.00 41.96 38.57 1iim s TYR 18 CO 0.17 -2.98 1.57 -0.35 -1.57 0.00 0.00 175.55 172.38 1iim n PRO 19 N -0.43 1.65 -0.13 -1.71 -0.04 -1.26 -4.88 135.00 128.20 1iim n PRO 19 Ca 0.07 -0.98 -0.04 0.00 -0.04 0.00 0.00 63.50 62.51 1iim n PRO 19 Cb 0.42 -1.39 0.04 0.00 -0.04 0.00 0.00 33.50 32.54 1iim n PRO 19 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1iim h VAL 20 N 1.99 0.71 -0.22 0.52 2.07 -1.13 -1.09 116.25 119.11 1iim h VAL 20 Ca 0.00 -0.05 0.00 0.00 0.82 0.00 0.00 66.70 67.47 1iim h VAL 20 Cb 0.44 0.54 0.00 0.00 -1.52 0.00 0.00 31.29 30.74 1iim h VAL 20 CO 0.00 0.03 0.00 0.35 0.02 0.00 0.00 177.57 177.97 1iim n THR 21 N -5.16 0.60 0.04 2.57 -2.24 -1.06 -3.46 114.28 105.57 1iim n THR 21 Ca 0.04 -0.39 -0.20 0.00 -2.27 0.00 0.00 64.05 61.23 1iim n THR 21 Cb 0.22 -0.12 -0.12 0.00 -2.10 0.00 0.00 70.33 68.22 1iim n THR 21 CO 0.00 0.00 0.00 0.24 -0.57 0.00 0.00 175.07 174.74 1iim h MET 22 N 1.36 0.54 -0.11 -0.78 2.86 -1.49 -3.37 114.93 113.94 1iim h MET 22 Ca 0.00 -0.65 0.00 0.00 -2.06 0.00 0.00 59.70 56.99 1iim h MET 22 Cb 0.64 0.20 0.00 0.00 0.06 0.00 0.00 31.60 32.50 1iim h MET 22 CO 0.08 1.26 0.00 0.00 1.06 0.00 0.00 176.91 179.31 1iim n ALA 23 N -2.64 2.24 -3.66 6.32 0.00 -1.25 -4.98 120.51 116.54 1iim n ALA 23 Ca -0.12 -1.61 -0.07 0.00 0.00 0.00 0.00 53.44 51.64 1iim n ALA 23 Cb 0.84 -0.28 -0.09 0.00 0.00 0.00 0.00 19.45 19.92 1iim n ALA 23 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1iim s VAL 24 N -1.71 -0.48 0.36 0.00 1.01 -1.22 -5.14 120.40 113.22 1iim s VAL 24 Ca 0.19 0.10 -0.28 0.00 0.00 0.00 0.00 61.98 61.98 1iim s VAL 24 Cb 0.14 -0.75 -0.11 0.00 0.00 0.00 0.00 36.38 35.65 1iim s VAL 24 CO 0.05 0.04 1.46 -0.24 0.00 0.00 0.00 175.10 176.41 1iim n SER 25 N 4.99 3.59 -0.35 3.32 2.88 -1.26 -4.08 113.62 122.71 1iim n SER 25 Ca -0.14 1.22 0.14 0.00 -1.33 0.00 0.00 58.87 58.75 1iim n SER 25 Cb 0.52 -1.59 0.34 0.00 -0.75 0.00 0.00 64.21 62.73 1iim n SER 25 CO 0.00 0.00 0.00 -0.61 -1.23 0.00 0.00 175.04 173.20 1iim h GLN 26 N 3.07 0.71 0.00 -1.46 4.15 -1.89 0.10 115.11 119.79 1iim h GLN 26 Ca -0.49 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 58.88 1iim h GLN 26 Cb 1.25 -0.16 0.00 0.00 0.21 0.00 0.00 27.48 28.78 1iim h GLN 26 CO 0.65 0.47 0.00 1.04 -1.93 0.00 0.00 178.83 179.07 1iim n GLN 27 N -4.74 0.14 0.00 1.69 3.00 -1.26 -1.98 117.38 114.22 1iim n GLN 27 Ca 0.23 0.15 0.09 0.00 -0.01 0.00 0.00 57.00 57.46 1iim n GLN 27 Cb 0.59 -1.50 -0.07 0.00 0.00 0.00 0.00 30.24 29.26 1iim n GLN 27 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 1iim n LEU 28 N -1.39 1.25 -4.76 1.08 4.77 0.33 -0.70 117.00 117.58 1iim n LEU 28 Ca 0.07 -0.60 -0.38 0.00 -0.03 0.00 0.00 56.01 55.06 1iim n LEU 28 Cb 0.18 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.27 1iim n LEU 28 CO 0.15 0.27 0.93 -0.76 -1.33 0.00 0.00 177.39 176.65 1iim s LEU 29 N -2.64 4.05 0.35 2.23 1.43 -0.84 -4.39 118.68 118.88 1iim s LEU 29 Ca 0.11 2.58 -0.25 0.00 -1.03 0.00 0.00 54.13 55.53 1iim s LEU 29 Cb 0.15 -4.11 -0.10 0.00 0.03 0.00 0.00 46.19 42.16 1iim s LEU 29 CO 0.66 -1.07 0.98 -2.16 0.23 0.00 0.00 176.35 174.99 1iim s PRO 30 N -2.57 4.44 -0.50 1.29 0.04 -1.26 0.36 135.00 136.80 1iim s PRO 30 Ca 0.63 1.39 0.04 0.00 0.04 0.00 0.00 61.00 63.10 1iim s PRO 30 Cb -0.36 -2.69 0.13 0.00 0.04 0.00 0.00 34.50 31.62 1iim s PRO 30 CO 0.44 0.13 0.24 0.42 0.04 0.00 0.00 177.00 178.27 1iim s ILE 31 N -1.65 2.48 0.00 0.56 -1.09 -0.59 -4.83 121.20 116.09 1iim s ILE 31 Ca 0.53 -3.18 0.00 0.00 -2.23 0.00 0.00 60.65 55.77 1iim s ILE 31 Cb -0.19 -2.74 0.00 0.00 -1.58 0.00 0.00 42.46 37.95 1iim s ILE 31 CO 0.25 -0.78 0.00 0.00 -1.23 0.00 0.00 174.94 173.17 1iim n TYR 32 N 3.25 0.00 -0.37 3.97 9.36 -1.26 -3.54 117.16 128.56 1iim n TYR 32 Ca 0.05 0.00 0.03 0.00 3.32 0.00 0.00 57.90 61.30 1iim n TYR 32 Cb 0.33 0.00 0.05 0.00 -0.63 0.00 0.00 39.34 39.09 1iim n TYR 32 CO 0.00 0.00 0.00 -0.40 0.22 0.00 0.00 176.86 176.68 1iim n ASP 33 N 3.42 2.12 -3.48 2.98 5.75 -1.26 -5.06 116.55 121.02 1iim n ASP 33 Ca 0.00 -2.37 -0.14 0.00 -0.01 0.00 0.00 54.79 52.27 1iim n ASP 33 Cb 0.00 -0.15 -0.04 0.00 -1.03 0.00 0.00 41.12 39.90 1iim n ASP 33 CO 0.00 0.00 0.00 -1.59 -0.11 0.00 0.00 177.20 175.50 1iim s LYS 34 N -1.64 1.11 0.50 0.11 -2.85 -1.23 -5.11 119.74 110.63 1iim s LYS 34 Ca 0.11 -0.11 -0.23 0.00 -1.00 0.00 0.00 55.97 54.73 1iim s LYS 34 Cb 0.10 0.52 -0.07 0.00 -2.06 0.00 0.00 37.83 36.32 1iim s LYS 34 CO 0.01 -0.43 1.39 -0.35 0.10 0.00 0.00 175.35 176.08 1iim n PRO 35 N 0.24 1.95 -0.28 1.78 -0.04 -1.26 -1.54 135.00 135.85 1iim n PRO 35 Ca -0.17 0.70 0.09 0.00 -0.04 0.00 0.00 63.50 64.09 1iim n PRO 35 Cb 0.61 -2.60 0.24 0.00 -0.04 0.00 0.00 33.50 31.71 1iim n PRO 35 CO 0.00 0.00 0.00 1.98 -0.04 0.00 0.00 175.50 177.44 1iim h MET 36 N 1.82 0.26 0.00 0.54 1.85 -0.06 -1.11 114.93 118.23 1iim h MET 36 Ca -0.51 -0.02 0.00 0.00 -0.61 0.00 0.00 59.70 58.57 1iim h MET 36 Cb 1.29 -0.06 0.00 0.00 0.43 0.00 0.00 31.60 33.26 1iim h MET 36 CO 0.59 0.17 0.00 0.97 -0.40 0.00 0.00 176.91 178.24 1iim h ILE 37 N 0.26 0.00 0.00 1.77 2.10 -1.11 -2.07 117.51 118.47 1iim h ILE 37 Ca 0.49 -0.04 -0.03 0.00 1.08 0.00 0.00 64.86 66.36 1iim h ILE 37 Cb 0.91 0.73 -0.00 0.00 -1.09 0.00 0.00 36.82 37.36 1iim h ILE 37 CO -0.57 0.00 -0.15 1.88 -1.08 0.00 0.00 178.15 178.23 1iim h TYR 38 N 0.00 0.00 0.41 2.19 -1.99 -1.49 -2.64 116.97 113.44 1iim h TYR 38 Ca 0.00 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.71 1iim h TYR 38 Cb 0.05 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.78 1iim h TYR 38 CO 0.00 0.15 -0.20 1.88 -0.00 0.00 0.00 178.16 180.00 1iim h TYR 39 N 0.00 -0.51 -0.17 4.88 -1.99 -1.55 -1.63 116.97 116.00 1iim h TYR 39 Ca -0.00 -0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.72 1iim h TYR 39 Cb 0.30 0.17 -0.01 0.00 2.00 0.00 0.00 36.73 39.19 1iim h TYR 39 CO 0.00 -0.27 0.11 -1.00 -0.00 0.00 0.00 178.16 177.01 1iim h PRO 40 N -1.11 0.23 -0.35 4.88 0.13 -1.66 -1.07 132.00 133.05 1iim h PRO 40 Ca -0.06 -0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 65.05 1iim h PRO 40 Cb 0.47 -0.05 -0.02 0.00 0.13 0.00 0.00 31.00 31.53 1iim h PRO 40 CO 0.09 0.15 0.18 1.25 -0.23 0.00 0.00 178.00 179.44 1iim h LEU 41 N 0.23 0.45 -0.95 1.56 6.46 -1.50 -2.17 115.31 119.39 1iim h LEU 41 Ca 0.06 -0.11 -0.02 0.00 -0.12 0.00 0.00 57.88 57.69 1iim h LEU 41 Cb -0.02 -0.11 -0.04 0.00 -0.73 0.00 0.00 40.66 39.75 1iim h LEU 41 CO -0.01 0.43 0.44 0.28 -0.62 0.00 0.00 178.44 178.95 1iim h SER 42 N 0.43 1.06 -0.45 1.25 0.02 -0.43 -1.54 113.55 113.90 1iim h SER 42 Ca 0.12 -0.10 0.02 0.00 -0.84 0.00 0.00 61.79 60.98 1iim h SER 42 Cb 0.09 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.33 1iim h SER 42 CO -0.02 0.87 0.27 0.74 -1.14 0.00 0.00 176.83 177.56 1iim h THR 43 N 1.18 1.06 -0.10 -2.27 2.02 -0.72 0.13 112.91 114.21 1iim h THR 43 Ca 0.29 -0.19 -0.01 0.00 0.77 0.00 0.00 66.41 67.28 1iim h THR 43 Cb 0.06 0.46 -0.00 0.00 -1.74 0.00 0.00 68.15 66.93 1iim h THR 43 CO -0.04 0.10 0.04 -0.07 0.37 0.00 0.00 175.52 175.91 1iim h LEU 44 N 0.55 0.14 -0.84 2.58 3.38 -1.13 -2.73 115.31 117.26 1iim h LEU 44 Ca 0.18 -0.18 0.13 0.00 0.09 0.00 0.00 57.88 58.09 1iim h LEU 44 Cb -0.01 -0.04 -0.09 0.00 0.09 0.00 0.00 40.66 40.62 1iim h LEU 44 CO -0.07 0.28 0.44 0.24 0.09 0.00 0.00 178.44 179.43 1iim h MET 45 N -0.01 0.65 0.00 1.13 2.86 -0.85 0.15 114.93 118.86 1iim h MET 45 Ca 0.03 -0.04 -0.00 0.00 -2.06 0.00 0.00 59.70 57.63 1iim h MET 45 Cb 0.19 -0.15 -0.00 0.00 0.06 0.00 0.00 31.60 31.70 1iim h MET 45 CO -0.00 0.43 -0.02 -0.07 1.06 0.00 0.00 176.91 178.31 1iim h LEU 46 N 0.67 0.00 -0.64 1.22 3.38 -0.53 0.70 115.31 120.11 1iim h LEU 46 Ca 0.44 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.41 1iim h LEU 46 Cb 0.56 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.31 1iim h LEU 46 CO -0.33 0.02 0.00 0.00 0.09 0.00 0.00 178.44 178.23 1iim n ALA 47 N -2.11 2.58 -0.78 1.53 0.00 0.47 -4.82 120.51 117.38 1iim n ALA 47 Ca -0.01 -0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.07 1iim n ALA 47 Cb 0.23 -1.23 0.00 0.00 0.00 0.00 0.00 19.45 18.45 1iim n ALA 47 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1iim n GLY 48 N 1.05 0.60 3.64 0.00 0.00 0.24 -4.93 105.19 105.79 1iim n GLY 48 Ca 0.18 -0.11 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 1iim n GLY 48 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1iim s ILE 49 N -2.00 5.04 -0.01 -0.61 1.01 -0.90 -4.92 121.20 118.81 1iim s ILE 49 Ca 0.00 1.03 0.07 0.00 0.00 0.00 0.00 60.65 61.74 1iim s ILE 49 Cb 0.00 -3.88 -0.10 0.00 0.01 0.00 0.00 42.46 38.48 1iim s ILE 49 CO 0.00 0.09 0.14 0.54 0.00 0.00 0.00 174.94 175.71 1iim n ARG 50 N 5.38 0.37 -3.39 2.79 1.74 -1.26 -3.66 116.66 118.62 1iim n ARG 50 Ca -0.03 -0.06 -0.44 0.00 -0.77 0.00 0.00 57.85 56.56 1iim n ARG 50 Cb 0.50 -1.16 -0.08 0.00 -1.02 0.00 0.00 32.46 30.69 1iim n ARG 50 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1iim s ASP 51 N -2.82 6.14 -0.04 0.55 2.15 -1.25 -0.99 116.67 120.41 1iim s ASP 51 Ca -0.02 -1.13 0.04 0.00 0.43 0.00 0.00 52.55 51.86 1iim s ASP 51 Cb 0.04 -2.19 0.00 0.00 -0.30 0.00 0.00 42.92 40.48 1iim s ASP 51 CO 0.27 -0.60 -0.14 -0.63 -0.17 0.00 0.00 175.17 173.91 1iim s ILE 52 N 1.74 1.20 -0.22 4.11 1.01 -0.65 -1.45 121.20 126.95 1iim s ILE 52 Ca 0.05 -0.58 -0.09 0.00 0.00 0.00 0.00 60.65 60.03 1iim s ILE 52 Cb -0.22 -1.05 -0.04 0.00 0.01 0.00 0.00 42.46 41.16 1iim s ILE 52 CO 0.08 0.36 0.11 -0.22 0.00 0.00 0.00 174.94 175.27 1iim s LEU 53 N 0.15 3.92 -0.25 2.97 2.96 0.44 -1.43 118.68 127.45 1iim s LEU 53 Ca -0.05 0.06 -0.08 0.00 -0.22 0.00 0.00 54.13 53.85 1iim s LEU 53 Cb -0.11 -2.03 -0.03 0.00 0.50 0.00 0.00 46.19 44.52 1iim s LEU 53 CO 0.02 0.10 0.08 -0.63 -1.32 0.00 0.00 176.35 174.60 1iim s ILE 54 N 0.83 4.49 -0.12 6.68 1.01 0.12 -0.92 121.20 133.29 1iim s ILE 54 Ca 0.06 -0.11 -0.01 0.00 0.00 0.00 0.00 60.65 60.58 1iim s ILE 54 Cb -0.13 -3.10 -0.03 0.00 0.01 0.00 0.00 42.46 39.22 1iim s ILE 54 CO 0.02 0.34 -0.07 -0.63 0.00 0.00 0.00 174.94 174.61 1iim s ILE 55 N 1.49 3.65 0.00 2.92 1.01 -0.64 -1.39 121.20 128.24 1iim s ILE 55 Ca 0.06 -0.46 0.00 0.00 0.00 0.00 0.00 60.65 60.24 1iim s ILE 55 Cb -0.15 -2.55 0.00 0.00 0.01 0.00 0.00 42.46 39.77 1iim s ILE 55 CO 0.04 0.54 0.00 -0.24 0.00 0.00 0.00 174.94 175.28 1iim n SER 56 N 3.03 0.00 -4.89 3.58 2.88 -1.12 0.23 113.62 117.34 1iim n SER 56 Ca -0.18 -0.70 -0.30 0.00 -1.33 0.00 0.00 58.87 56.37 1iim n SER 56 Cb 0.53 0.00 0.07 0.00 -0.75 0.00 0.00 64.21 64.05 1iim n SER 56 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 1iim s THR 57 N -2.40 2.84 0.21 2.46 -4.23 -1.26 -0.38 115.64 112.88 1iim s THR 57 Ca 0.00 0.27 -0.09 0.00 -1.18 0.00 0.00 61.69 60.69 1iim s THR 57 Cb 0.00 -3.26 0.15 0.00 1.34 0.00 0.00 72.50 70.73 1iim s THR 57 CO 0.00 -0.36 1.77 1.55 -0.54 0.00 0.00 174.62 177.05 1iim h PRO 58 N -0.85 0.53 -0.29 3.99 0.13 -1.85 -1.23 132.00 132.44 1iim h PRO 58 Ca -0.46 -0.03 -0.17 0.00 -0.87 0.00 0.00 66.00 64.47 1iim h PRO 58 Cb 1.29 -0.12 -0.00 0.00 0.13 0.00 0.00 31.00 32.30 1iim h PRO 58 CO 0.65 0.35 -0.49 0.37 -0.23 0.00 0.00 178.00 178.65 1iim h GLN 59 N 0.55 0.84 0.00 0.86 4.15 -1.96 -3.35 115.11 116.19 1iim h GLN 59 Ca 0.31 -0.52 -0.01 0.00 0.77 0.00 0.00 58.65 59.21 1iim h GLN 59 Cb 0.31 0.05 -0.00 0.00 0.21 0.00 0.00 27.48 28.05 1iim h GLN 59 CO -0.25 1.15 -0.64 -0.44 -1.93 0.00 0.00 178.83 176.73 1iim h ASP 60 N 0.62 0.00 -0.41 -0.69 3.32 -1.87 -3.38 116.42 114.02 1iim h ASP 60 Ca 0.02 0.00 0.08 0.00 0.02 0.00 0.00 57.03 57.15 1iim h ASP 60 Cb 1.09 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 40.57 1iim h ASP 60 CO 0.11 0.02 -0.05 0.74 -1.72 0.00 0.00 179.24 178.34 1iim h THR 61 N 0.00 0.64 -0.29 0.35 2.02 -1.37 -0.52 112.91 113.74 1iim h THR 61 Ca -0.00 -0.02 0.04 0.00 0.77 0.00 0.00 66.41 67.20 1iim h THR 61 Cb 1.02 0.59 -0.02 0.00 -1.74 0.00 0.00 68.15 68.00 1iim h THR 61 CO 0.00 0.01 0.20 1.55 0.37 0.00 0.00 175.52 177.65 1iim h PRO 62 N 0.05 0.21 -0.41 6.66 0.13 -1.79 -1.00 132.00 135.85 1iim h PRO 62 Ca 0.20 -0.01 -0.08 0.00 -0.87 0.00 0.00 66.00 65.24 1iim h PRO 62 Cb 0.30 -0.05 -0.01 0.00 0.13 0.00 0.00 31.00 31.36 1iim h PRO 62 CO -0.38 0.14 -0.04 0.00 -0.23 0.00 0.00 178.00 177.49 1iim h ARG 63 N 0.22 0.76 -0.08 0.86 3.08 -1.33 0.44 114.38 118.33 1iim h ARG 63 Ca 0.13 -0.26 -0.08 0.00 0.07 0.00 0.00 59.98 59.83 1iim h ARG 63 Cb 0.23 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.21 1iim h ARG 63 CO -0.02 0.86 -0.32 0.74 -1.07 0.00 0.00 179.97 180.16 1iim h PHE 64 N 0.58 0.17 -0.57 3.04 -1.00 -0.71 -0.23 116.94 118.23 1iim h PHE 64 Ca 0.11 -0.03 -0.10 0.00 2.81 0.00 0.00 57.97 60.75 1iim h PHE 64 Cb 0.55 -0.04 -0.02 0.00 3.61 0.00 0.00 35.95 40.05 1iim h PHE 64 CO 0.04 0.46 -0.05 0.37 -1.61 0.00 0.00 178.31 177.52 1iim h GLN 65 N 0.13 1.04 -0.13 1.51 4.15 -0.70 0.21 115.11 121.32 1iim h GLN 65 Ca 0.02 -0.35 -0.13 0.00 0.77 0.00 0.00 58.65 58.96 1iim h GLN 65 Cb 0.63 -0.08 -0.01 0.00 0.21 0.00 0.00 27.48 28.23 1iim h GLN 65 CO 0.05 1.05 -0.47 0.37 -1.93 0.00 0.00 178.83 177.89 1iim h GLN 66 N 0.94 0.33 -0.09 1.69 4.15 -0.44 0.48 115.11 122.16 1iim h GLN 66 Ca 0.16 -0.18 -0.11 0.00 0.77 0.00 0.00 58.65 59.28 1iim h GLN 66 Cb 0.61 0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.32 1iim h GLN 66 CO 0.04 0.74 -0.38 1.25 -1.93 0.00 0.00 178.83 178.55 1iim h LEU 67 N 0.27 0.50 0.00 -2.39 6.46 -0.45 -3.38 115.31 116.30 1iim h LEU 67 Ca 0.02 -0.63 -0.11 0.00 -0.12 0.00 0.00 57.88 57.03 1iim h LEU 67 Cb 0.94 -0.15 -0.02 0.00 -0.73 0.00 0.00 40.66 40.70 1iim h LEU 67 CO 0.08 1.04 -2.00 0.18 -0.62 0.00 0.00 178.44 177.13 1iim n LEU 68 N -4.35 0.00 0.00 2.25 4.77 0.68 -5.09 117.00 115.26 1iim n LEU 68 Ca -0.08 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.90 1iim n LEU 68 Cb 0.53 0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.77 1iim n LEU 68 CO 0.43 0.15 0.00 0.61 -1.33 0.00 0.00 177.39 177.26 1iim n GLY 69 N 1.58 0.78 0.27 -0.72 0.00 0.17 -2.54 105.19 104.74 1iim n GLY 69 Ca -0.12 -0.74 0.09 0.00 0.00 0.00 0.00 46.02 45.25 1iim n GLY 69 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1iim n ASP 70 N -2.54 0.81 0.00 1.61 5.68 -1.26 -4.76 116.55 116.08 1iim n ASP 70 Ca 0.00 -1.59 0.00 0.00 -0.50 0.00 0.00 54.79 52.70 1iim n ASP 70 Cb 0.00 -0.05 0.00 0.00 -1.14 0.00 0.00 41.12 39.93 1iim n ASP 70 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1iim n GLY 71 N 0.94 0.53 0.28 6.12 0.00 -1.05 -0.99 105.19 111.02 1iim n GLY 71 Ca 0.14 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.29 1iim n GLY 71 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1iim h SER 72 N 0.00 0.00 0.10 1.61 4.64 -1.82 -0.07 113.55 118.01 1iim h SER 72 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1iim h SER 72 Cb 0.09 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.18 1iim h SER 72 CO 0.00 0.06 -0.00 0.06 -0.87 0.00 0.00 176.83 176.07 1iim h GLN 73 N 0.00 0.00 -0.06 4.77 -0.00 -1.89 -1.10 115.11 116.83 1iim h GLN 73 Ca -0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 58.65 58.64 1iim h GLN 73 Cb 0.14 0.00 -0.00 0.00 -0.00 0.00 0.00 27.48 27.62 1iim h GLN 73 CO 0.01 0.00 -0.05 0.91 -0.00 0.00 0.00 178.83 179.70 1iim n TRP 74 N -3.16 0.22 -1.72 0.06 8.01 -0.20 -4.97 117.44 115.68 1iim n TRP 74 Ca -0.03 -1.04 -0.12 0.00 -1.31 0.00 0.00 57.50 55.00 1iim n TRP 74 Cb 0.10 -0.20 -0.03 0.00 -2.01 0.00 0.00 31.31 29.16 1iim n TRP 74 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1iim n GLY 75 N -1.22 0.71 3.69 6.99 0.00 -0.42 -4.70 105.19 110.25 1iim n GLY 75 Ca 0.18 -0.43 -0.24 0.00 0.00 0.00 0.00 46.02 45.53 1iim n GLY 75 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1iim s LEU 76 N -3.06 3.13 -0.38 0.99 1.43 -0.25 -4.96 118.68 115.58 1iim s LEU 76 Ca 0.00 -0.90 0.04 0.00 -1.03 0.00 0.00 54.13 52.24 1iim s LEU 76 Cb 0.00 -1.55 0.11 0.00 0.03 0.00 0.00 46.19 44.78 1iim s LEU 76 CO 0.00 -0.30 0.10 0.21 0.23 0.00 0.00 176.35 176.58 1iim s ASN 77 N -3.80 4.66 -0.10 2.29 3.84 -0.17 -2.74 114.94 118.93 1iim s ASN 77 Ca 0.37 -2.34 -0.05 0.00 0.21 0.00 0.00 52.86 51.05 1iim s ASN 77 Cb -0.01 -1.63 -0.04 0.00 -0.55 0.00 0.00 41.25 39.03 1iim s ASN 77 CO 0.21 -0.35 0.10 -0.76 -2.79 0.00 0.00 177.10 173.51 1iim s LEU 78 N 0.65 4.13 0.18 3.21 1.43 -0.16 -1.63 118.68 126.48 1iim s LEU 78 Ca 0.12 0.36 0.04 0.00 -1.03 0.00 0.00 54.13 53.61 1iim s LEU 78 Cb -0.20 -2.03 -0.05 0.00 0.03 0.00 0.00 46.19 43.94 1iim s LEU 78 CO -0.06 0.39 -0.05 0.00 0.23 0.00 0.00 176.35 176.86 1iim s GLN 79 N -1.05 1.15 0.05 1.70 0.00 -0.51 -4.69 119.66 116.31 1iim s GLN 79 Ca 0.15 -1.54 0.04 0.00 -0.00 0.00 0.00 55.36 54.02 1iim s GLN 79 Cb -0.12 -0.54 -0.02 0.00 0.00 0.00 0.00 33.01 32.33 1iim s GLN 79 CO 0.04 -0.02 -0.11 0.71 0.00 0.00 0.00 175.29 175.91 1iim s TYR 80 N -3.43 0.99 -0.12 9.60 1.51 -1.26 0.12 117.35 124.76 1iim s TYR 80 Ca 0.22 -0.41 -0.16 0.00 -1.01 0.00 0.00 57.07 55.70 1iim s TYR 80 Cb 0.04 -0.58 0.04 0.00 -0.11 0.00 0.00 41.96 41.36 1iim s TYR 80 CO 0.04 0.00 0.43 0.21 -1.11 0.00 0.00 175.55 175.11 1iim s LYS 81 N -1.40 0.60 0.17 -0.62 2.20 -0.49 -4.92 119.74 115.27 1iim s LYS 81 Ca -0.03 0.38 -0.18 0.00 -0.36 0.00 0.00 55.97 55.78 1iim s LYS 81 Cb -0.09 0.28 -0.08 0.00 -1.51 0.00 0.00 37.83 36.44 1iim s LYS 81 CO 0.01 -0.11 0.64 0.08 -0.36 0.00 0.00 175.35 175.61 1iim s VAL 82 N -0.28 4.68 -0.40 4.02 1.01 -1.26 -2.78 120.40 125.39 1iim s VAL 82 Ca -0.04 1.15 -0.10 0.00 0.00 0.00 0.00 61.98 62.99 1iim s VAL 82 Cb -0.03 -3.84 0.06 0.00 0.00 0.00 0.00 36.38 32.56 1iim s VAL 82 CO 0.02 0.30 0.23 -1.58 0.00 0.00 0.00 175.10 174.07 1iim s GLN 83 N -1.77 2.67 0.23 2.72 0.74 0.49 -4.90 119.66 119.85 1iim s GLN 83 Ca 0.38 -1.32 -0.10 0.00 0.05 0.00 0.00 55.36 54.37 1iim s GLN 83 Cb -0.17 -3.74 0.34 0.00 1.10 0.00 0.00 33.01 30.54 1iim s GLN 83 CO 0.20 -0.85 1.63 -1.35 -0.55 0.00 0.00 175.29 174.37 1iim h PRO 84 N 8.40 0.04 -3.83 1.67 0.11 -1.96 -3.38 132.00 133.05 1iim h PRO 84 Ca -0.24 -0.00 -0.21 0.00 0.11 0.00 0.00 66.00 65.66 1iim h PRO 84 Cb 1.09 -0.01 -0.25 0.00 0.11 0.00 0.00 31.00 31.93 1iim h PRO 84 CO 0.72 0.03 -0.71 0.45 -0.21 0.00 0.00 178.00 178.27 1iim s SER 85 N -5.22 0.10 -0.74 -2.05 0.15 -1.26 -4.72 113.70 99.97 1iim s SER 85 Ca -0.14 -0.18 -0.21 0.00 0.70 0.00 0.00 55.95 56.12 1iim s SER 85 Cb 0.21 0.03 -0.16 0.00 -1.71 0.00 0.00 66.02 64.40 1iim s SER 85 CO 0.75 -0.11 1.92 -0.81 1.20 0.00 0.00 173.24 176.19 1iim n PRO 86 N 2.54 1.46 -0.30 5.44 -0.04 -1.26 -4.67 135.00 138.16 1iim n PRO 86 Ca -0.16 -1.76 0.03 0.00 -0.04 0.00 0.00 63.50 61.57 1iim n PRO 86 Cb 0.58 -2.85 0.16 0.00 -0.04 0.00 0.00 33.50 31.35 1iim n PRO 86 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1iim n ASP 87 N 7.27 2.53 0.00 3.54 8.00 -1.26 -4.98 116.55 131.65 1iim n ASP 87 Ca 0.49 -2.26 0.00 0.00 0.71 0.00 0.00 54.79 53.72 1iim n ASP 87 Cb 0.38 -0.46 0.00 0.00 -0.02 0.00 0.00 41.12 41.02 1iim n ASP 87 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1iim n GLY 88 N 0.48 3.92 0.28 0.44 0.00 -1.26 -1.47 105.19 107.58 1iim n GLY 88 Ca 0.11 -1.46 0.01 0.00 0.00 0.00 0.00 46.02 44.69 1iim n GLY 88 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1iim h LEU 89 N 0.00 0.58 -2.87 0.99 3.38 -1.94 -1.84 115.31 113.62 1iim h LEU 89 Ca 0.00 0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 1iim h LEU 89 Cb 0.00 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 40.69 1iim h LEU 89 CO 0.00 0.35 -0.00 0.00 0.09 0.00 0.00 178.44 178.88 1iim h ALA 90 N 1.42 1.01 0.00 1.53 0.00 -1.77 -1.09 119.26 120.37 1iim h ALA 90 Ca 0.36 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.27 1iim h ALA 90 Cb 0.31 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1iim h ALA 90 CO -0.23 0.00 0.00 0.37 0.00 0.00 0.00 179.25 179.39 1iim h GLN 91 N 0.00 0.00 -0.33 0.00 4.15 -1.53 -2.47 115.11 114.92 1iim h GLN 91 Ca -0.00 0.00 0.07 0.00 0.77 0.00 0.00 58.65 59.49 1iim h GLN 91 Cb 0.04 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 27.71 1iim h GLN 91 CO 0.00 0.00 0.23 0.00 -1.93 0.00 0.00 178.83 177.13 1iim h ALA 92 N 2.07 2.15 0.00 3.38 0.00 -1.36 -1.00 119.26 124.50 1iim h ALA 92 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1iim h ALA 92 Cb 0.22 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1iim h ALA 92 CO 0.00 -0.23 -0.38 0.74 0.00 0.00 0.00 179.25 179.38 1iim h PHE 93 N 0.13 0.00 0.00 0.00 -1.00 -1.68 -1.24 116.94 113.15 1iim h PHE 93 Ca 0.15 0.00 -0.05 0.00 2.81 0.00 0.00 57.97 60.89 1iim h PHE 93 Cb 0.44 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.00 1iim h PHE 93 CO -0.00 0.00 -0.31 0.82 -1.61 0.00 0.00 178.31 177.21 1iim h ILE 94 N 0.00 0.93 -0.62 -0.55 2.04 -1.43 -2.92 117.51 114.96 1iim h ILE 94 Ca 0.00 -1.79 0.04 0.00 1.00 0.00 0.00 64.86 64.11 1iim h ILE 94 Cb 0.79 1.85 -0.05 0.00 -0.74 0.00 0.00 36.82 38.67 1iim h ILE 94 CO 0.00 0.31 0.36 0.40 0.00 0.00 0.00 178.15 179.22 1iim h ILE 95 N -1.00 1.01 -0.35 -0.67 2.04 -1.32 -2.51 117.51 114.71 1iim h ILE 95 Ca -0.07 -0.23 -0.06 0.00 1.00 0.00 0.00 64.86 65.50 1iim h ILE 95 Cb 0.74 0.27 -0.03 0.00 -0.74 0.00 0.00 36.82 37.05 1iim h ILE 95 CO -0.04 0.12 0.07 0.61 0.00 0.00 0.00 178.15 178.91 1iim n GLY 96 N -1.27 2.51 0.14 5.37 0.00 -0.47 -4.54 105.19 106.92 1iim n GLY 96 Ca 0.07 -0.51 -0.09 0.00 0.00 0.00 0.00 46.02 45.49 1iim n GLY 96 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1iim h GLU 97 N 1.82 0.38 -0.39 1.61 4.81 -1.24 -0.55 114.58 121.03 1iim h GLU 97 Ca 0.07 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.23 1iim h GLU 97 Cb 1.44 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 30.72 1iim h GLU 97 CO 0.33 0.25 0.06 0.93 -0.73 0.00 0.00 179.01 179.85 1iim h GLU 98 N 0.39 0.64 -0.61 1.92 3.07 -1.84 -1.47 114.58 116.68 1iim h GLU 98 Ca 0.12 -0.17 0.06 0.00 -0.50 0.00 0.00 59.36 58.86 1iim h GLU 98 Cb -0.02 -0.07 -0.05 0.00 -0.84 0.00 0.00 28.75 27.76 1iim h GLU 98 CO -0.04 0.70 0.32 0.35 -1.40 0.00 0.00 179.01 178.93 1iim h PHE 99 N 0.48 0.57 -0.44 4.33 3.57 -1.83 -2.59 116.94 121.04 1iim h PHE 99 Ca 0.12 0.02 -0.13 0.00 3.53 0.00 0.00 57.97 61.51 1iim h PHE 99 Cb 0.37 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 38.93 1iim h PHE 99 CO 0.03 0.26 -0.25 0.82 -2.23 0.00 0.00 178.31 176.94 1iim h ILE 100 N 0.59 1.27 0.00 1.41 2.04 -0.91 -3.48 117.51 118.43 1iim h ILE 100 Ca 0.28 -1.41 0.00 0.00 1.00 0.00 0.00 64.86 64.73 1iim h ILE 100 Cb 0.20 1.20 0.00 0.00 -0.74 0.00 0.00 36.82 37.48 1iim h ILE 100 CO -0.19 0.48 0.00 0.61 0.00 0.00 0.00 178.15 179.05 1iim n GLY 101 N -0.10 3.42 1.00 5.37 0.00 -0.57 -1.90 105.19 112.40 1iim n GLY 101 Ca -0.00 -0.12 0.10 0.00 0.00 0.00 0.00 46.02 46.00 1iim n GLY 101 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1iim n HIS 102 N 13.75 0.56 -2.60 1.61 8.25 -1.26 -4.98 115.22 130.54 1iim n HIS 102 Ca 0.00 -0.35 -0.22 0.00 -0.26 0.00 0.00 57.72 56.89 1iim n HIS 102 Cb 0.00 -0.01 0.06 0.00 1.12 0.00 0.00 29.99 31.17 1iim n HIS 102 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1iim s ASP 103 N -1.17 4.94 0.64 0.41 1.01 -0.80 -4.75 116.67 116.95 1iim s ASP 103 Ca 0.35 -0.11 -0.11 0.00 0.71 0.00 0.00 52.55 53.38 1iim s ASP 103 Cb 0.19 -0.58 -0.03 0.00 1.01 0.00 0.00 42.92 43.51 1iim s ASP 103 CO 0.26 -1.41 1.04 -1.81 0.21 0.00 0.00 175.17 173.46 1iim s ASP 104 N -4.54 5.94 -0.11 0.27 1.01 -1.26 -3.98 116.67 114.00 1iim s ASP 104 Ca 0.60 1.51 -0.23 0.00 0.71 0.00 0.00 52.55 55.14 1iim s ASP 104 Cb -0.09 -2.48 0.05 0.00 1.01 0.00 0.00 42.92 41.41 1iim s ASP 104 CO 0.41 -1.06 0.55 0.00 0.21 0.00 0.00 175.17 175.28 1iim s ALA 106 N -0.65 3.65 -0.04 0.00 0.00 -0.10 -1.12 121.76 123.50 1iim s ALA 106 Ca -0.07 -1.19 0.02 0.00 0.00 0.00 0.00 51.96 50.72 1iim s ALA 106 Cb -0.03 -1.45 0.01 0.00 0.00 0.00 0.00 23.12 21.65 1iim s ALA 106 CO 0.05 0.49 -0.10 -1.17 0.00 0.00 0.00 175.76 175.03 1iim s LEU 107 N -3.19 1.70 -0.01 0.00 2.96 0.71 -0.87 118.68 119.98 1iim s LEU 107 Ca 0.32 -0.22 0.01 0.00 -0.22 0.00 0.00 54.13 54.01 1iim s LEU 107 Cb -0.10 -0.65 0.01 0.00 0.50 0.00 0.00 46.19 45.95 1iim s LEU 107 CO 0.25 0.05 -0.03 0.54 -1.32 0.00 0.00 176.35 175.84 1iim s VAL 108 N 0.39 0.29 0.24 1.68 0.11 -0.47 -0.24 120.40 122.40 1iim s VAL 108 Ca -0.07 -0.10 -0.30 0.00 -2.93 0.00 0.00 61.98 58.58 1iim s VAL 108 Cb -0.11 -0.29 -0.09 0.00 -1.53 0.00 0.00 36.38 34.36 1iim s VAL 108 CO 0.01 0.11 1.08 -0.76 -3.33 0.00 0.00 175.10 172.22 1iim s LEU 109 N 0.28 4.54 0.59 2.54 1.43 -0.36 -1.92 118.68 125.79 1iim s LEU 109 Ca -0.03 2.17 0.39 0.00 -1.03 0.00 0.00 54.13 55.63 1iim s LEU 109 Cb -0.06 -3.62 2.05 0.00 0.03 0.00 0.00 46.19 44.59 1iim s LEU 109 CO -0.01 -0.14 2.20 1.23 0.23 0.00 0.00 176.35 179.87 1iim h GLY 110 N 4.34 0.00 -2.37 -3.19 0.00 -1.13 -2.67 103.07 98.05 1iim h GLY 110 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.87 1iim h GLY 110 CO 0.69 0.00 0.00 2.09 0.00 0.00 0.00 176.54 179.32 1iim n ASP 111 N -2.96 4.34 -4.68 0.19 5.75 -1.26 -4.34 116.55 113.58 1iim n ASP 111 Ca -0.02 -2.64 -0.36 0.00 -0.01 0.00 0.00 54.79 51.76 1iim n ASP 111 Cb 0.12 -0.53 -0.09 0.00 -1.03 0.00 0.00 41.12 39.59 1iim n ASP 111 CO 0.00 0.00 0.00 0.20 -0.11 0.00 0.00 177.20 177.29 1iim s ASN 112 N -1.24 6.21 -0.23 -1.12 0.02 -1.01 -3.43 114.94 114.14 1iim s ASN 112 Ca 0.44 0.22 -0.05 0.00 -1.02 0.00 0.00 52.86 52.45 1iim s ASN 112 Cb 0.31 -2.12 -0.02 0.00 0.02 0.00 0.00 41.25 39.44 1iim s ASN 112 CO 0.17 0.08 0.00 -0.63 0.02 0.00 0.00 177.10 176.73 1iim s ILE 113 N 0.88 3.77 -0.05 0.60 1.01 -0.43 -3.84 121.20 123.14 1iim s ILE 113 Ca 0.10 -0.36 0.04 0.00 0.00 0.00 0.00 60.65 60.43 1iim s ILE 113 Cb -0.13 -2.73 -0.02 0.00 0.01 0.00 0.00 42.46 39.58 1iim s ILE 113 CO 0.03 0.39 -0.15 -0.36 0.00 0.00 0.00 174.94 174.85 1iim s PHE 114 N 1.47 2.67 -0.23 3.97 0.40 -1.26 -1.10 117.98 123.90 1iim s PHE 114 Ca 0.05 -0.20 -0.19 0.00 -0.60 0.00 0.00 56.93 55.99 1iim s PHE 114 Cb -0.15 -1.62 0.06 0.00 0.51 0.00 0.00 43.02 41.82 1iim s PHE 114 CO -0.00 0.15 0.60 -0.47 0.70 0.00 0.00 175.22 176.19 1iim s TYR 115 N -0.68 -0.71 0.00 0.36 5.04 -0.28 -4.99 117.35 116.08 1iim s TYR 115 Ca 0.11 1.66 0.00 0.00 -2.44 0.00 0.00 57.07 56.39 1iim s TYR 115 Cb -0.11 0.29 0.00 0.00 0.35 0.00 0.00 41.96 42.49 1iim s TYR 115 CO 0.01 -0.35 0.00 0.41 -1.34 0.00 0.00 175.55 174.28 1iim n GLY 116 N 3.11 3.38 3.71 8.97 0.00 -1.26 0.12 105.19 123.22 1iim n GLY 116 Ca -0.15 -0.74 -0.42 0.00 0.00 0.00 0.00 46.02 44.71 1iim n GLY 116 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1iim s HIS 117 N -2.00 2.92 -0.25 1.61 2.46 -1.26 -2.39 115.29 116.38 1iim s HIS 117 Ca 0.00 0.63 0.00 0.00 0.47 0.00 0.00 55.06 56.16 1iim s HIS 117 Cb 0.00 -3.87 0.00 0.00 -0.13 0.00 0.00 32.58 28.58 1iim s HIS 117 CO 0.00 -3.27 0.00 -0.25 -2.47 0.00 0.00 174.74 168.75 1iim n ASP 118 N 4.47 -3.59 -0.25 9.88 8.00 -1.26 -4.94 116.55 128.86 1iim n ASP 118 Ca 0.14 0.06 0.02 0.00 0.71 0.00 0.00 54.79 55.71 1iim n ASP 118 Cb 0.40 -1.30 0.14 0.00 -0.02 0.00 0.00 41.12 40.35 1iim n ASP 118 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 1iim h LEU 119 N 0.00 0.48 -0.55 0.64 5.85 -1.88 -1.19 115.31 118.67 1iim h LEU 119 Ca -0.05 0.06 0.07 0.00 0.84 0.00 0.00 57.88 58.80 1iim h LEU 119 Cb 0.26 -0.02 -0.06 0.00 0.37 0.00 0.00 40.66 41.21 1iim h LEU 119 CO 0.07 0.27 0.24 -0.65 -0.34 0.00 0.00 178.44 178.03 1iim h PRO 120 N 0.62 0.44 -0.11 5.25 0.11 -1.87 -1.79 132.00 134.65 1iim h PRO 120 Ca 0.36 -0.03 0.02 0.00 0.11 0.00 0.00 66.00 66.46 1iim h PRO 120 Cb 0.38 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 31.37 1iim h PRO 120 CO -0.27 0.29 -0.02 -0.22 -0.21 0.00 0.00 178.00 177.57 1iim h LYS 121 N 0.46 0.01 -0.72 1.05 3.64 -1.63 -0.43 116.57 118.95 1iim h LYS 121 Ca 0.26 -0.00 0.09 0.00 -1.27 0.00 0.00 60.65 59.73 1iim h LYS 121 Cb 0.24 -0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 31.99 1iim h LYS 121 CO -0.22 0.01 0.37 1.25 -2.27 0.00 0.00 179.45 178.58 1iim h LEU 122 N 0.01 0.48 -0.61 5.20 5.85 -0.81 -2.28 115.31 123.16 1iim h LEU 122 Ca 0.05 0.06 -0.13 0.00 0.84 0.00 0.00 57.88 58.71 1iim h LEU 122 Cb 0.08 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.07 1iim h LEU 122 CO -0.11 0.28 -0.25 0.24 -0.34 0.00 0.00 178.44 178.26 1iim h MET 123 N 0.62 0.83 -0.90 1.25 2.86 -0.90 -3.22 114.93 115.47 1iim h MET 123 Ca 0.35 -0.36 0.19 0.00 -2.06 0.00 0.00 59.70 57.83 1iim h MET 123 Cb 0.36 -0.03 -0.07 0.00 0.06 0.00 0.00 31.60 31.92 1iim h MET 123 CO -0.26 0.99 0.59 1.49 1.06 0.00 0.00 176.91 180.78 1iim h GLU 124 N 0.72 0.45 -0.45 1.72 4.81 -0.48 0.16 114.58 121.51 1iim h GLU 124 Ca 0.09 -0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 59.24 1iim h GLU 124 Cb 0.79 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 30.05 1iim h GLU 124 CO 0.07 0.30 0.06 0.00 -0.73 0.00 0.00 179.01 178.71 1iim h ALA 125 N 1.61 0.60 -0.24 2.92 0.00 -1.55 -0.81 119.26 121.79 1iim h ALA 125 Ca 0.47 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 55.12 1iim h ALA 125 Cb 1.08 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 1iim h ALA 125 CO -0.19 0.33 0.05 0.00 0.00 0.00 0.00 179.25 179.44 1iim h ALA 126 N 0.94 0.32 -0.72 0.00 0.00 -1.16 -1.92 119.26 116.72 1iim h ALA 126 Ca 0.14 -0.17 0.11 0.00 0.00 0.00 0.00 54.91 54.99 1iim h ALA 126 Cb 0.40 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.05 1iim h ALA 126 CO 0.01 -0.02 0.48 0.28 0.00 0.00 0.00 179.25 179.99 1iim h VAL 127 N 0.21 0.89 0.00 0.00 2.07 -0.55 -1.87 116.25 117.00 1iim h VAL 127 Ca 0.07 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 67.41 1iim h VAL 127 Cb 0.29 0.30 0.00 0.00 -1.52 0.00 0.00 31.29 30.36 1iim h VAL 127 CO 0.00 0.10 -0.55 0.59 0.02 0.00 0.00 177.57 177.73 1iim n ASN 128 N -4.49 0.54 -4.68 0.57 3.02 -0.33 -1.00 115.26 108.89 1iim n ASN 128 Ca 0.12 -0.21 -0.45 0.00 -0.03 0.00 0.00 54.58 54.01 1iim n ASN 128 Cb 0.39 0.28 -0.04 0.00 -0.61 0.00 0.00 39.78 39.81 1iim n ASN 128 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 1iim n LYS 129 N -1.60 2.42 -0.10 3.52 4.81 -0.70 -4.77 118.16 121.74 1iim n LYS 129 Ca 0.05 0.88 -0.06 0.00 -0.87 0.00 0.00 58.31 58.31 1iim n LYS 129 Cb 0.35 -2.72 0.01 0.00 0.02 0.00 0.00 35.03 32.70 1iim n LYS 129 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 1iim h GLU 130 N 7.68 0.13 -3.68 1.64 4.39 -1.89 -3.45 114.58 119.41 1iim h GLU 130 Ca -0.46 -0.01 -0.16 0.00 0.34 0.00 0.00 59.36 59.07 1iim h GLU 130 Cb 1.24 -0.03 -0.05 0.00 -0.10 0.00 0.00 28.75 29.81 1iim h GLU 130 CO 0.93 0.09 -0.02 -1.54 -1.16 0.00 0.00 179.01 177.30 1iim s SER 131 N -5.28 0.47 0.00 1.42 1.04 -1.26 -4.64 113.70 105.46 1iim s SER 131 Ca -0.13 -1.29 0.00 0.00 0.48 0.00 0.00 55.95 55.01 1iim s SER 131 Cb 0.13 0.72 0.00 0.00 0.10 0.00 0.00 66.02 66.96 1iim s SER 131 CO 0.71 -1.41 0.00 0.61 0.98 0.00 0.00 173.24 174.13 1iim n GLY 132 N -0.53 -0.93 3.17 7.32 0.00 -1.26 -4.93 105.19 108.04 1iim n GLY 132 Ca -0.02 -1.41 -0.09 0.00 0.00 0.00 0.00 46.02 44.50 1iim n GLY 132 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iim s ALA 133 N -1.28 -0.08 -0.05 4.61 0.00 -0.68 -1.77 121.76 122.51 1iim s ALA 133 Ca 0.00 -0.69 0.02 0.00 0.00 0.00 0.00 51.96 51.29 1iim s ALA 133 Cb 0.00 0.40 0.01 0.00 0.00 0.00 0.00 23.12 23.54 1iim s ALA 133 CO 0.00 -0.45 -0.08 0.99 0.00 0.00 0.00 175.76 176.22 1iim s THR 134 N -3.63 0.80 0.29 0.00 2.01 -0.25 -0.61 115.64 114.25 1iim s THR 134 Ca 0.03 -0.31 0.03 0.00 0.31 0.00 0.00 61.69 61.76 1iim s THR 134 Cb 0.04 -0.76 -0.06 0.00 0.01 0.00 0.00 72.50 71.74 1iim s THR 134 CO -0.10 0.27 0.05 0.68 -0.69 0.00 0.00 174.62 174.84 1iim s VAL 135 N 0.64 1.00 -0.02 3.82 -7.23 -0.57 -1.46 120.40 116.58 1iim s VAL 135 Ca -0.11 -2.01 0.07 0.00 -1.81 0.00 0.00 61.98 58.13 1iim s VAL 135 Cb -0.13 -2.65 -0.02 0.00 0.56 0.00 0.00 36.38 34.14 1iim s VAL 135 CO 0.02 -0.08 -0.23 -0.36 -0.31 0.00 0.00 175.10 174.13 1iim s PHE 136 N -3.44 2.41 -0.18 2.82 0.40 -1.26 -1.17 117.98 117.56 1iim s PHE 136 Ca 0.35 -0.37 -0.06 0.00 -0.60 0.00 0.00 56.93 56.24 1iim s PHE 136 Cb 0.08 -1.51 -0.03 0.00 0.51 0.00 0.00 43.02 42.06 1iim s PHE 136 CO 0.13 0.04 0.03 0.00 0.70 0.00 0.00 175.22 176.12 1iim s ALA 137 N -0.67 3.24 -0.02 5.36 0.00 -0.18 -1.38 121.76 128.12 1iim s ALA 137 Ca 0.11 -0.82 0.02 0.00 0.00 0.00 0.00 51.96 51.27 1iim s ALA 137 Cb -0.10 -1.83 0.00 0.00 0.00 0.00 0.00 23.12 21.20 1iim s ALA 137 CO -0.00 0.10 -0.07 -0.47 0.00 0.00 0.00 175.76 175.32 1iim s TYR 138 N 0.53 0.76 -0.08 0.00 5.04 -0.37 -0.87 117.35 122.37 1iim s TYR 138 Ca 0.01 -0.18 -0.30 0.00 -2.44 0.00 0.00 57.07 54.17 1iim s TYR 138 Cb -0.13 -0.56 -0.03 0.00 0.35 0.00 0.00 41.96 41.59 1iim s TYR 138 CO 0.02 -0.09 1.17 -1.58 -1.34 0.00 0.00 175.55 173.73 1iim s HIS 139 N 0.24 3.22 0.18 4.97 5.65 -1.26 -0.69 115.29 127.60 1iim s HIS 139 Ca -0.03 1.26 0.02 0.00 0.25 0.00 0.00 55.06 56.56 1iim s HIS 139 Cb -0.08 -3.39 -0.05 0.00 -1.18 0.00 0.00 32.58 27.89 1iim s HIS 139 CO 0.00 -1.16 -0.01 0.14 -0.65 0.00 0.00 174.74 173.07 1iim s VAL 140 N 2.30 0.77 -0.09 0.89 -7.23 -0.24 -4.97 120.40 111.83 1iim s VAL 140 Ca 0.54 -1.99 0.14 0.00 -1.81 0.00 0.00 61.98 58.86 1iim s VAL 140 Cb -0.23 -2.12 0.03 0.00 0.56 0.00 0.00 36.38 34.62 1iim s VAL 140 CO 0.20 -0.49 1.45 -0.55 -0.31 0.00 0.00 175.10 175.41 1iim h ASN 141 N 2.68 0.00 -2.12 4.85 -1.07 -1.96 -3.39 115.58 114.57 1iim h ASN 141 Ca -0.37 0.00 -0.57 0.00 0.07 0.00 0.00 56.30 55.43 1iim h ASN 141 Cb 1.20 0.00 -0.41 0.00 -2.07 0.00 0.00 38.32 37.05 1iim h ASN 141 CO 0.63 0.56 -0.83 -0.67 0.07 0.00 0.00 177.43 177.19 1iim n ASP 142 N -3.27 2.34 -0.05 6.14 2.03 -1.26 -4.95 116.55 117.53 1iim n ASP 142 Ca 0.02 -3.17 0.23 0.00 0.52 0.00 0.00 54.79 52.38 1iim n ASP 142 Cb 0.74 -0.64 0.71 0.00 -0.72 0.00 0.00 41.12 41.21 1iim n ASP 142 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1iim h PRO 143 N 3.86 0.00 -0.34 -0.67 0.13 -1.87 -2.79 132.00 130.32 1iim h PRO 143 Ca 0.14 0.00 0.10 0.00 -0.87 0.00 0.00 66.00 65.37 1iim h PRO 143 Cb 0.75 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.86 1iim h PRO 143 CO 0.67 0.00 0.35 0.93 -0.23 0.00 0.00 178.00 179.72 1iim h GLU 144 N 0.00 0.00 0.00 0.86 3.07 -1.92 0.16 114.58 116.75 1iim h GLU 144 Ca 0.31 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.17 1iim h GLU 144 Cb 1.28 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.19 1iim h GLU 144 CO -0.00 0.00 0.00 0.54 -1.40 0.00 0.00 179.01 178.15 1iim n ARG 145 N -3.83 0.20 -3.11 2.33 1.74 -1.05 -3.97 116.66 108.96 1iim n ARG 145 Ca 0.05 0.27 -0.14 0.00 -0.77 0.00 0.00 57.85 57.27 1iim n ARG 145 Cb 0.51 -1.78 -0.03 0.00 -1.02 0.00 0.00 32.46 30.14 1iim n ARG 145 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1iim n TYR 146 N -2.13 0.48 -2.77 -1.55 4.02 0.56 -4.75 117.16 111.02 1iim n TYR 146 Ca 0.04 -1.04 -0.42 0.00 -0.01 0.00 0.00 57.90 56.47 1iim n TYR 146 Cb 0.33 -0.14 -0.03 0.00 -0.02 0.00 0.00 39.34 39.48 1iim n TYR 146 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 1iim s GLY 147 N -2.16 2.88 -0.11 2.72 0.00 -1.26 -0.90 107.32 108.48 1iim s GLY 147 Ca 0.00 0.48 0.00 0.00 0.00 0.00 0.00 44.72 45.20 1iim s GLY 147 CO 0.00 1.58 -0.11 0.14 0.00 0.00 0.00 173.10 174.71 1iim s VAL 148 N 0.87 3.25 -0.15 1.40 1.01 0.83 -0.95 120.40 126.65 1iim s VAL 148 Ca 0.49 -0.61 -0.08 0.00 0.00 0.00 0.00 61.98 61.78 1iim s VAL 148 Cb -0.21 -2.35 -0.04 0.00 0.00 0.00 0.00 36.38 33.78 1iim s VAL 148 CO 0.27 0.54 0.13 0.54 0.00 0.00 0.00 175.10 176.58 1iim s VAL 149 N -0.00 5.46 -0.15 2.92 0.11 -0.75 -1.71 120.40 126.27 1iim s VAL 149 Ca -0.03 0.20 -0.07 0.00 -2.93 0.00 0.00 61.98 59.14 1iim s VAL 149 Cb -0.14 -3.42 -0.04 0.00 -1.53 0.00 0.00 36.38 31.25 1iim s VAL 149 CO 0.04 0.56 0.11 -0.70 -3.33 0.00 0.00 175.10 171.77 1iim s GLU 150 N -0.56 3.74 0.09 1.54 2.12 0.51 -4.46 118.70 121.69 1iim s GLU 150 Ca 0.13 -0.23 0.09 0.00 0.36 0.00 0.00 54.97 55.31 1iim s GLU 150 Cb -0.12 -3.23 -0.04 0.00 0.26 0.00 0.00 34.13 31.01 1iim s GLU 150 CO 0.02 0.51 -0.19 -0.06 -0.54 0.00 0.00 175.26 175.01 1iim s PHE 151 N -0.28 2.52 0.39 5.30 0.40 -1.26 0.45 117.98 125.50 1iim s PHE 151 Ca 0.10 -0.27 -0.05 0.00 -0.60 0.00 0.00 56.93 56.11 1iim s PHE 151 Cb -0.12 -1.37 0.09 0.00 0.51 0.00 0.00 43.02 42.13 1iim s PHE 151 CO 0.01 0.34 0.54 -0.40 0.70 0.00 0.00 175.22 176.41 1iim n ASP 152 N 1.04 0.24 -0.13 1.36 5.68 0.33 -4.85 116.55 120.22 1iim n ASP 152 Ca -0.16 -1.32 0.08 0.00 -0.50 0.00 0.00 54.79 52.89 1iim n ASP 152 Cb 0.53 -0.39 0.40 0.00 -1.14 0.00 0.00 41.12 40.52 1iim n ASP 152 CO 0.00 0.00 0.00 1.56 -1.33 0.00 0.00 177.20 177.43 1iim h GLN 153 N 0.00 0.62 0.00 0.11 7.50 -2.01 -0.16 115.11 121.17 1iim h GLN 153 Ca -0.17 -0.04 0.00 0.00 0.50 0.00 0.00 58.65 58.94 1iim h GLN 153 Cb 0.53 -0.14 0.00 0.00 0.05 0.00 0.00 27.48 27.92 1iim h GLN 153 CO 0.14 0.41 0.00 1.63 -1.50 0.00 0.00 178.83 179.51 1iim n LYS 154 N -4.48 0.18 -0.14 1.46 4.01 -1.26 -4.89 118.16 113.05 1iim n LYS 154 Ca 0.09 0.26 0.00 0.00 -0.51 0.00 0.00 58.31 58.15 1iim n LYS 154 Cb 0.25 -1.76 0.00 0.00 -0.51 0.00 0.00 35.03 33.01 1iim n LYS 154 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1iim n GLY 155 N 0.79 0.93 3.73 0.72 0.00 -0.07 -5.07 105.19 106.21 1iim n GLY 155 Ca 0.04 -0.05 -0.39 0.00 0.00 0.00 0.00 46.02 45.62 1iim n GLY 155 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1iim s THR 156 N -2.00 5.04 0.02 2.61 2.01 -1.26 -4.75 115.64 117.31 1iim s THR 156 Ca 0.00 1.29 -0.30 0.00 0.31 0.00 0.00 61.69 62.99 1iim s THR 156 Cb 0.00 -3.97 -0.06 0.00 0.01 0.00 0.00 72.50 68.48 1iim s THR 156 CO 0.00 0.31 1.47 0.00 -0.69 0.00 0.00 174.62 175.71 1iim s ALA 157 N 0.51 3.61 -0.01 7.40 0.00 -1.26 -0.51 121.76 131.50 1iim s ALA 157 Ca 0.33 0.97 0.00 0.00 0.00 0.00 0.00 51.96 53.26 1iim s ALA 157 Cb -0.17 -3.62 -0.00 0.00 0.00 0.00 0.00 23.12 19.32 1iim s ALA 157 CO 0.16 -0.96 0.01 1.33 0.00 0.00 0.00 175.76 176.30 1iim n VAL 158 N 4.67 0.00 -3.50 0.00 0.24 0.17 -4.93 118.33 114.98 1iim n VAL 158 Ca 0.14 -0.49 -0.12 0.00 -2.04 0.00 0.00 64.34 61.83 1iim n VAL 158 Cb 0.43 0.99 -0.04 0.00 -1.47 0.00 0.00 33.84 33.76 1iim n VAL 158 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1iim s SER 159 N -1.03 -0.47 -0.00 -1.34 1.04 -1.20 -4.99 113.70 105.70 1iim s SER 159 Ca 0.00 0.24 0.04 0.00 0.48 0.00 0.00 55.95 56.71 1iim s SER 159 Cb 0.00 0.45 -0.01 0.00 0.10 0.00 0.00 66.02 66.56 1iim s SER 159 CO 0.01 -0.64 -0.13 -0.76 0.98 0.00 0.00 173.24 172.70 1iim s LEU 160 N -1.98 2.05 -0.02 2.42 1.43 -1.26 -0.36 118.68 120.97 1iim s LEU 160 Ca -0.01 -0.28 0.01 0.00 -1.03 0.00 0.00 54.13 52.82 1iim s LEU 160 Cb -0.01 -0.67 0.01 0.00 0.03 0.00 0.00 46.19 45.56 1iim s LEU 160 CO -0.04 0.14 -0.02 -1.61 0.23 0.00 0.00 176.35 175.05 1iim s GLU 161 N -0.48 0.30 -0.18 1.70 2.02 -0.69 -4.95 118.70 116.41 1iim s GLU 161 Ca 0.04 -0.02 -0.24 0.00 0.02 0.00 0.00 54.97 54.77 1iim s GLU 161 Cb -0.06 -0.38 -0.02 0.00 0.10 0.00 0.00 34.13 33.78 1iim s GLU 161 CO -0.00 -0.03 0.79 -2.00 0.02 0.00 0.00 175.26 174.04 1iim s GLU 162 N 0.48 4.26 -1.20 1.61 2.56 -1.26 -0.12 118.70 125.03 1iim s GLU 162 Ca -0.05 0.93 -0.33 0.00 0.00 0.00 0.00 54.97 55.52 1iim s GLU 162 Cb -0.08 -3.58 0.04 0.00 2.00 0.00 0.00 34.13 32.51 1iim s GLU 162 CO -0.01 -0.34 0.70 1.63 -0.56 0.00 0.00 175.26 176.68 1iim n LYS 163 N 5.30 -0.37 -2.30 4.30 5.02 -0.08 -4.89 118.16 125.14 1iim n LYS 163 Ca 0.03 0.13 -0.36 0.00 -2.02 0.00 0.00 58.31 56.09 1iim n LYS 163 Cb 0.49 -2.73 -0.01 0.00 -0.02 0.00 0.00 35.03 32.76 1iim n LYS 163 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1iim s PRO 164 N -7.23 3.68 0.39 1.97 0.04 -1.26 -4.89 135.00 127.70 1iim s PRO 164 Ca 0.49 1.68 0.10 0.00 0.04 0.00 0.00 61.00 63.32 1iim s PRO 164 Cb -0.26 -2.29 0.79 0.00 0.04 0.00 0.00 34.50 32.79 1iim s PRO 164 CO 0.96 -0.59 1.91 -0.07 0.04 0.00 0.00 177.00 179.24 1iim h LEU 165 N 1.82 0.18 -6.97 -3.56 3.38 -1.92 -3.36 115.31 104.87 1iim h LEU 165 Ca -0.49 -0.04 -0.60 0.00 0.09 0.00 0.00 57.88 56.84 1iim h LEU 165 Cb 1.25 -0.05 -0.40 0.00 0.09 0.00 0.00 40.66 41.55 1iim h LEU 165 CO 0.59 0.36 -0.76 -1.10 0.09 0.00 0.00 178.44 177.63 1iim s GLN 166 N -4.64 1.03 0.17 1.13 -0.21 -1.26 -5.05 119.66 110.83 1iim s GLN 166 Ca -0.05 -1.67 -0.33 0.00 0.02 0.00 0.00 55.36 53.32 1iim s GLN 166 Cb 0.15 -2.10 -0.15 0.00 1.00 0.00 0.00 33.01 31.91 1iim s GLN 166 CO 0.73 -1.12 1.31 -2.30 -2.12 0.00 0.00 175.29 171.78 1iim n PRO 167 N 3.94 1.49 0.00 2.91 -0.02 -1.26 -4.86 135.00 137.20 1iim n PRO 167 Ca 0.06 0.53 0.14 0.00 -2.02 0.00 0.00 63.50 62.22 1iim n PRO 167 Cb 0.37 -2.13 0.64 0.00 -0.02 0.00 0.00 33.50 32.36 1iim n PRO 167 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1iim n LYS 168 N 2.17 1.13 -3.80 -0.52 5.02 -1.26 -4.92 118.16 115.99 1iim n LYS 168 Ca 0.15 -0.46 -0.01 0.00 -2.02 0.00 0.00 58.31 55.96 1iim n LYS 168 Cb 0.26 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.78 1iim n LYS 168 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1iim s SER 169 N -2.19 -0.06 -0.21 4.39 1.04 -1.26 -4.82 113.70 110.60 1iim s SER 169 Ca 0.37 -0.41 0.15 0.00 0.48 0.00 0.00 55.95 56.54 1iim s SER 169 Cb 0.21 0.37 0.74 0.00 0.10 0.00 0.00 66.02 67.44 1iim s SER 169 CO 0.40 -0.71 1.66 0.59 0.98 0.00 0.00 173.24 176.16 1iim n ASN 170 N -0.83 5.19 -4.51 7.02 3.02 -1.26 -4.86 115.26 119.04 1iim n ASN 170 Ca -0.04 -2.89 -0.41 0.00 -0.03 0.00 0.00 54.58 51.21 1iim n ASN 170 Cb 0.60 -0.64 -0.10 0.00 -0.61 0.00 0.00 39.78 39.04 1iim n ASN 170 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1iim s TYR 171 N -2.66 3.23 0.19 3.10 1.51 -1.26 -1.08 117.35 120.38 1iim s TYR 171 Ca 0.51 -0.32 0.01 0.00 -1.01 0.00 0.00 57.07 56.26 1iim s TYR 171 Cb 0.39 -2.53 -0.04 0.00 -0.11 0.00 0.00 41.96 39.66 1iim s TYR 171 CO 0.15 -0.45 0.35 0.00 -1.11 0.00 0.00 175.55 174.50 1iim s ALA 172 N 1.74 3.89 -0.15 3.71 0.00 0.14 -1.81 121.76 129.28 1iim s ALA 172 Ca 0.06 -0.95 -0.22 0.00 0.00 0.00 0.00 51.96 50.85 1iim s ALA 172 Cb -0.18 -1.89 -0.03 0.00 0.00 0.00 0.00 23.12 21.02 1iim s ALA 172 CO 0.11 0.44 0.68 0.08 0.00 0.00 0.00 175.76 177.06 1iim s VAL 173 N -1.85 5.02 1.13 0.00 1.01 -0.13 -1.24 120.40 124.34 1iim s VAL 173 Ca 0.37 1.33 -0.17 0.00 0.00 0.00 0.00 61.98 63.50 1iim s VAL 173 Cb -0.11 -4.00 0.25 0.00 0.00 0.00 0.00 36.38 32.53 1iim s VAL 173 CO 0.29 0.16 1.14 0.42 0.00 0.00 0.00 175.10 177.10 1iim s THR 174 N 1.51 1.73 -0.27 3.92 -4.23 -0.48 -4.66 115.64 113.17 1iim s THR 174 Ca 0.33 0.00 0.03 0.00 -1.18 0.00 0.00 61.69 60.86 1iim s THR 174 Cb -0.16 -2.57 0.37 0.00 1.34 0.00 0.00 72.50 71.48 1iim s THR 174 CO 0.13 0.00 1.49 0.61 -0.54 0.00 0.00 174.62 176.31 1iim n GLY 175 N -1.42 3.31 3.01 3.99 0.00 -1.26 -4.78 105.19 108.04 1iim n GLY 175 Ca 0.12 -0.59 -0.30 0.00 0.00 0.00 0.00 46.02 45.24 1iim n GLY 175 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1iim s LEU 176 N -1.80 1.77 0.01 0.99 2.96 -1.26 -1.23 118.68 120.12 1iim s LEU 176 Ca 0.31 -0.55 0.03 0.00 -0.22 0.00 0.00 54.13 53.71 1iim s LEU 176 Cb 0.26 -1.18 -0.01 0.00 0.50 0.00 0.00 46.19 45.76 1iim s LEU 176 CO 0.06 -0.07 -0.11 -0.31 -1.32 0.00 0.00 176.35 174.60 1iim s TYR 177 N 1.48 0.97 -0.14 5.38 1.51 0.67 -4.25 117.35 122.98 1iim s TYR 177 Ca 0.04 -0.24 0.02 0.00 -1.01 0.00 0.00 57.07 55.89 1iim s TYR 177 Cb -0.13 -0.61 0.01 0.00 -0.11 0.00 0.00 41.96 41.12 1iim s TYR 177 CO -0.10 -0.01 -0.22 -0.06 -1.11 0.00 0.00 175.55 174.05 1iim s PHE 178 N -0.46 2.67 0.16 2.71 0.40 -0.54 -0.21 117.98 122.71 1iim s PHE 178 Ca 0.02 -1.28 0.07 0.00 -0.60 0.00 0.00 56.93 55.14 1iim s PHE 178 Cb -0.05 -1.81 -0.04 0.00 0.51 0.00 0.00 43.02 41.63 1iim s PHE 178 CO 0.00 -0.58 -0.15 0.71 0.70 0.00 0.00 175.22 175.90 1iim s TYR 179 N 0.76 1.60 0.54 0.36 1.51 -0.28 -1.09 117.35 120.76 1iim s TYR 179 Ca -0.08 -0.55 -0.02 0.00 -1.01 0.00 0.00 57.07 55.41 1iim s TYR 179 Cb -0.16 -0.80 0.11 0.00 -0.11 0.00 0.00 41.96 41.01 1iim s TYR 179 CO -0.01 0.26 0.74 -0.40 -1.11 0.00 0.00 175.55 175.03 1iim n ASP 180 N 0.15 0.81 0.30 2.29 5.68 -0.73 -1.63 116.55 123.41 1iim n ASP 180 Ca -0.12 -1.73 0.19 0.00 -0.50 0.00 0.00 54.79 52.63 1iim n ASP 180 Cb 0.58 -0.49 0.88 0.00 -1.14 0.00 0.00 41.12 40.95 1iim n ASP 180 CO 0.00 0.00 0.00 -1.13 -1.33 0.00 0.00 177.20 174.74 1iim h ASN 181 N -0.54 0.00 0.36 -1.12 -0.73 -1.86 -3.08 115.58 108.61 1iim h ASN 181 Ca -0.24 0.00 0.00 0.00 1.87 0.00 0.00 56.30 57.93 1iim h ASN 181 Cb 0.85 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.44 1iim h ASN 181 CO 0.24 0.02 0.00 -1.54 -0.37 0.00 0.00 177.43 175.78 1iim n SER 182 N -3.14 0.36 0.09 1.15 3.41 -1.26 -2.75 113.62 111.48 1iim n SER 182 Ca -0.01 0.62 0.03 0.00 -0.26 0.00 0.00 58.87 59.25 1iim n SER 182 Cb 0.22 -0.68 0.43 0.00 -0.26 0.00 0.00 64.21 63.91 1iim n SER 182 CO 0.00 0.00 0.00 1.62 -0.16 0.00 0.00 175.04 176.50 1iim h VAL 183 N 0.00 1.13 -0.05 -3.33 3.04 -1.93 -2.66 116.25 112.46 1iim h VAL 183 Ca 0.00 -0.48 0.00 0.00 -1.01 0.00 0.00 66.70 65.21 1iim h VAL 183 Cb 0.18 0.93 -0.00 0.00 -2.01 0.00 0.00 31.29 30.39 1iim h VAL 183 CO 0.00 0.16 0.03 0.58 -1.01 0.00 0.00 177.57 177.33 1iim h VAL 184 N 0.32 1.02 -0.75 1.51 2.07 -1.79 0.03 116.25 118.66 1iim h VAL 184 Ca 0.08 -0.05 -0.05 0.00 0.82 0.00 0.00 66.70 67.50 1iim h VAL 184 Cb 0.18 0.97 -0.03 0.00 -1.52 0.00 0.00 31.29 30.89 1iim h VAL 184 CO 0.00 0.02 0.28 -0.08 0.02 0.00 0.00 177.57 177.81 1iim h GLU 185 N 0.05 1.14 -0.16 1.57 4.57 -1.75 -1.49 114.58 118.51 1iim h GLU 185 Ca 0.02 -0.22 0.04 0.00 -1.18 0.00 0.00 59.36 58.01 1iim h GLU 185 Cb 0.01 -0.18 -0.03 0.00 -0.16 0.00 0.00 28.75 28.38 1iim h GLU 185 CO -0.00 0.95 -0.06 0.52 -1.18 0.00 0.00 179.01 179.23 1iim h MET 186 N 1.10 -0.03 -0.76 1.92 2.86 -1.09 -2.34 114.93 116.59 1iim h MET 186 Ca 0.25 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.89 1iim h MET 186 Cb 0.25 0.01 -0.04 0.00 0.06 0.00 0.00 31.60 31.88 1iim h MET 186 CO -0.02 -0.02 0.48 0.00 1.06 0.00 0.00 176.91 178.42 1iim h ALA 187 N 1.12 0.97 0.00 6.32 0.00 -0.62 -1.93 119.26 125.11 1iim h ALA 187 Ca 0.08 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1iim h ALA 187 Cb 0.16 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 1iim h ALA 187 CO -0.18 0.41 -0.04 0.87 0.00 0.00 0.00 179.25 180.30 1iim h LYS 188 N 1.03 0.00 -0.03 0.00 1.57 -0.97 -2.61 116.57 115.57 1iim h LYS 188 Ca 0.28 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.06 1iim h LYS 188 Cb -0.08 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.23 1iim h LYS 188 CO -0.06 0.04 -0.11 0.09 -0.57 0.00 0.00 179.45 178.84 1iim n ASN 189 N -3.55 2.64 -4.78 0.86 3.02 -0.76 -4.98 115.26 107.72 1iim n ASN 189 Ca -0.02 -1.83 -0.36 0.00 -0.03 0.00 0.00 54.58 52.34 1iim n ASN 189 Cb 0.15 0.11 -0.01 0.00 -0.61 0.00 0.00 39.78 39.42 1iim n ASN 189 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1iim s LEU 190 N -2.12 3.89 -0.07 3.41 1.43 -0.99 -5.04 118.68 119.19 1iim s LEU 190 Ca 0.26 2.18 0.00 0.00 -1.03 0.00 0.00 54.13 55.55 1iim s LEU 190 Cb 0.20 -4.42 -0.03 0.00 0.03 0.00 0.00 46.19 41.96 1iim s LEU 190 CO 0.37 -0.99 -0.05 -0.54 0.23 0.00 0.00 176.35 175.37 1iim s LYS 191 N -3.00 2.81 0.54 1.70 3.01 -1.26 -5.08 119.74 118.45 1iim s LYS 191 Ca 0.68 -0.52 -0.22 0.00 -1.01 0.00 0.00 55.97 54.90 1iim s LYS 191 Cb -0.24 -2.65 -0.05 0.00 -1.01 0.00 0.00 37.83 33.88 1iim s LYS 191 CO 0.29 0.67 1.35 -1.25 0.51 0.00 0.00 175.35 176.92 1iim s PRO 192 N -0.88 3.21 1.06 -1.68 0.04 -1.26 -4.80 135.00 130.69 1iim s PRO 192 Ca 0.13 2.21 -0.17 0.00 0.04 0.00 0.00 61.00 63.21 1iim s PRO 192 Cb -0.11 -2.29 0.23 0.00 0.04 0.00 0.00 34.50 32.37 1iim s PRO 192 CO 0.02 -1.13 1.22 -1.54 0.04 0.00 0.00 177.00 175.61 1iim s SER 193 N -0.96 2.23 0.48 6.66 1.04 -0.49 -4.79 113.70 117.87 1iim s SER 193 Ca 0.71 0.48 0.19 0.00 0.48 0.00 0.00 55.95 57.81 1iim s SER 193 Cb -0.40 -0.66 1.21 0.00 0.10 0.00 0.00 66.02 66.27 1iim s SER 193 CO 0.47 -3.30 2.01 0.00 0.98 0.00 0.00 173.24 173.40 1iim h ALA 194 N -2.02 2.21 -0.16 5.32 0.00 -1.95 0.70 119.26 123.35 1iim h ALA 194 Ca -0.45 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1iim h ALA 194 Cb 1.27 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1iim h ALA 194 CO 0.39 -0.33 0.00 2.89 0.00 0.00 0.00 179.25 182.20 1iim n ARG 195 N -4.44 1.62 -3.27 0.00 1.85 -1.26 -4.90 116.66 106.26 1iim n ARG 195 Ca 0.08 -0.69 -0.22 0.00 -1.00 0.00 0.00 57.85 56.02 1iim n ARG 195 Cb 0.43 -1.35 0.06 0.00 -1.05 0.00 0.00 32.46 30.54 1iim n ARG 195 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1iim n GLY 196 N 0.54 -0.48 3.24 2.89 0.00 0.24 -5.03 105.19 106.60 1iim n GLY 196 Ca 0.06 0.15 -0.19 0.00 0.00 0.00 0.00 46.02 46.05 1iim n GLY 196 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1iim s GLU 197 N -5.95 1.00 -0.50 1.61 2.02 -1.26 -4.82 118.70 110.81 1iim s GLU 197 Ca 0.43 -1.18 -0.23 0.00 0.02 0.00 0.00 54.97 54.00 1iim s GLU 197 Cb -0.19 -0.95 0.03 0.00 0.10 0.00 0.00 34.13 33.12 1iim s GLU 197 CO 0.53 0.19 0.85 -0.51 0.02 0.00 0.00 175.26 176.34 1iim s LEU 198 N -2.27 4.22 -0.20 1.80 1.43 -0.54 -1.39 118.68 121.73 1iim s LEU 198 Ca 0.07 -0.24 -0.28 0.00 -1.03 0.00 0.00 54.13 52.64 1iim s LEU 198 Cb -0.06 -2.90 0.00 0.00 0.03 0.00 0.00 46.19 43.26 1iim s LEU 198 CO 0.03 -1.05 1.00 -1.61 0.23 0.00 0.00 176.35 174.94 1iim s GLU 199 N 3.56 4.29 0.45 1.70 0.41 -1.26 -2.39 118.70 125.46 1iim s GLU 199 Ca 0.30 1.30 0.14 0.00 -0.41 0.00 0.00 54.97 56.30 1iim s GLU 199 Cb -0.13 -3.61 1.00 0.00 -1.78 0.00 0.00 34.13 29.61 1iim s GLU 199 CO 0.21 -0.53 2.00 0.97 -0.49 0.00 0.00 175.26 177.42 1iim h ILE 200 N 5.35 1.13 -0.19 -1.63 6.09 -1.94 -1.96 117.51 124.36 1iim h ILE 200 Ca -0.23 -0.59 -0.04 0.00 -1.37 0.00 0.00 64.86 62.63 1iim h ILE 200 Cb 1.09 1.30 -0.01 0.00 0.47 0.00 0.00 36.82 39.67 1iim h ILE 200 CO 0.93 0.17 -0.07 0.74 -3.07 0.00 0.00 178.15 176.85 1iim h THR 201 N 0.02 1.16 -0.27 2.19 2.02 -1.99 -1.26 112.91 114.78 1iim h THR 201 Ca 0.00 -0.69 -0.10 0.00 0.77 0.00 0.00 66.41 66.40 1iim h THR 201 Cb 0.30 1.11 -0.01 0.00 -1.74 0.00 0.00 68.15 67.81 1iim h THR 201 CO 0.02 0.22 -0.25 0.44 0.37 0.00 0.00 175.52 176.32 1iim h ASP 202 N 0.27 0.52 -0.21 4.18 3.32 -1.76 0.84 116.42 123.58 1iim h ASP 202 Ca 0.06 -0.18 -0.02 0.00 0.02 0.00 0.00 57.03 56.92 1iim h ASP 202 Cb 0.31 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 1iim h ASP 202 CO 0.01 0.76 0.07 0.40 -1.72 0.00 0.00 179.24 178.77 1iim h ILE 203 N 0.46 1.19 -0.41 0.35 2.04 -1.29 -0.97 117.51 118.87 1iim h ILE 203 Ca 0.07 -0.59 -0.04 0.00 1.00 0.00 0.00 64.86 65.30 1iim h ILE 203 Cb 0.68 1.18 -0.02 0.00 -0.74 0.00 0.00 36.82 37.92 1iim h ILE 203 CO 0.05 0.19 0.10 0.78 0.00 0.00 0.00 178.15 179.27 1iim h ASN 204 N 0.17 0.56 -0.04 1.72 -0.26 -0.96 -1.23 115.58 115.54 1iim h ASN 204 Ca 0.07 -0.08 -0.09 0.00 -0.56 0.00 0.00 56.30 55.63 1iim h ASN 204 Cb 0.23 -0.15 -0.01 0.00 -1.06 0.00 0.00 38.32 37.33 1iim h ASN 204 CO -0.00 0.56 -0.25 0.03 -1.06 0.00 0.00 177.43 176.71 1iim h ARG 205 N 0.60 0.47 -0.09 0.81 3.08 -0.50 -1.13 114.38 117.62 1iim h ARG 205 Ca 0.14 -0.18 -0.01 0.00 0.07 0.00 0.00 59.98 60.01 1iim h ARG 205 Cb 0.23 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.25 1iim h ARG 205 CO -0.00 0.69 0.03 0.82 -1.07 0.00 0.00 179.97 180.44 1iim h ILE 206 N 0.41 1.16 -0.92 2.04 2.04 -0.00 0.63 117.51 122.87 1iim h ILE 206 Ca 0.06 -0.48 -0.00 0.00 1.00 0.00 0.00 64.86 65.44 1iim h ILE 206 Cb 0.67 1.32 -0.04 0.00 -0.74 0.00 0.00 36.82 38.02 1iim h ILE 206 CO 0.05 0.14 0.56 1.88 0.00 0.00 0.00 178.15 180.78 1iim h TYR 207 N -0.03 1.21 -0.55 1.37 -1.99 -1.26 -1.83 116.97 113.88 1iim h TYR 207 Ca 0.03 -0.00 -0.08 0.00 2.00 0.00 0.00 58.73 60.68 1iim h TYR 207 Cb 0.19 -0.40 -0.02 0.00 2.00 0.00 0.00 36.73 38.50 1iim h TYR 207 CO -0.01 0.80 0.01 1.98 -0.00 0.00 0.00 178.16 180.94 1iim h MET 208 N 1.27 0.93 0.00 4.88 4.05 -0.91 0.83 114.93 125.98 1iim h MET 208 Ca 0.33 -0.27 -0.05 0.00 -0.28 0.00 0.00 59.70 59.44 1iim h MET 208 Cb -0.06 -0.10 -0.01 0.00 -0.80 0.00 0.00 31.60 30.63 1iim h MET 208 CO -0.06 0.91 -0.23 0.93 0.23 0.00 0.00 176.91 178.69 1iim h GLU 209 N 0.86 0.00 -0.07 0.39 5.08 -0.29 -2.02 114.58 118.53 1iim h GLU 209 Ca 0.16 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.52 1iim h GLU 209 Cb 0.49 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.74 1iim h GLU 209 CO 0.02 0.23 0.00 1.04 -1.00 0.00 0.00 179.01 179.30 1iim n GLN 210 N -3.54 1.75 -2.11 2.33 6.02 -0.74 -4.92 117.38 116.17 1iim n GLN 210 Ca -0.01 -1.10 -0.11 0.00 -0.01 0.00 0.00 57.00 55.77 1iim n GLN 210 Cb 0.38 -1.45 -0.01 0.00 1.02 0.00 0.00 30.24 30.18 1iim n GLN 210 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1iim n GLY 211 N 1.18 0.06 0.37 1.08 0.00 -0.76 -4.92 105.19 102.20 1iim n GLY 211 Ca 0.18 -0.43 0.03 0.00 0.00 0.00 0.00 46.02 45.80 1iim n GLY 211 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1iim n ARG 212 N -2.13 2.89 -3.91 1.61 1.74 0.24 -5.00 116.66 112.10 1iim n ARG 212 Ca -0.13 -1.86 -0.35 0.00 -0.77 0.00 0.00 57.85 54.73 1iim n ARG 212 Cb 0.57 -1.18 -0.11 0.00 -1.02 0.00 0.00 32.46 30.72 1iim n ARG 212 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1iim s LEU 213 N -1.11 3.71 -0.29 0.55 2.96 -1.15 -1.69 118.68 121.67 1iim s LEU 213 Ca 0.15 -0.01 -0.11 0.00 -0.22 0.00 0.00 54.13 53.93 1iim s LEU 213 Cb 0.08 -1.96 -0.04 0.00 0.50 0.00 0.00 46.19 44.77 1iim s LEU 213 CO 0.09 0.09 0.19 -0.44 -1.32 0.00 0.00 176.35 174.96 1iim s SER 214 N 0.85 5.93 -0.53 3.68 0.01 0.22 -4.92 113.70 118.94 1iim s SER 214 Ca 0.04 -0.10 -0.15 0.00 1.31 0.00 0.00 55.95 57.04 1iim s SER 214 Cb -0.14 -2.10 0.13 0.00 0.21 0.00 0.00 66.02 64.12 1iim s SER 214 CO 0.02 -0.08 0.48 -0.69 0.41 0.00 0.00 173.24 173.39 1iim s VAL 215 N 1.74 5.13 0.05 3.43 1.01 -1.26 -1.51 120.40 128.97 1iim s VAL 215 Ca 0.07 -1.50 -0.24 0.00 0.00 0.00 0.00 61.98 60.30 1iim s VAL 215 Cb -0.16 -4.28 -0.06 0.00 0.00 0.00 0.00 36.38 31.88 1iim s VAL 215 CO 0.10 -0.85 0.73 0.00 0.00 0.00 0.00 175.10 175.08 1iim s ALA 216 N 1.58 3.40 0.07 5.51 0.00 -0.31 -4.87 121.76 127.14 1iim s ALA 216 Ca 0.03 0.23 -0.30 0.00 0.00 0.00 0.00 51.96 51.92 1iim s ALA 216 Cb -0.29 -2.94 -0.05 0.00 0.00 0.00 0.00 23.12 19.84 1iim s ALA 216 CO 0.03 0.11 1.01 -1.64 0.00 0.00 0.00 175.76 175.27 1iim s MET 217 N -0.19 4.60 -0.41 0.00 -1.94 -1.26 -1.01 119.30 119.10 1iim s MET 217 Ca 0.37 1.50 -0.05 0.00 -1.71 0.00 0.00 55.69 55.80 1iim s MET 217 Cb -0.20 -3.40 0.10 0.00 2.01 0.00 0.00 34.83 33.34 1iim s MET 217 CO 0.22 0.04 0.21 1.41 -0.01 0.00 0.00 175.02 176.89 1iim s MET 218 N 0.48 2.24 1.13 2.03 0.00 -0.05 -4.87 119.30 120.26 1iim s MET 218 Ca 0.50 -1.67 -0.13 0.00 0.00 0.00 0.00 55.69 54.40 1iim s MET 218 Cb -0.24 -3.62 0.26 0.00 0.00 0.00 0.00 34.83 31.23 1iim s MET 218 CO 0.30 -1.01 1.04 0.20 0.00 0.00 0.00 175.02 175.55 1iim s GLY 219 N 1.94 1.56 0.58 2.11 0.00 -1.26 -4.46 107.32 107.78 1iim s GLY 219 Ca 0.05 -0.10 0.39 0.00 0.00 0.00 0.00 44.72 45.06 1iim s GLY 219 CO -0.02 0.58 2.19 0.07 0.00 0.00 0.00 173.10 175.92 1iim h ARG 220 N -2.49 0.00 0.00 2.90 0.11 -1.97 -1.79 114.38 111.14 1iim h ARG 220 Ca -0.59 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.49 1iim h ARG 220 Cb 1.33 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.41 1iim h ARG 220 CO 0.51 0.00 0.00 0.78 0.10 0.00 0.00 179.97 181.36 1iim h GLY 221 N 0.42 0.00 -3.43 0.08 0.00 -1.98 -3.43 103.07 94.72 1iim h GLY 221 Ca 0.00 0.00 -0.50 0.00 0.00 0.00 0.00 47.33 46.83 1iim h GLY 221 CO 0.00 0.00 -0.35 -0.19 0.00 0.00 0.00 176.54 176.00 1iim s TYR 222 N -3.62 3.48 -0.20 5.60 1.51 -0.67 -4.71 117.35 118.74 1iim s TYR 222 Ca 0.01 0.21 -0.03 0.00 -1.01 0.00 0.00 57.07 56.25 1iim s TYR 222 Cb 0.09 -1.76 -0.01 0.00 -0.11 0.00 0.00 41.96 40.17 1iim s TYR 222 CO 0.46 0.36 -0.06 0.00 -1.11 0.00 0.00 175.55 175.21 1iim s ALA 223 N -1.97 2.80 -0.23 3.71 0.00 0.12 -4.96 121.76 121.23 1iim s ALA 223 Ca 0.37 -1.08 0.01 0.00 0.00 0.00 0.00 51.96 51.26 1iim s ALA 223 Cb -0.10 -1.60 0.06 0.00 0.00 0.00 0.00 23.12 21.48 1iim s ALA 223 CO 0.30 -0.23 -0.07 -0.46 0.00 0.00 0.00 175.76 175.30 1iim s TRP 224 N 1.14 2.45 0.16 0.00 -0.00 -1.26 -1.13 118.94 120.31 1iim s TRP 224 Ca 0.02 -1.74 0.11 0.00 -0.00 0.00 0.00 56.10 54.48 1iim s TRP 224 Cb -0.14 -1.61 -0.04 0.00 -0.00 0.00 0.00 33.47 31.67 1iim s TRP 224 CO -0.01 -0.77 -0.25 -0.51 -0.00 0.00 0.00 176.95 175.41 1iim s LEU 225 N 1.38 2.38 0.27 5.86 1.43 -0.26 -4.98 118.68 124.76 1iim s LEU 225 Ca -0.05 -0.81 0.11 0.00 -1.03 0.00 0.00 54.13 52.35 1iim s LEU 225 Cb -0.18 -1.15 -0.05 0.00 0.03 0.00 0.00 46.19 44.84 1iim s LEU 225 CO -0.07 0.13 -0.15 -1.81 0.23 0.00 0.00 176.35 174.68 1iim s ASP 226 N -2.39 3.82 -0.35 2.29 1.01 -1.26 -1.32 116.67 118.48 1iim s ASP 226 Ca 0.17 -0.92 0.13 0.00 0.71 0.00 0.00 52.55 52.64 1iim s ASP 226 Cb -0.09 -0.44 0.45 0.00 1.01 0.00 0.00 42.92 43.86 1iim s ASP 226 CO 0.08 0.04 1.05 0.35 0.21 0.00 0.00 175.17 176.89 1iim n THR 227 N -0.63 1.64 0.30 -1.27 -2.24 -1.22 -4.42 114.28 106.44 1iim n THR 227 Ca -0.06 -3.77 0.12 0.00 -2.27 0.00 0.00 64.05 58.08 1iim n THR 227 Cb 0.59 -0.06 0.16 0.00 -2.10 0.00 0.00 70.33 68.92 1iim n THR 227 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1iim h GLY 228 N 2.73 0.00 -2.25 3.38 0.00 -1.92 -3.43 103.07 101.57 1iim h GLY 228 Ca 0.07 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.88 1iim h GLY 228 CO 0.60 0.00 -0.71 -0.51 0.00 0.00 0.00 176.54 175.92 1iim s THR 229 N -3.23 1.93 0.16 4.70 -4.23 -1.26 -4.36 115.64 109.34 1iim s THR 229 Ca 0.05 -2.21 -0.18 0.00 -1.18 0.00 0.00 61.69 58.17 1iim s THR 229 Cb 0.09 -2.36 0.05 0.00 1.34 0.00 0.00 72.50 71.62 1iim s THR 229 CO 0.70 -0.37 1.68 0.45 -0.54 0.00 0.00 174.62 176.54 1iim h HIS 230 N 2.30 -0.14 0.48 3.99 3.86 -1.91 -0.41 115.15 123.33 1iim h HIS 230 Ca -0.40 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 58.83 1iim h HIS 230 Cb 1.24 0.11 -0.01 0.00 1.06 0.00 0.00 27.41 29.81 1iim h HIS 230 CO 0.73 -0.13 -0.34 1.96 0.86 0.00 0.00 177.93 181.01 1iim h GLN 231 N 0.02 -0.77 -0.39 2.45 7.50 -1.99 -2.08 115.11 119.86 1iim h GLN 231 Ca 0.17 0.05 -0.00 0.00 0.50 0.00 0.00 58.65 59.36 1iim h GLN 231 Cb 0.25 0.17 -0.02 0.00 0.05 0.00 0.00 27.48 27.93 1iim h GLN 231 CO -0.33 -0.51 0.23 0.66 -1.50 0.00 0.00 178.83 177.37 1iim h SER 232 N -0.79 0.47 -0.53 1.46 4.64 -1.80 -1.59 113.55 115.41 1iim h SER 232 Ca -0.05 -0.02 -0.07 0.00 -0.47 0.00 0.00 61.79 61.18 1iim h SER 232 Cb 0.67 -0.12 -0.02 0.00 -0.31 0.00 0.00 62.40 62.62 1iim h SER 232 CO 0.02 0.37 0.05 0.25 -0.87 0.00 0.00 176.83 176.65 1iim h LEU 233 N 0.54 0.87 -0.35 5.97 5.85 -0.83 -1.14 115.31 126.22 1iim h LEU 233 Ca 0.14 -0.28 -0.19 0.00 0.84 0.00 0.00 57.88 58.39 1iim h LEU 233 Cb -0.00 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 40.78 1iim h LEU 233 CO -0.03 0.93 -0.82 -0.29 -0.34 0.00 0.00 178.44 177.89 1iim h ILE 234 N 0.77 1.46 -0.35 4.05 2.10 -1.00 -2.62 117.51 121.92 1iim h ILE 234 Ca 0.16 -2.46 -0.09 0.00 1.08 0.00 0.00 64.86 63.55 1iim h ILE 234 Cb 0.45 2.35 -0.02 0.00 -1.09 0.00 0.00 36.82 38.52 1iim h ILE 234 CO 0.02 0.72 -0.17 -0.33 -1.08 0.00 0.00 178.15 177.31 1iim h GLU 235 N 0.14 0.63 -0.41 2.19 5.08 -1.16 -1.38 114.58 119.67 1iim h GLU 235 Ca -0.04 -0.22 -0.11 0.00 -1.00 0.00 0.00 59.36 57.99 1iim h GLU 235 Cb 1.43 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.62 1iim h GLU 235 CO 0.13 0.77 -0.18 0.00 -1.00 0.00 0.00 179.01 178.73 1iim h ALA 236 N 1.25 0.57 -0.68 3.43 0.00 -1.16 -1.50 119.26 121.17 1iim h ALA 236 Ca 0.09 -0.36 -0.04 0.00 0.00 0.00 0.00 54.91 54.60 1iim h ALA 236 Cb 0.62 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 1iim h ALA 236 CO 0.04 0.52 0.28 0.77 0.00 0.00 0.00 179.25 180.86 1iim h SER 237 N 0.66 0.93 -0.57 0.00 0.02 -1.13 -1.10 113.55 112.36 1iim h SER 237 Ca 0.09 -0.17 -0.08 0.00 -0.84 0.00 0.00 61.79 60.80 1iim h SER 237 Cb 0.73 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 63.01 1iim h SER 237 CO 0.06 0.84 0.05 0.78 -1.14 0.00 0.00 176.83 177.42 1iim h ASN 238 N 0.96 0.97 0.41 3.07 2.35 -1.18 -0.55 115.58 121.60 1iim h ASN 238 Ca 0.23 -0.24 -0.01 0.00 -0.55 0.00 0.00 56.30 55.72 1iim h ASN 238 Cb 0.19 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.30 1iim h ASN 238 CO -0.02 0.99 -0.26 0.15 -1.65 0.00 0.00 177.43 176.64 1iim h PHE 239 N 0.93 -0.68 -0.73 1.19 3.57 -0.87 -1.31 116.94 119.04 1iim h PHE 239 Ca 0.18 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.67 1iim h PHE 239 Cb 0.47 0.24 -0.04 0.00 2.79 0.00 0.00 35.95 39.42 1iim h PHE 239 CO 0.03 -0.40 0.44 0.82 -2.23 0.00 0.00 178.31 176.97 1iim h ILE 240 N -0.64 1.21 -0.43 1.41 1.08 -1.11 -2.77 117.51 116.25 1iim h ILE 240 Ca -0.04 -0.48 0.03 0.00 -0.39 0.00 0.00 64.86 63.98 1iim h ILE 240 Cb 0.53 0.20 -0.04 0.00 -3.07 0.00 0.00 36.82 34.45 1iim h ILE 240 CO 0.04 0.22 0.22 0.00 -0.69 0.00 0.00 178.15 177.94 1iim h ALA 241 N 1.23 0.54 0.03 1.87 0.00 -0.84 -1.41 119.26 120.68 1iim h ALA 241 Ca 0.26 0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.21 1iim h ALA 241 Cb -0.02 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 1iim h ALA 241 CO -0.05 -0.14 -0.14 1.15 0.00 0.00 0.00 179.25 180.08 1iim h THR 242 N 0.44 0.67 0.06 0.00 2.02 -1.03 -0.04 112.91 115.03 1iim h THR 242 Ca 0.19 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.39 1iim h THR 242 Cb 0.09 0.67 -0.03 0.00 -1.74 0.00 0.00 68.15 67.13 1iim h THR 242 CO -0.13 0.00 -0.22 0.40 0.37 0.00 0.00 175.52 175.94 1iim h ILE 243 N -0.25 0.49 -0.67 3.11 2.04 -1.26 -2.16 117.51 118.82 1iim h ILE 243 Ca 0.04 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.84 1iim h ILE 243 Cb 0.29 0.49 -0.03 0.00 -0.74 0.00 0.00 36.82 36.84 1iim h ILE 243 CO -0.11 0.00 0.18 -0.33 0.00 0.00 0.00 178.15 177.88 1iim h GLU 244 N -0.39 1.06 -0.63 2.37 5.08 -1.13 -0.31 114.58 120.63 1iim h GLU 244 Ca 0.04 -0.25 -0.03 0.00 -1.00 0.00 0.00 59.36 58.13 1iim h GLU 244 Cb 0.44 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.51 1iim h GLU 244 CO -0.16 0.94 0.27 0.93 -1.00 0.00 0.00 179.01 179.99 1iim h GLU 245 N 0.98 0.93 -0.00 2.33 4.39 -0.95 0.12 114.58 122.38 1iim h GLU 245 Ca 0.21 -0.16 -0.00 0.00 0.34 0.00 0.00 59.36 59.75 1iim h GLU 245 Cb 0.34 -0.16 -0.00 0.00 -0.10 0.00 0.00 28.75 28.84 1iim h GLU 245 CO -0.00 0.77 -0.00 -0.09 -1.16 0.00 0.00 179.01 178.53 1iim h ARG 246 N 0.88 0.00 0.00 2.33 9.65 -1.19 -3.33 114.38 122.72 1iim h ARG 246 Ca 0.21 -0.00 -0.13 0.00 -1.10 0.00 0.00 59.98 58.96 1iim h ARG 246 Cb 0.17 -0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 28.73 1iim h ARG 246 CO -0.02 0.33 -0.68 1.96 2.80 0.00 0.00 179.97 184.35 1iim h GLN 247 N -0.32 0.00 -0.31 0.20 4.20 -0.98 -3.47 115.11 114.43 1iim h GLN 247 Ca 0.00 0.00 -0.13 0.00 0.06 0.00 0.00 58.65 58.58 1iim h GLN 247 Cb 0.32 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.05 1iim h GLN 247 CO 0.00 0.59 -0.12 0.41 -0.67 0.00 0.00 178.83 179.04 1iim n GLY 248 N 1.27 0.88 3.21 3.46 0.00 0.40 -5.00 105.19 109.41 1iim n GLY 248 Ca 0.01 -0.67 -0.25 0.00 0.00 0.00 0.00 46.02 45.11 1iim n GLY 248 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1iim s LEU 249 N -1.49 2.12 0.02 0.99 1.43 -1.24 -5.08 118.68 115.43 1iim s LEU 249 Ca 0.00 -0.45 -0.13 0.00 -1.03 0.00 0.00 54.13 52.51 1iim s LEU 249 Cb 0.00 -0.92 -0.06 0.00 0.03 0.00 0.00 46.19 45.24 1iim s LEU 249 CO 0.00 0.17 0.40 -0.54 0.23 0.00 0.00 176.35 176.61 1iim s LYS 250 N -0.93 3.87 -0.13 1.70 1.02 -1.26 -4.21 119.74 119.79 1iim s LYS 250 Ca 0.07 0.34 -0.21 0.00 0.02 0.00 0.00 55.97 56.18 1iim s LYS 250 Cb -0.08 -3.16 -0.03 0.00 -0.52 0.00 0.00 37.83 34.04 1iim s LYS 250 CO 0.01 0.66 0.63 0.08 -0.92 0.00 0.00 175.35 175.81 1iim s VAL 251 N -1.16 5.06 -1.21 3.17 1.01 -1.26 -4.35 120.40 121.66 1iim s VAL 251 Ca 0.26 1.24 -0.01 0.00 0.00 0.00 0.00 61.98 63.47 1iim s VAL 251 Cb -0.16 -3.96 -0.01 0.00 0.00 0.00 0.00 36.38 32.26 1iim s VAL 251 CO 0.14 0.20 0.90 -1.20 0.00 0.00 0.00 175.10 175.15 1iim n SER 252 N 4.33 -2.36 -4.51 3.32 7.64 -1.26 -4.97 113.62 115.80 1iim n SER 252 Ca -0.02 -0.70 -0.43 0.00 1.01 0.00 0.00 58.87 58.73 1iim n SER 252 Cb 0.51 -4.80 -0.07 0.00 -1.01 0.00 0.00 64.21 58.84 1iim n SER 252 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1iim h PRO 254 N 8.84 0.48 -0.52 0.00 0.11 -1.93 -0.82 132.00 138.16 1iim h PRO 254 Ca -0.26 -0.03 0.02 0.00 0.11 0.00 0.00 66.00 65.85 1iim h PRO 254 Cb 1.10 -0.11 -0.03 0.00 0.11 0.00 0.00 31.00 32.07 1iim h PRO 254 CO 0.87 0.32 0.31 0.93 -0.21 0.00 0.00 178.00 180.21 1iim h GLU 255 N 0.50 0.60 -0.37 1.05 3.07 -1.97 0.82 114.58 118.27 1iim h GLU 255 Ca 0.32 -0.04 -0.04 0.00 -0.50 0.00 0.00 59.36 59.11 1iim h GLU 255 Cb 0.36 -0.14 -0.02 0.00 -0.84 0.00 0.00 28.75 28.12 1iim h GLU 255 CO -0.28 0.40 0.09 1.49 -1.40 0.00 0.00 179.01 179.31 1iim h GLU 256 N 0.62 0.59 -0.62 2.33 4.81 -1.83 -1.59 114.58 118.88 1iim h GLU 256 Ca 0.21 -0.14 -0.07 0.00 -0.13 0.00 0.00 59.36 59.23 1iim h GLU 256 Cb 0.02 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.30 1iim h GLU 256 CO -0.10 0.62 0.13 0.82 -0.73 0.00 0.00 179.01 179.75 1iim h ILE 257 N 0.44 1.26 -0.91 2.32 2.04 -0.87 0.19 117.51 121.99 1iim h ILE 257 Ca 0.12 -0.97 0.01 0.00 1.00 0.00 0.00 64.86 65.02 1iim h ILE 257 Cb 0.30 0.68 -0.05 0.00 -0.74 0.00 0.00 36.82 37.02 1iim h ILE 257 CO 0.00 0.36 0.60 0.00 0.00 0.00 0.00 178.15 179.11 1iim h ALA 258 N 1.04 1.15 0.02 1.87 0.00 -0.73 -0.59 119.26 122.02 1iim h ALA 258 Ca 0.19 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 1iim h ALA 258 Cb 0.39 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1iim h ALA 258 CO 0.01 0.55 -0.01 0.35 0.00 0.00 0.00 179.25 180.15 1iim h PHE 259 N 1.23 -0.02 0.00 0.00 3.57 -0.82 0.30 116.94 121.19 1iim h PHE 259 Ca 0.33 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.81 1iim h PHE 259 Cb -0.14 0.01 -0.00 0.00 2.79 0.00 0.00 35.95 38.61 1iim h PHE 259 CO -0.01 0.32 -0.12 0.00 -2.23 0.00 0.00 178.31 176.26 1iim h ARG 260 N -0.37 0.00 -0.67 1.11 3.08 -0.74 -1.73 114.38 115.06 1iim h ARG 260 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1iim h ARG 260 Cb 0.35 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.40 1iim h ARG 260 CO 0.00 0.12 0.00 1.63 -1.07 0.00 0.00 179.97 180.66 1iim n LYS 261 N -3.56 2.88 -2.20 0.04 5.02 -0.25 -4.95 118.16 115.14 1iim n LYS 261 Ca -0.01 -2.51 -0.20 0.00 -2.02 0.00 0.00 58.31 53.57 1iim n LYS 261 Cb 0.26 -1.63 -0.03 0.00 -0.02 0.00 0.00 35.03 33.61 1iim n LYS 261 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1iim n ASN 262 N 1.35 -5.63 0.07 4.39 3.02 -0.65 -4.86 115.26 112.94 1iim n ASN 262 Ca 0.23 0.09 -0.06 0.00 -0.03 0.00 0.00 54.58 54.81 1iim n ASN 262 Cb 0.66 -4.71 0.11 0.00 -0.61 0.00 0.00 39.78 35.23 1iim n ASN 262 CO 0.00 0.00 0.00 -0.26 -2.62 0.00 0.00 177.26 174.38 1iim h PHE 263 N 0.00 0.39 -4.04 3.10 0.05 -0.64 -3.45 116.94 112.35 1iim h PHE 263 Ca -0.46 -0.15 -0.18 0.00 3.82 0.00 0.00 57.97 61.01 1iim h PHE 263 Cb 1.34 -0.07 -0.17 0.00 2.00 0.00 0.00 35.95 39.05 1iim h PHE 263 CO 0.54 0.82 -0.69 0.96 -0.18 0.00 0.00 178.31 179.75 1iim s ILE 264 N -3.80 0.38 0.49 -0.55 -4.36 -1.12 -4.47 121.20 107.77 1iim s ILE 264 Ca -0.05 -1.61 0.07 0.00 -0.26 0.00 0.00 60.65 58.80 1iim s ILE 264 Cb 0.12 -1.26 0.07 0.00 1.25 0.00 0.00 42.46 42.64 1iim s ILE 264 CO 0.81 -0.81 0.56 0.59 0.24 0.00 0.00 174.94 176.33 1iim n ASN 265 N 0.47 2.09 -0.29 4.36 4.13 -1.26 -4.37 115.26 120.39 1iim n ASN 265 Ca -0.16 -2.45 0.03 0.00 1.68 0.00 0.00 54.58 53.68 1iim n ASN 265 Cb 0.59 -0.24 0.17 0.00 -1.54 0.00 0.00 39.78 38.76 1iim n ASN 265 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1iim h ALA 266 N 0.37 1.19 -0.72 5.41 0.00 -2.00 -2.73 119.26 120.77 1iim h ALA 266 Ca -0.26 0.04 0.05 0.00 0.00 0.00 0.00 54.91 54.74 1iim h ALA 266 Cb 1.09 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.70 1iim h ALA 266 CO 0.39 0.09 0.43 1.96 0.00 0.00 0.00 179.25 182.11 1iim h GLN 267 N 0.78 0.78 -0.76 0.00 7.50 -1.99 0.77 115.11 122.19 1iim h GLN 267 Ca 0.40 -0.05 -0.03 0.00 0.50 0.00 0.00 58.65 59.47 1iim h GLN 267 Cb 0.38 -0.18 -0.03 0.00 0.05 0.00 0.00 27.48 27.70 1iim h GLN 267 CO -0.25 0.51 0.35 1.96 -1.50 0.00 0.00 178.83 179.90 1iim h GLN 268 N 0.80 1.10 -0.11 1.46 4.20 -1.89 0.71 115.11 121.38 1iim h GLN 268 Ca 0.31 -0.17 -0.01 0.00 0.06 0.00 0.00 58.65 58.84 1iim h GLN 268 Cb 0.13 -0.19 -0.00 0.00 0.30 0.00 0.00 27.48 27.72 1iim h GLN 268 CO -0.16 0.87 0.04 0.28 -0.67 0.00 0.00 178.83 179.19 1iim h VAL 269 N 1.08 1.15 -0.81 -0.54 2.07 -1.15 -0.86 116.25 117.18 1iim h VAL 269 Ca 0.26 -0.46 0.09 0.00 0.82 0.00 0.00 66.70 67.40 1iim h VAL 269 Cb 0.14 1.26 -0.07 0.00 -1.52 0.00 0.00 31.29 31.10 1iim h VAL 269 CO -0.03 0.14 0.47 0.40 0.02 0.00 0.00 177.57 178.56 1iim h ILE 270 N 0.01 0.93 -0.42 4.57 2.04 -0.49 0.15 117.51 124.30 1iim h ILE 270 Ca 0.04 -0.27 -0.08 0.00 1.00 0.00 0.00 64.86 65.54 1iim h ILE 270 Cb 0.18 0.06 -0.02 0.00 -0.74 0.00 0.00 36.82 36.30 1iim h ILE 270 CO -0.00 0.15 -0.06 -0.33 0.00 0.00 0.00 178.15 177.90 1iim h GLU 271 N 0.80 0.72 -0.17 2.37 5.08 -0.55 -2.02 114.58 120.80 1iim h GLU 271 Ca 0.38 -0.21 -0.20 0.00 -1.00 0.00 0.00 59.36 58.34 1iim h GLU 271 Cb 0.32 -0.08 0.01 0.00 0.50 0.00 0.00 28.75 29.50 1iim h GLU 271 CO -0.23 0.77 -0.66 -0.07 -1.00 0.00 0.00 179.01 177.82 1iim h LEU 272 N 0.66 0.87 -0.57 1.33 3.38 -0.31 -3.33 115.31 117.34 1iim h LEU 272 Ca 0.12 -0.61 -0.12 0.00 0.09 0.00 0.00 57.88 57.37 1iim h LEU 272 Cb 0.50 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 1iim h LEU 272 CO 0.03 1.34 -0.12 0.00 0.09 0.00 0.00 178.44 179.77 1iim h ALA 273 N 0.56 0.77 -0.09 1.53 0.00 -0.60 -3.37 119.26 118.06 1iim h ALA 273 Ca -0.03 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1iim h ALA 273 Cb 1.29 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1iim h ALA 273 CO 0.14 0.67 0.00 0.41 0.00 0.00 0.00 179.25 180.47 1iim n GLY 274 N -0.26 -2.87 0.00 0.00 0.00 -0.77 0.20 105.19 101.49 1iim n GLY 274 Ca 0.01 0.54 0.01 0.00 0.00 0.00 0.00 46.02 46.59 1iim n GLY 274 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1iim n PRO 275 N -2.85 0.04 0.00 1.61 -0.04 -1.26 -1.62 135.00 130.89 1iim n PRO 275 Ca 0.00 0.25 0.04 0.00 -0.04 0.00 0.00 63.50 63.76 1iim n PRO 275 Cb 0.00 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 31.91 1iim n PRO 275 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1iim n LEU 276 N -1.28 0.45 0.08 1.53 4.77 0.50 -4.63 117.00 118.42 1iim n LEU 276 Ca 0.01 -0.51 0.04 0.00 -0.03 0.00 0.00 56.01 55.53 1iim n LEU 276 Cb 0.02 0.00 0.23 0.00 -2.33 0.00 0.00 43.42 41.34 1iim n LEU 276 CO 0.02 0.11 0.65 -1.54 -1.33 0.00 0.00 177.39 175.30 1iim n SER 277 N -1.18 0.22 0.19 -1.43 3.41 0.13 -0.87 113.62 114.09 1iim n SER 277 Ca 0.02 0.54 0.07 0.00 -0.26 0.00 0.00 58.87 59.24 1iim n SER 277 Cb 0.14 -0.55 0.33 0.00 -0.26 0.00 0.00 64.21 63.87 1iim n SER 277 CO 0.00 0.00 0.00 0.07 -0.16 0.00 0.00 175.04 174.95 1iim h LYS 278 N 0.00 0.00 -6.06 4.33 2.10 -1.82 -3.39 116.57 111.73 1iim h LYS 278 Ca 0.00 0.00 -0.52 0.00 -2.00 0.00 0.00 60.65 58.13 1iim h LYS 278 Cb 0.19 0.00 -0.05 0.00 -0.90 0.00 0.00 32.23 31.47 1iim h LYS 278 CO 0.00 0.32 -0.42 0.54 -2.00 0.00 0.00 179.45 177.90 1iim s ASN 279 N -6.33 4.80 0.50 7.07 4.22 -0.05 -5.03 114.94 120.12 1iim s ASN 279 Ca 0.01 -0.90 0.21 0.00 -2.14 0.00 0.00 52.86 50.05 1iim s ASN 279 Cb 0.10 -0.48 1.30 0.00 1.28 0.00 0.00 41.25 43.45 1iim s ASN 279 CO 0.67 -0.64 2.07 -0.78 -2.04 0.00 0.00 177.10 176.39 1iim h ASP 280 N 1.15 0.00 -0.38 3.54 -0.00 -1.87 -2.72 116.42 116.14 1iim h ASP 280 Ca -0.42 0.00 -0.02 0.00 -0.00 0.00 0.00 57.03 56.59 1iim h ASP 280 Cb 1.26 0.00 -0.02 0.00 -0.00 0.00 0.00 39.33 40.58 1iim h ASP 280 CO 0.62 0.12 0.16 0.22 -0.00 0.00 0.00 179.24 180.36 1iim h TYR 281 N 0.00 0.58 -0.15 0.28 3.20 -1.95 0.22 116.97 119.14 1iim h TYR 281 Ca -0.00 -0.04 -0.00 0.00 3.14 0.00 0.00 58.73 61.83 1iim h TYR 281 Cb 0.25 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.34 1iim h TYR 281 CO 0.00 0.51 0.08 0.78 -1.64 0.00 0.00 178.16 177.89 1iim h GLY 282 N 0.48 0.23 0.82 1.82 0.00 -1.39 -1.98 103.07 103.05 1iim h GLY 282 Ca 0.13 -0.11 0.05 0.00 0.00 0.00 0.00 47.33 47.40 1iim h GLY 282 CO -0.01 0.10 0.64 0.50 0.00 0.00 0.00 176.54 177.77 1iim h LYS 283 N 0.14 1.16 -0.17 4.80 1.57 -1.27 -1.29 116.57 121.50 1iim h LYS 283 Ca 0.05 -0.07 0.02 0.00 -1.87 0.00 0.00 60.65 58.78 1iim h LYS 283 Cb 0.09 -0.26 -0.02 0.00 0.08 0.00 0.00 32.23 32.12 1iim h LYS 283 CO -0.01 0.76 0.04 -0.92 -0.57 0.00 0.00 179.45 178.75 1iim h TYR 284 N 1.19 0.06 -0.39 -1.35 3.20 -0.12 -0.85 116.97 118.72 1iim h TYR 284 Ca 0.41 0.01 -0.06 0.00 3.14 0.00 0.00 58.73 62.23 1iim h TYR 284 Cb 0.10 -0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.35 1iim h TYR 284 CO -0.00 0.02 0.00 -0.07 -1.64 0.00 0.00 178.16 176.47 1iim h LEU 285 N 0.11 0.57 -0.25 2.82 3.38 -0.63 -1.80 115.31 119.51 1iim h LEU 285 Ca 0.08 -0.12 -0.20 0.00 0.09 0.00 0.00 57.88 57.73 1iim h LEU 285 Cb 0.07 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.67 1iim h LEU 285 CO -0.10 0.64 -0.62 -0.07 0.09 0.00 0.00 178.44 178.39 1iim h LEU 286 N 0.58 0.98 -1.13 1.67 3.38 -1.02 -2.88 115.31 116.90 1iim h LEU 286 Ca 0.12 -0.56 0.00 0.00 0.09 0.00 0.00 57.88 57.53 1iim h LEU 286 Cb 0.37 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.79 1iim h LEU 286 CO 0.01 1.37 0.53 0.50 0.09 0.00 0.00 178.44 180.94 1iim h LYS 287 N 0.64 1.12 -0.68 1.13 3.64 -0.90 -2.42 116.57 119.10 1iim h LYS 287 Ca -0.01 -0.08 0.09 0.00 -1.27 0.00 0.00 60.65 59.38 1iim h LYS 287 Cb 1.24 -0.25 -0.07 0.00 -0.41 0.00 0.00 32.23 32.74 1iim h LYS 287 CO 0.14 0.76 0.34 1.98 -2.27 0.00 0.00 179.45 180.40 1iim h MET 288 N 1.15 0.57 -0.02 1.90 4.05 -1.12 -3.52 114.93 117.95 1iim h MET 288 Ca 0.31 -0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.69 1iim h MET 288 Cb -0.09 -0.13 0.00 0.00 -0.80 0.00 0.00 31.60 30.58 1iim h MET 288 CO -0.06 0.38 0.00 1.33 0.23 0.00 0.00 176.91 178.79