#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1kfi n VAL 4 N 0.00-13.35 -2.45 5.09 0.31 -1.26 -4.92 118.33 101.76 1kfi n VAL 4 Ca 0.00 3.06 -0.41 0.00 -0.01 0.00 0.00 64.34 66.98 1kfi n VAL 4 Cb 0.00 -6.31 -0.04 0.00 -0.91 0.00 0.00 33.84 26.59 1kfi n VAL 4 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1kfi s ILE 5 N -0.63 3.64 1.08 2.52 1.01 0.17 -4.94 121.20 124.06 1kfi s ILE 5 Ca -0.11 1.46 -0.13 0.00 0.00 0.00 0.00 60.65 61.87 1kfi s ILE 5 Cb 0.01 -3.93 0.23 0.00 0.01 0.00 0.00 42.46 38.78 1kfi s ILE 5 CO 0.30 0.27 1.07 -2.84 0.00 0.00 0.00 174.94 173.75 1kfi s PRO 6 N -0.62 -0.25 0.58 2.79 0.02 -1.26 -1.67 135.00 134.59 1kfi s PRO 6 Ca 0.49 0.50 -0.18 0.00 0.02 0.00 0.00 61.00 61.83 1kfi s PRO 6 Cb -0.31 -1.66 -0.04 0.00 0.02 0.00 0.00 34.50 32.51 1kfi s PRO 6 CO 0.37 -3.18 1.13 0.00 -0.33 0.00 0.00 177.00 175.00 1kfi s ALA 7 N -2.83 2.62 0.53 -1.55 0.00 -1.25 -4.17 121.76 115.11 1kfi s ALA 7 Ca 0.67 0.78 -0.22 0.00 0.00 0.00 0.00 51.96 53.19 1kfi s ALA 7 Cb -0.19 -3.36 -0.05 0.00 0.00 0.00 0.00 23.12 19.51 1kfi s ALA 7 CO 0.59 -0.95 1.38 -2.14 0.00 0.00 0.00 175.76 174.64 1kfi s PRO 8 N -3.49 3.23 -0.03 0.00 0.02 -1.26 -4.76 135.00 128.72 1kfi s PRO 8 Ca 0.72 2.29 0.08 0.00 0.02 0.00 0.00 61.00 64.10 1kfi s PRO 8 Cb -0.24 -2.33 -0.02 0.00 0.02 0.00 0.00 34.50 31.93 1kfi s PRO 8 CO 0.31 -1.14 -0.26 0.50 -0.33 0.00 0.00 177.00 176.09 1kfi s ARG 9 N -2.82 2.18 0.30 5.54 3.52 0.10 -4.97 118.95 122.80 1kfi s ARG 9 Ca 0.70 -0.92 -0.28 0.00 -0.13 0.00 0.00 55.73 55.11 1kfi s ARG 9 Cb -0.41 -2.04 -0.09 0.00 -1.56 0.00 0.00 34.95 30.84 1kfi s ARG 9 CO 0.50 0.52 0.98 0.08 -0.81 0.00 0.00 175.30 176.56 1kfi s VAL 10 N -0.51 4.00 -0.18 7.11 1.01 -1.26 -1.69 120.40 128.89 1kfi s VAL 10 Ca 0.07 1.81 -0.02 0.00 0.00 0.00 0.00 61.98 63.83 1kfi s VAL 10 Cb -0.11 -4.07 0.05 0.00 0.00 0.00 0.00 36.38 32.26 1kfi s VAL 10 CO -0.00 0.27 0.03 -1.58 0.00 0.00 0.00 175.10 173.82 1kfi s GLN 11 N -1.74 0.70 0.45 2.72 2.00 -0.44 -4.94 119.66 118.41 1kfi s GLN 11 Ca 0.47 -0.37 -0.25 0.00 -2.00 0.00 0.00 55.36 53.22 1kfi s GLN 11 Cb -0.23 -1.97 -0.08 0.00 0.80 0.00 0.00 33.01 31.53 1kfi s GLN 11 CO 0.29 -0.59 1.36 0.08 -0.50 0.00 0.00 175.29 175.94 1kfi s VAL 12 N 1.86 2.31 0.07 1.34 1.01 -1.26 -1.21 120.40 124.52 1kfi s VAL 12 Ca -0.00 0.27 -0.14 0.00 0.00 0.00 0.00 61.98 62.11 1kfi s VAL 12 Cb -0.16 -3.16 0.02 0.00 0.00 0.00 0.00 36.38 33.08 1kfi s VAL 12 CO -0.08 0.03 0.31 0.28 0.00 0.00 0.00 175.10 175.65 1kfi s THR 13 N -1.25 0.09 -0.13 3.92 -1.32 0.17 -4.86 115.64 112.26 1kfi s THR 13 Ca 0.61 -0.74 -0.05 0.00 -1.21 0.00 0.00 61.69 60.31 1kfi s THR 13 Cb -0.41 -1.08 -0.04 0.00 -1.51 0.00 0.00 72.50 69.47 1kfi s THR 13 CO 0.52 -0.41 0.04 -1.58 -2.21 0.00 0.00 174.62 170.97 1kfi s GLN 14 N -3.15 3.48 0.80 7.08 0.74 -1.26 -4.08 119.66 123.28 1kfi s GLN 14 Ca -0.01 -0.36 -0.14 0.00 0.05 0.00 0.00 55.36 54.90 1kfi s GLN 14 Cb 0.01 -3.01 0.05 0.00 1.10 0.00 0.00 33.01 31.16 1kfi s GLN 14 CO -0.07 0.51 1.00 -2.30 -0.55 0.00 0.00 175.29 173.88 1kfi n PRO 15 N 2.78 0.20 -4.93 1.67 -0.02 -1.22 -5.01 135.00 128.47 1kfi n PRO 15 Ca -0.18 0.14 -0.31 0.00 -2.02 0.00 0.00 63.50 61.12 1kfi n PRO 15 Cb 0.53 -2.27 -0.17 0.00 -0.02 0.00 0.00 33.50 31.57 1kfi n PRO 15 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 1kfi s TYR 16 N -2.08 2.45 0.73 6.00 2.02 -1.25 -5.08 117.35 120.15 1kfi s TYR 16 Ca 0.71 -1.09 -0.12 0.00 -0.37 0.00 0.00 57.07 56.21 1kfi s TYR 16 Cb -0.30 -1.66 0.03 0.00 -0.40 0.00 0.00 41.96 39.63 1kfi s TYR 16 CO 0.53 -0.47 1.12 0.00 -1.57 0.00 0.00 175.55 175.16 1kfi s ALA 17 N 0.57 2.80 0.00 3.71 0.00 -1.26 -4.10 121.76 123.48 1kfi s ALA 17 Ca -0.14 -0.41 0.00 0.00 0.00 0.00 0.00 51.96 51.42 1kfi s ALA 17 Cb -0.17 -3.02 0.00 0.00 0.00 0.00 0.00 23.12 19.94 1kfi s ALA 17 CO 0.04 -1.30 0.00 0.41 0.00 0.00 0.00 175.76 174.92 1kfi n GLY 18 N -3.03 1.91 2.11 0.00 0.00 -1.26 -4.91 105.19 100.02 1kfi n GLY 18 Ca 0.07 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.93 1kfi n GLY 18 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1kfi n GLN 19 N -2.00 2.14 -3.58 1.61 6.02 -1.26 -4.83 117.38 115.48 1kfi n GLN 19 Ca 0.00 -1.14 -0.41 0.00 -0.01 0.00 0.00 57.00 55.44 1kfi n GLN 19 Cb 0.00 -2.11 -0.11 0.00 1.02 0.00 0.00 30.24 29.04 1kfi n GLN 19 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 1kfi s LYS 20 N 1.44 2.99 0.39 -1.09 2.20 -1.26 -4.56 119.74 119.85 1kfi s LYS 20 Ca 0.61 -0.97 -0.27 0.00 -0.36 0.00 0.00 55.97 54.98 1kfi s LYS 20 Cb 0.26 -3.75 -0.11 0.00 -1.51 0.00 0.00 37.83 32.73 1kfi s LYS 20 CO -0.01 -0.64 1.35 -2.30 -0.36 0.00 0.00 175.35 173.39 1kfi n PRO 21 N 5.03 2.20 -0.06 4.03 -0.02 -1.26 -4.83 135.00 140.09 1kfi n PRO 21 Ca -0.12 0.78 0.00 0.00 -2.02 0.00 0.00 63.50 62.14 1kfi n PRO 21 Cb 0.47 -2.47 0.00 0.00 -0.02 0.00 0.00 33.50 31.48 1kfi n PRO 21 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1kfi n GLY 22 N 0.68 -0.76 0.22 -1.23 0.00 0.33 -4.84 105.19 99.60 1kfi n GLY 22 Ca 0.05 -1.70 0.15 0.00 0.00 0.00 0.00 46.02 44.52 1kfi n GLY 22 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1kfi h THR 23 N -0.65 0.00 -0.21 2.61 1.35 -0.69 -2.89 112.91 112.42 1kfi h THR 23 Ca 0.00 -0.26 -0.18 0.00 -0.55 0.00 0.00 66.41 65.42 1kfi h THR 23 Cb 0.00 1.09 -0.19 0.00 -1.73 0.00 0.00 68.15 67.31 1kfi h THR 23 CO 0.00 0.00 -0.71 -1.54 -0.25 0.00 0.00 175.52 173.02 1kfi n SER 24 N -2.67 2.36 0.00 5.36 3.41 -1.26 -4.92 113.62 115.90 1kfi n SER 24 Ca 0.00 -3.43 0.00 0.00 -0.26 0.00 0.00 58.87 55.18 1kfi n SER 24 Cb 0.20 -0.44 0.00 0.00 -0.26 0.00 0.00 64.21 63.71 1kfi n SER 24 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1kfi n GLY 25 N -0.73 0.78 3.72 5.00 0.00 -1.09 -4.84 105.19 108.04 1kfi n GLY 25 Ca 0.22 -2.08 -0.41 0.00 0.00 0.00 0.00 46.02 43.74 1kfi n GLY 25 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1kfi s LEU 26 N 0.00 4.41 -0.03 0.99 2.96 -0.38 -0.51 118.68 126.11 1kfi s LEU 26 Ca 0.00 1.62 -0.00 0.00 -0.22 0.00 0.00 54.13 55.52 1kfi s LEU 26 Cb 0.00 -3.48 0.03 0.00 0.50 0.00 0.00 46.19 43.24 1kfi s LEU 26 CO 0.00 -0.16 0.02 -0.13 -1.32 0.00 0.00 176.35 174.76 1kfi s ARG 27 N 0.60 0.22 0.12 1.98 0.52 -1.26 -0.85 118.95 120.27 1kfi s ARG 27 Ca 0.47 0.15 -0.06 0.00 -0.52 0.00 0.00 55.73 55.78 1kfi s ARG 27 Cb -0.21 -0.51 -0.02 0.00 0.52 0.00 0.00 34.95 34.73 1kfi s ARG 27 CO 0.27 -0.19 0.15 0.15 0.02 0.00 0.00 175.30 175.69 1kfi s LYS 28 N 1.34 0.92 0.48 3.54 -0.14 -0.34 -4.98 119.74 120.57 1kfi s LYS 28 Ca -0.05 -1.19 -0.22 0.00 -1.36 0.00 0.00 55.97 53.15 1kfi s LYS 28 Cb -0.13 0.31 -0.07 0.00 -1.68 0.00 0.00 37.83 36.25 1kfi s LYS 28 CO -0.03 -0.29 1.11 0.21 -0.76 0.00 0.00 175.35 175.60 1kfi s LYS 29 N -3.95 3.73 0.45 1.68 2.20 -1.26 0.11 119.74 122.70 1kfi s LYS 29 Ca 0.14 1.60 0.20 0.00 -0.36 0.00 0.00 55.97 57.55 1kfi s LYS 29 Cb 0.06 -2.26 1.17 0.00 -1.51 0.00 0.00 37.83 35.28 1kfi s LYS 29 CO -0.04 -0.54 1.89 0.28 -0.36 0.00 0.00 175.35 176.58 1kfi h VAL 30 N 1.68 0.69 -0.46 4.02 2.07 -1.56 0.42 116.25 123.11 1kfi h VAL 30 Ca -0.49 -0.11 0.09 0.00 0.82 0.00 0.00 66.70 67.01 1kfi h VAL 30 Cb 1.24 0.35 -0.07 0.00 -1.52 0.00 0.00 31.29 31.29 1kfi h VAL 30 CO 0.59 0.06 0.01 0.28 0.02 0.00 0.00 177.57 178.53 1kfi h SER 31 N 0.31 -0.17 0.88 0.57 0.02 -1.83 -1.39 113.55 111.93 1kfi h SER 31 Ca 0.42 0.11 -0.23 0.00 -0.84 0.00 0.00 61.79 61.25 1kfi h SER 31 Cb 1.16 0.19 -0.03 0.00 0.14 0.00 0.00 62.40 63.86 1kfi h SER 31 CO -0.12 -0.05 -1.14 -0.08 -1.14 0.00 0.00 176.83 174.30 1kfi h GLU 32 N 0.12 0.04 0.00 3.45 4.81 -1.35 -3.34 114.58 118.31 1kfi h GLU 32 Ca 0.23 -0.06 -0.07 0.00 -0.13 0.00 0.00 59.36 59.33 1kfi h GLU 32 Cb 0.34 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.73 1kfi h GLU 32 CO -0.38 0.96 -0.34 0.00 -0.73 0.00 0.00 179.01 178.53 1kfi h ALA 33 N 0.94 1.01 -0.24 2.92 0.00 -0.66 -3.03 119.26 120.19 1kfi h ALA 33 Ca -0.07 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1kfi h ALA 33 Cb 1.83 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.57 1kfi h ALA 33 CO 0.13 0.42 0.00 0.25 0.00 0.00 0.00 179.25 180.05 1kfi n THR 34 N -3.51 0.31 -1.85 0.00 -2.24 -0.56 -3.92 114.28 102.51 1kfi n THR 34 Ca -0.00 -0.43 -0.38 0.00 -2.27 0.00 0.00 64.05 60.97 1kfi n THR 34 Cb 0.49 0.42 0.03 0.00 -2.10 0.00 0.00 70.33 69.17 1kfi n THR 34 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1kfi s GLN 35 N -1.69 3.21 -0.15 -0.78 -0.21 -1.15 -4.85 119.66 114.04 1kfi s GLN 35 Ca 0.32 2.16 -0.39 0.00 0.02 0.00 0.00 55.36 57.47 1kfi s GLN 35 Cb 0.17 -2.26 -0.16 0.00 1.00 0.00 0.00 33.01 31.76 1kfi s GLN 35 CO 0.25 -1.11 1.61 -2.30 -2.12 0.00 0.00 175.29 171.62 1kfi n PRO 36 N -0.98 1.16 -0.73 2.91 -0.02 -1.26 -1.01 135.00 135.07 1kfi n PRO 36 Ca 0.10 0.42 0.00 0.00 -2.02 0.00 0.00 63.50 62.01 1kfi n PRO 36 Cb 0.46 -2.10 0.00 0.00 -0.02 0.00 0.00 33.50 31.84 1kfi n PRO 36 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1kfi n ASN 37 N 4.44 -0.43 0.38 2.55 5.03 -1.26 -4.87 115.26 121.10 1kfi n ASN 37 Ca 0.24 0.00 -0.18 0.00 0.87 0.00 0.00 54.58 55.50 1kfi n ASN 37 Cb 0.15 -1.53 -0.09 0.00 -1.02 0.00 0.00 39.78 37.29 1kfi n ASN 37 CO 0.00 0.00 0.00 0.22 -1.83 0.00 0.00 177.26 175.65 1kfi h TYR 38 N 0.00 -1.06 0.20 3.10 3.20 -1.35 0.36 116.97 121.43 1kfi h TYR 38 Ca 0.00 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.85 1kfi h TYR 38 Cb 0.05 0.37 -0.01 0.00 1.54 0.00 0.00 36.73 38.69 1kfi h TYR 38 CO 0.03 -0.61 -0.16 1.25 -1.64 0.00 0.00 178.16 177.03 1kfi h LEU 39 N -1.02 -0.41 -1.00 2.82 5.85 -1.76 -2.92 115.31 116.88 1kfi h LEU 39 Ca -0.09 0.03 0.12 0.00 0.84 0.00 0.00 57.88 58.78 1kfi h LEU 39 Cb 0.81 0.13 -0.08 0.00 0.37 0.00 0.00 40.66 41.89 1kfi h LEU 39 CO 0.10 -0.25 0.63 -0.33 -0.34 0.00 0.00 178.44 178.26 1kfi h GLU 40 N -0.37 0.97 -0.43 1.25 3.07 -1.92 -0.95 114.58 116.20 1kfi h GLU 40 Ca -0.01 -0.06 0.04 0.00 -0.50 0.00 0.00 59.36 58.83 1kfi h GLU 40 Cb 0.33 -0.22 -0.04 0.00 -0.84 0.00 0.00 28.75 27.98 1kfi h GLU 40 CO -0.01 0.64 0.21 -0.91 -1.40 0.00 0.00 179.01 177.54 1kfi h ASN 41 N 1.00 0.29 -0.17 1.42 4.21 -0.73 0.10 115.58 121.69 1kfi h ASN 41 Ca 0.50 0.03 -0.08 0.00 1.21 0.00 0.00 56.30 57.95 1kfi h ASN 41 Cb 0.48 -0.03 -0.00 0.00 -1.12 0.00 0.00 38.32 37.65 1kfi h ASN 41 CO -0.26 0.21 -0.20 0.15 -1.29 0.00 0.00 177.43 176.03 1kfi h PHE 42 N 0.42 0.54 -0.58 1.19 3.57 -1.19 -1.71 116.94 119.17 1kfi h PHE 42 Ca 0.19 -0.17 0.01 0.00 3.53 0.00 0.00 57.97 61.53 1kfi h PHE 42 Cb 0.10 -0.11 -0.03 0.00 2.79 0.00 0.00 35.95 38.70 1kfi h PHE 42 CO -0.11 0.83 0.38 0.28 -2.23 0.00 0.00 178.31 177.46 1kfi h VAL 43 N 0.09 1.13 -0.70 1.41 2.07 -1.07 -1.15 116.25 118.03 1kfi h VAL 43 Ca 0.02 -0.26 -0.05 0.00 0.82 0.00 0.00 66.70 67.23 1kfi h VAL 43 Cb 0.76 0.30 -0.03 0.00 -1.52 0.00 0.00 31.29 30.79 1kfi h VAL 43 CO 0.05 0.14 0.23 -0.61 0.02 0.00 0.00 177.57 177.40 1kfi h GLN 44 N 0.76 1.07 0.00 1.57 5.75 -0.97 -1.70 115.11 121.60 1kfi h GLN 44 Ca 0.22 -0.21 -0.04 0.00 -0.15 0.00 0.00 58.65 58.46 1kfi h GLN 44 Cb -0.07 -0.16 -0.01 0.00 1.07 0.00 0.00 27.48 28.31 1kfi h GLN 44 CO -0.06 0.91 -0.19 0.77 -2.65 0.00 0.00 178.83 177.61 1kfi h SER 45 N 1.04 0.00 -0.26 -0.69 0.02 -0.62 0.23 113.55 113.27 1kfi h SER 45 Ca 0.23 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 61.10 1kfi h SER 45 Cb 0.27 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.81 1kfi h SER 45 CO -0.01 0.19 -0.17 0.40 -1.14 0.00 0.00 176.83 176.10 1kfi h ILE 46 N 0.00 1.31 -0.35 3.27 2.04 -0.35 -0.96 117.51 122.47 1kfi h ILE 46 Ca -0.00 -1.29 -0.08 0.00 1.00 0.00 0.00 64.86 64.49 1kfi h ILE 46 Cb 0.36 1.58 -0.02 0.00 -0.74 0.00 0.00 36.82 38.00 1kfi h ILE 46 CO 0.02 0.40 -0.11 -0.26 0.00 0.00 0.00 178.15 178.21 1kfi h PHE 47 N 0.30 0.65 0.00 1.37 0.05 -0.73 -2.48 116.94 116.10 1kfi h PHE 47 Ca 0.05 -0.10 -0.02 0.00 3.82 0.00 0.00 57.97 61.72 1kfi h PHE 47 Cb 0.70 -0.17 -0.00 0.00 2.00 0.00 0.00 35.95 38.47 1kfi h PHE 47 CO 0.07 0.69 -0.08 -0.91 -0.18 0.00 0.00 178.31 177.89 1kfi h ASN 48 N 0.55 0.00 1.93 2.17 2.35 -0.35 -2.80 115.58 119.44 1kfi h ASN 48 Ca 0.10 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.85 1kfi h ASN 48 Cb 0.52 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.89 1kfi h ASN 48 CO 0.03 0.08 0.00 0.74 -1.65 0.00 0.00 177.43 176.63 1kfi h THR 49 N 0.00 0.00 -4.02 2.81 2.02 -0.70 -3.45 112.91 109.58 1kfi h THR 49 Ca -0.00 -0.96 -0.47 0.00 0.77 0.00 0.00 66.41 65.75 1kfi h THR 49 Cb 0.72 1.96 -0.00 0.00 -1.74 0.00 0.00 68.15 69.09 1kfi h THR 49 CO 0.01 0.00 0.29 -0.76 0.37 0.00 0.00 175.52 175.43 1kfi s LEU 50 N -6.20 3.79 0.22 2.58 1.43 -1.06 -5.01 118.68 114.43 1kfi s LEU 50 Ca 0.07 1.50 -0.30 0.00 -1.03 0.00 0.00 54.13 54.36 1kfi s LEU 50 Cb 0.05 -4.39 -0.09 0.00 0.03 0.00 0.00 46.19 41.80 1kfi s LEU 50 CO 0.66 -0.45 1.29 -0.13 0.23 0.00 0.00 176.35 177.95 1kfi s ARG 51 N -3.66 4.40 0.43 1.70 3.00 -1.26 -4.90 118.95 118.66 1kfi s ARG 51 Ca 0.58 2.05 0.21 0.00 0.00 0.00 0.00 55.73 58.57 1kfi s ARG 51 Cb -0.10 -3.18 1.17 0.00 0.00 0.00 0.00 34.95 32.84 1kfi s ARG 51 CO 0.25 -0.21 1.83 1.57 0.00 0.00 0.00 175.30 178.73 1kfi h LYS 52 N 5.06 0.32 0.00 3.54 2.10 -1.92 0.13 116.57 125.80 1kfi h LYS 52 Ca -0.45 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.18 1kfi h LYS 52 Cb 1.22 -0.07 0.00 0.00 -0.90 0.00 0.00 32.23 32.47 1kfi h LYS 52 CO 0.75 0.21 0.00 0.38 -2.00 0.00 0.00 179.45 178.79 1kfi h ASP 53 N 0.33 0.00 1.06 7.07 3.04 -2.01 -2.74 116.42 123.17 1kfi h ASP 53 Ca 0.51 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 54.30 1kfi h ASP 53 Cb 1.41 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.70 1kfi h ASP 53 CO -0.18 0.00 0.00 -0.62 -2.04 0.00 0.00 179.24 176.40 1kfi n GLU 54 N -2.34 0.16 0.03 4.15 1.02 0.45 -3.26 120.64 120.85 1kfi n GLU 54 Ca 0.03 0.23 0.11 0.00 -0.02 0.00 0.00 57.16 57.51 1kfi n GLU 54 Cb 0.29 -1.72 -0.06 0.00 -0.02 0.00 0.00 31.44 29.92 1kfi n GLU 54 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1kfi n LEU 55 N -2.01 0.47 0.01 -4.62 4.77 -1.03 -4.49 117.00 110.10 1kfi n LEU 55 Ca 0.05 0.06 -0.19 0.00 -0.03 0.00 0.00 56.01 55.90 1kfi n LEU 55 Cb 0.33 -0.05 -0.10 0.00 -2.33 0.00 0.00 43.42 41.27 1kfi n LEU 55 CO 0.25 -0.02 0.18 0.11 -1.33 0.00 0.00 177.39 176.57 1kfi h LYS 56 N 0.00 0.67 -7.23 3.23 1.79 -1.65 -3.39 116.57 109.98 1kfi h LYS 56 Ca 0.00 -0.65 -0.48 0.00 -2.18 0.00 0.00 60.65 57.34 1kfi h LYS 56 Cb 0.89 0.17 0.19 0.00 -1.58 0.00 0.00 32.23 31.90 1kfi h LYS 56 CO 0.00 1.25 0.15 -2.14 -1.08 0.00 0.00 179.45 177.63 1kfi s PRO 57 N -3.45 0.36 -0.47 3.15 0.02 -1.26 -4.80 135.00 128.55 1kfi s PRO 57 Ca -0.11 1.16 -0.27 0.00 0.02 0.00 0.00 61.00 61.81 1kfi s PRO 57 Cb 0.07 -1.68 -0.05 0.00 0.02 0.00 0.00 34.50 32.86 1kfi s PRO 57 CO 0.89 -2.96 2.15 0.21 -0.33 0.00 0.00 177.00 176.97 1kfi s LYS 58 N -4.63 2.54 0.33 5.54 2.20 -1.26 -4.69 119.74 119.77 1kfi s LYS 58 Ca 0.67 1.28 0.10 0.00 -0.36 0.00 0.00 55.97 57.66 1kfi s LYS 58 Cb -0.23 -4.45 -0.06 0.00 -1.51 0.00 0.00 37.83 31.58 1kfi s LYS 58 CO 0.60 -2.79 -0.12 0.54 -0.36 0.00 0.00 175.35 173.22 1kfi s ASN 59 N 9.75 3.70 -0.11 1.43 6.03 -1.26 -4.84 114.94 129.64 1kfi s ASN 59 Ca 0.87 -1.15 0.02 0.00 -1.03 0.00 0.00 52.86 51.57 1kfi s ASN 59 Cb -0.19 -0.34 0.01 0.00 -3.03 0.00 0.00 41.25 37.71 1kfi s ASN 59 CO 0.27 -0.14 -0.15 -0.69 -2.03 0.00 0.00 177.10 174.36 1kfi s VAL 60 N -2.58 1.47 -0.22 3.54 1.01 -0.50 -0.99 120.40 122.13 1kfi s VAL 60 Ca 0.32 -0.63 -0.04 0.00 0.00 0.00 0.00 61.98 61.64 1kfi s VAL 60 Cb 0.00 -1.35 -0.01 0.00 0.00 0.00 0.00 36.38 35.03 1kfi s VAL 60 CO 0.16 0.44 -0.05 -0.22 0.00 0.00 0.00 175.10 175.43 1kfi s LEU 61 N 1.00 2.88 0.29 3.92 2.96 -0.18 -0.90 118.68 128.64 1kfi s LEU 61 Ca -0.07 -0.39 -0.07 0.00 -0.22 0.00 0.00 54.13 53.38 1kfi s LEU 61 Cb -0.15 -1.73 -0.06 0.00 0.50 0.00 0.00 46.19 44.75 1kfi s LEU 61 CO -0.02 -0.01 0.59 0.12 -1.32 0.00 0.00 176.35 175.71 1kfi s PHE 62 N 1.43 3.46 -0.24 5.38 5.36 -0.87 -1.53 117.98 130.97 1kfi s PHE 62 Ca 0.05 0.78 -0.03 0.00 -0.96 0.00 0.00 56.93 56.77 1kfi s PHE 62 Cb -0.14 -2.21 0.08 0.00 -0.34 0.00 0.00 43.02 40.41 1kfi s PHE 62 CO -0.03 0.15 0.08 0.08 -1.46 0.00 0.00 175.22 174.04 1kfi s VAL 63 N -2.06 0.33 0.55 3.12 1.01 0.13 -0.68 120.40 122.81 1kfi s VAL 63 Ca 0.46 -0.72 0.09 0.00 0.00 0.00 0.00 61.98 61.81 1kfi s VAL 63 Cb -0.11 -1.07 0.07 0.00 0.00 0.00 0.00 36.38 35.27 1kfi s VAL 63 CO 0.28 -0.46 0.76 -0.83 0.00 0.00 0.00 175.10 174.85 1kfi s GLY 64 N 1.92 1.77 0.00 4.51 0.00 0.11 -3.77 107.32 111.86 1kfi s GLY 64 Ca 0.05 -2.03 0.00 0.00 0.00 0.00 0.00 44.72 42.73 1kfi s GLY 64 CO -0.20 -1.62 0.00 0.61 0.00 0.00 0.00 173.10 171.90 1kfi n GLY 65 N -2.21 1.86 3.81 0.20 0.00 -0.17 -0.71 105.19 107.98 1kfi n GLY 65 Ca 0.14 -0.33 -0.38 0.00 0.00 0.00 0.00 46.02 45.45 1kfi n GLY 65 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1kfi s ASP 66 N 0.00 6.83 0.00 1.61 3.84 -0.64 -1.39 116.67 126.92 1kfi s ASP 66 Ca 0.00 0.99 -0.00 0.00 -0.00 0.00 0.00 52.55 53.54 1kfi s ASP 66 Cb 0.00 -2.27 -0.00 0.00 -1.38 0.00 0.00 42.92 39.27 1kfi s ASP 66 CO 0.00 0.26 0.06 0.61 -0.00 0.00 0.00 175.17 176.11 1kfi n GLY 67 N 2.05 0.56 3.83 2.12 0.00 -1.26 -4.86 105.19 107.63 1kfi n GLY 67 Ca -0.12 -0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.57 1kfi n GLY 67 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1kfi s ARG 68 N 2.10 3.84 0.22 1.61 1.70 -1.26 -3.41 118.95 123.74 1kfi s ARG 68 Ca 0.00 1.01 -0.30 0.00 -0.47 0.00 0.00 55.73 55.97 1kfi s ARG 68 Cb 0.00 -2.12 -0.15 0.00 -0.57 0.00 0.00 34.95 32.11 1kfi s ARG 68 CO 0.00 -0.37 0.98 0.98 -1.08 0.00 0.00 175.30 175.81 1kfi n TYR 69 N -1.64 0.95 -0.39 5.89 9.36 0.10 -2.21 117.16 129.22 1kfi n TYR 69 Ca 0.07 0.75 0.00 0.00 3.32 0.00 0.00 57.90 62.04 1kfi n TYR 69 Cb 0.54 -2.20 0.00 0.00 -0.63 0.00 0.00 39.34 37.04 1kfi n TYR 69 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 1kfi n PHE 70 N 0.71 0.00 -0.07 2.98 7.35 -1.26 -4.72 117.46 122.45 1kfi n PHE 70 Ca 0.13 0.00 -0.09 0.00 -0.76 0.00 0.00 57.45 56.73 1kfi n PHE 70 Cb 0.27 0.00 0.06 0.00 0.35 0.00 0.00 39.48 40.16 1kfi n PHE 70 CO 0.00 0.00 0.00 -0.91 -0.76 0.00 0.00 176.76 175.09 1kfi h ASN 71 N 0.00 0.79 -0.52 -2.13 4.21 -1.80 -1.10 115.58 115.03 1kfi h ASN 71 Ca 0.00 -0.34 -0.06 0.00 1.21 0.00 0.00 56.30 57.11 1kfi h ASN 71 Cb 0.00 -0.22 -0.02 0.00 -1.12 0.00 0.00 38.32 36.96 1kfi h ASN 71 CO 0.00 1.07 0.11 0.03 -1.29 0.00 0.00 177.43 177.34 1kfi h ARG 72 N 0.62 0.85 -0.05 0.81 3.08 -1.92 0.17 114.38 117.95 1kfi h ARG 72 Ca 0.06 -0.22 -0.12 0.00 0.07 0.00 0.00 59.98 59.77 1kfi h ARG 72 Cb 0.90 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.83 1kfi h ARG 72 CO 0.08 0.82 -0.53 1.96 -1.07 0.00 0.00 179.97 181.24 1kfi h GLN 73 N 0.74 0.14 -0.13 0.04 4.20 -1.96 -1.86 115.11 116.28 1kfi h GLN 73 Ca 0.16 -0.09 -0.18 0.00 0.06 0.00 0.00 58.65 58.60 1kfi h GLN 73 Cb 0.37 0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.15 1kfi h GLN 73 CO 0.01 0.64 -0.67 0.00 -0.67 0.00 0.00 178.83 178.13 1kfi h ALA 74 N 1.35 0.59 -0.69 3.87 0.00 -0.92 -2.58 119.26 120.88 1kfi h ALA 74 Ca 0.00 -0.57 0.01 0.00 0.00 0.00 0.00 54.91 54.35 1kfi h ALA 74 Cb 0.97 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.66 1kfi h ALA 74 CO 0.08 0.72 0.45 0.82 0.00 0.00 0.00 179.25 181.32 1kfi h ILE 75 N 0.38 1.16 0.00 0.00 2.04 -0.23 0.97 117.51 121.82 1kfi h ILE 75 Ca -0.02 -0.31 -0.07 0.00 1.00 0.00 0.00 64.86 65.45 1kfi h ILE 75 Cb 1.24 0.16 -0.01 0.00 -0.74 0.00 0.00 36.82 37.48 1kfi h ILE 75 CO 0.12 0.17 -0.35 -0.26 0.00 0.00 0.00 178.15 177.83 1kfi h PHE 76 N 0.91 0.00 -0.10 1.37 0.04 -1.25 -1.17 116.94 116.74 1kfi h PHE 76 Ca 0.26 0.00 -0.20 0.00 2.80 0.00 0.00 57.97 60.83 1kfi h PHE 76 Cb -0.08 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.08 1kfi h PHE 76 CO -0.03 0.35 -0.73 0.77 -0.60 0.00 0.00 178.31 178.07 1kfi h SER 77 N 0.00 0.82 -0.67 2.17 0.02 -0.95 -2.31 113.55 112.62 1kfi h SER 77 Ca -0.00 -0.66 -0.03 0.00 -0.84 0.00 0.00 61.79 60.25 1kfi h SER 77 Cb 0.82 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 63.08 1kfi h SER 77 CO 0.05 1.35 0.31 0.40 -1.14 0.00 0.00 176.83 177.80 1kfi h ILE 78 N 0.34 1.23 -0.52 3.27 2.04 -0.59 -0.95 117.51 122.34 1kfi h ILE 78 Ca -0.06 -0.67 -0.04 0.00 1.00 0.00 0.00 64.86 65.09 1kfi h ILE 78 Cb 1.38 0.36 -0.02 0.00 -0.74 0.00 0.00 36.82 37.79 1kfi h ILE 78 CO 0.15 0.28 0.18 0.40 0.00 0.00 0.00 178.15 179.16 1kfi h ILE 79 N 0.99 1.23 -0.32 -0.67 2.04 -1.12 0.30 117.51 119.95 1kfi h ILE 79 Ca 0.24 -0.73 -0.00 0.00 1.00 0.00 0.00 64.86 65.36 1kfi h ILE 79 Cb 0.13 0.73 -0.02 0.00 -0.74 0.00 0.00 36.82 36.93 1kfi h ILE 79 CO -0.03 0.27 0.19 0.03 0.00 0.00 0.00 178.15 178.61 1kfi h ARG 80 N 0.70 0.44 -0.32 2.37 3.08 -0.83 -1.92 114.38 117.91 1kfi h ARG 80 Ca 0.17 -0.05 -0.15 0.00 0.07 0.00 0.00 59.98 60.03 1kfi h ARG 80 Cb 0.24 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.20 1kfi h ARG 80 CO -0.01 0.36 -0.39 -0.07 -1.07 0.00 0.00 179.97 178.79 1kfi h LEU 81 N 0.41 0.80 -0.49 3.04 4.07 -0.94 -1.08 115.31 121.13 1kfi h LEU 81 Ca 0.11 -0.36 -0.00 0.00 0.08 0.00 0.00 57.88 57.71 1kfi h LEU 81 Cb 0.04 -0.23 -0.02 0.00 1.08 0.00 0.00 40.66 41.53 1kfi h LEU 81 CO -0.02 1.10 0.30 0.00 -1.08 0.00 0.00 178.44 178.74 1kfi h ALA 82 N 0.94 0.62 -0.13 1.53 0.00 -0.29 0.48 119.26 122.41 1kfi h ALA 82 Ca 0.05 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1kfi h ALA 82 Cb 0.94 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 1kfi h ALA 82 CO 0.09 0.10 0.07 -0.92 0.00 0.00 0.00 179.25 178.59 1kfi h TYR 83 N 0.66 0.18 0.00 0.00 5.03 -1.27 0.38 116.97 121.96 1kfi h TYR 83 Ca 0.18 -0.01 -0.03 0.00 2.58 0.00 0.00 58.73 61.45 1kfi h TYR 83 Cb -0.02 -0.06 -0.00 0.00 1.55 0.00 0.00 36.73 38.20 1kfi h TYR 83 CO -0.03 0.22 -0.16 0.00 -1.32 0.00 0.00 178.16 176.87 1kfi h ALA 84 N 0.94 1.69 -0.45 1.82 0.00 -0.78 -2.06 119.26 120.43 1kfi h ALA 84 Ca 0.04 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1kfi h ALA 84 Cb 0.10 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1kfi h ALA 84 CO -0.01 0.20 0.00 0.09 0.00 0.00 0.00 179.25 179.53 1kfi n ASN 85 N -4.27 4.64 0.00 0.00 4.13 0.17 -4.83 115.26 115.10 1kfi n ASN 85 Ca -0.02 -2.71 0.00 0.00 1.68 0.00 0.00 54.58 53.53 1kfi n ASN 85 Cb 0.23 -0.64 0.00 0.00 -1.54 0.00 0.00 39.78 37.83 1kfi n ASN 85 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 1kfi n ASP 86 N 0.50 -2.74 -4.77 6.41 4.64 -0.77 -4.89 116.55 114.92 1kfi n ASP 86 Ca 0.21 0.00 -0.40 0.00 -1.38 0.00 0.00 54.79 53.22 1kfi n ASP 86 Cb 0.98 -0.61 -0.00 0.00 -1.04 0.00 0.00 41.12 40.44 1kfi n ASP 86 CO 0.00 0.00 0.00 -0.63 -0.82 0.00 0.00 177.20 175.75 1kfi s ILE 87 N -2.20 2.31 -0.14 5.18 -1.09 0.13 -4.75 121.20 120.65 1kfi s ILE 87 Ca 0.00 0.30 -0.28 0.00 -2.23 0.00 0.00 60.65 58.44 1kfi s ILE 87 Cb 0.00 -3.18 -0.26 0.00 -1.58 0.00 0.00 42.46 37.44 1kfi s ILE 87 CO 0.00 0.06 0.74 0.28 -1.23 0.00 0.00 174.94 174.79 1kfi h SER 88 N 2.83 0.03 -3.84 3.58 0.02 -1.80 -3.41 113.55 110.96 1kfi h SER 88 Ca -0.50 -0.96 -0.28 0.00 -0.84 0.00 0.00 61.79 59.21 1kfi h SER 88 Cb 1.24 -0.01 -0.28 0.00 0.14 0.00 0.00 62.40 63.49 1kfi h SER 88 CO 0.63 1.06 -0.74 -1.61 -1.14 0.00 0.00 176.83 175.04 1kfi s GLU 89 N -2.24 0.22 -0.18 3.45 2.02 -0.16 -2.43 118.70 119.36 1kfi s GLU 89 Ca -0.19 -0.10 -0.01 0.00 0.02 0.00 0.00 54.97 54.68 1kfi s GLU 89 Cb -0.02 -0.20 0.00 0.00 0.10 0.00 0.00 34.13 34.01 1kfi s GLU 89 CO 0.69 0.06 -0.13 0.08 0.02 0.00 0.00 175.26 175.98 1kfi s VAL 90 N -0.09 2.74 -0.19 2.63 1.01 -0.62 -1.01 120.40 124.87 1kfi s VAL 90 Ca 0.01 -0.72 -0.04 0.00 0.00 0.00 0.00 61.98 61.23 1kfi s VAL 90 Cb -0.01 -2.19 -0.02 0.00 0.00 0.00 0.00 36.38 34.16 1kfi s VAL 90 CO -0.00 0.49 -0.03 -1.00 0.00 0.00 0.00 175.10 174.56 1kfi s HIS 91 N 1.16 2.99 0.14 5.22 3.76 -0.58 0.03 115.29 128.01 1kfi s HIS 91 Ca 0.01 -0.56 0.06 0.00 -0.15 0.00 0.00 55.06 54.42 1kfi s HIS 91 Cb -0.14 -2.04 -0.04 0.00 1.11 0.00 0.00 32.58 31.47 1kfi s HIS 91 CO -0.05 -0.27 -0.13 0.54 -0.85 0.00 0.00 174.74 173.99 1kfi s VAL 92 N 0.91 1.32 0.53 -0.90 0.11 -0.52 0.22 120.40 122.06 1kfi s VAL 92 Ca -0.00 -1.87 -0.07 0.00 -2.93 0.00 0.00 61.98 57.11 1kfi s VAL 92 Cb -0.15 -1.67 -0.03 0.00 -1.53 0.00 0.00 36.38 33.00 1kfi s VAL 92 CO 0.01 -0.54 0.86 -0.83 -3.33 0.00 0.00 175.10 171.27 1kfi s GLY 93 N -2.76 1.55 0.21 6.54 0.00 -1.25 -0.95 107.32 110.65 1kfi s GLY 93 Ca 0.13 -0.41 -0.32 0.00 0.00 0.00 0.00 44.72 44.11 1kfi s GLY 93 CO 0.03 -0.21 1.36 -0.18 0.00 0.00 0.00 173.10 174.10 1kfi n GLN 94 N -2.41 1.81 -1.38 2.90 7.27 -0.08 0.62 117.38 126.11 1kfi n GLN 94 Ca 0.02 0.65 -0.13 0.00 0.07 0.00 0.00 57.00 57.61 1kfi n GLN 94 Cb 0.55 -2.27 -0.06 0.00 2.41 0.00 0.00 30.24 30.87 1kfi n GLN 94 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1kfi n ALA 95 N 1.94 -0.20 -1.05 1.69 0.00 0.15 -0.84 120.51 122.21 1kfi n ALA 95 Ca 0.13 0.21 -0.02 0.00 0.00 0.00 0.00 53.44 53.76 1kfi n ALA 95 Cb 0.29 -1.77 -0.01 0.00 0.00 0.00 0.00 19.45 17.97 1kfi n ALA 95 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1kfi n GLY 96 N -0.15 0.52 3.63 0.00 0.00 0.20 -4.92 105.19 104.48 1kfi n GLY 96 Ca -0.13 -0.31 -0.39 0.00 0.00 0.00 0.00 46.02 45.19 1kfi n GLY 96 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1kfi s LEU 97 N -0.39 4.08 -0.30 0.99 1.02 -0.02 -3.74 118.68 120.33 1kfi s LEU 97 Ca 0.00 0.52 -0.06 0.00 0.02 0.00 0.00 54.13 54.60 1kfi s LEU 97 Cb 0.00 -2.61 0.18 0.00 0.02 0.00 0.00 46.19 43.78 1kfi s LEU 97 CO 0.00 -0.22 0.82 -0.32 0.02 0.00 0.00 176.35 176.65 1kfi s MET 98 N 1.97 0.38 0.84 1.70 1.75 -0.49 -4.08 119.30 121.38 1kfi s MET 98 Ca 0.20 0.65 -0.13 0.00 -1.25 0.00 0.00 55.69 55.16 1kfi s MET 98 Cb -0.15 0.35 0.08 0.00 2.84 0.00 0.00 34.83 37.95 1kfi s MET 98 CO 0.09 -0.45 1.05 -1.13 -0.65 0.00 0.00 175.02 173.93 1kfi n SER 99 N 5.43 0.39 -0.14 1.11 3.41 -1.26 -1.00 113.62 121.57 1kfi n SER 99 Ca -0.03 0.53 -0.04 0.00 -0.26 0.00 0.00 58.87 59.08 1kfi n SER 99 Cb 0.53 -1.45 0.05 0.00 -0.26 0.00 0.00 64.21 63.08 1kfi n SER 99 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 1kfi h THR 100 N -1.10 0.73 -0.54 6.66 2.02 -1.73 0.39 112.91 119.34 1kfi h THR 100 Ca -0.45 -0.06 -0.04 0.00 0.77 0.00 0.00 66.41 66.63 1kfi h THR 100 Cb 1.30 0.53 -0.02 0.00 -1.74 0.00 0.00 68.15 68.21 1kfi h THR 100 CO 0.44 0.03 0.19 -0.65 0.37 0.00 0.00 175.52 175.90 1kfi h PRO 101 N 0.19 0.82 -0.35 6.66 0.11 -1.79 -1.20 132.00 136.44 1kfi h PRO 101 Ca 0.22 -0.16 -0.07 0.00 0.11 0.00 0.00 66.00 66.10 1kfi h PRO 101 Cb 0.29 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 31.26 1kfi h PRO 101 CO -0.31 0.74 -0.06 0.00 -0.21 0.00 0.00 178.00 178.16 1kfi h ALA 102 N 1.05 1.25 -0.26 -0.75 0.00 -1.71 -1.39 119.26 117.44 1kfi h ALA 102 Ca 0.18 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 1kfi h ALA 102 Cb 0.24 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1kfi h ALA 102 CO -0.01 0.50 -0.05 0.77 0.00 0.00 0.00 179.25 180.46 1kfi h SER 103 N 0.54 0.49 -0.68 0.00 0.02 0.09 0.23 113.55 114.23 1kfi h SER 103 Ca 0.11 -0.35 0.07 0.00 -0.84 0.00 0.00 61.79 60.77 1kfi h SER 103 Cb 0.43 -0.13 -0.06 0.00 0.14 0.00 0.00 62.40 62.78 1kfi h SER 103 CO 0.02 0.73 0.37 -1.28 -1.14 0.00 0.00 176.83 175.53 1kfi h SER 104 N 0.25 0.54 -0.30 3.07 0.87 -0.91 -1.06 113.55 116.00 1kfi h SER 104 Ca 0.07 0.04 -0.10 0.00 -1.23 0.00 0.00 61.79 60.56 1kfi h SER 104 Cb 0.50 -0.07 -0.01 0.00 -0.44 0.00 0.00 62.40 62.39 1kfi h SER 104 CO 0.02 0.34 -0.21 -0.74 -0.53 0.00 0.00 176.83 175.71 1kfi h HIS 105 N 0.67 0.79 -0.87 2.24 6.17 -1.01 -2.50 115.15 120.64 1kfi h HIS 105 Ca 0.31 -0.22 0.07 0.00 0.71 0.00 0.00 60.37 61.24 1kfi h HIS 105 Cb 0.22 -0.17 -0.06 0.00 2.52 0.00 0.00 27.41 29.91 1kfi h HIS 105 CO -0.08 0.93 0.54 -0.92 0.71 0.00 0.00 177.93 179.11 1kfi h TYR 106 N 0.42 0.99 -0.33 5.26 3.20 0.07 0.20 116.97 126.79 1kfi h TYR 106 Ca 0.06 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.94 1kfi h TYR 106 Cb 0.76 -0.32 -0.01 0.00 1.54 0.00 0.00 36.73 38.70 1kfi h TYR 106 CO 0.07 0.48 0.14 0.82 -1.64 0.00 0.00 178.16 178.03 1kfi h ILE 107 N 0.96 1.18 -0.66 1.81 2.04 -1.14 -2.31 117.51 119.39 1kfi h ILE 107 Ca 0.39 -0.54 -0.07 0.00 1.00 0.00 0.00 64.86 65.64 1kfi h ILE 107 Cb 0.22 0.93 -0.03 0.00 -0.74 0.00 0.00 36.82 37.20 1kfi h ILE 107 CO -0.19 0.19 0.14 0.03 0.00 0.00 0.00 178.15 178.32 1kfi h ARG 108 N 0.38 1.07 0.59 2.37 3.08 -0.92 -1.66 114.38 119.29 1kfi h ARG 108 Ca 0.11 -0.26 -0.02 0.00 0.07 0.00 0.00 59.98 59.88 1kfi h ARG 108 Cb 0.17 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.07 1kfi h ARG 108 CO -0.01 0.96 -0.42 -0.22 -1.07 0.00 0.00 179.97 179.21 1kfi h LYS 109 N 1.01 -0.94 -0.72 0.04 3.64 -0.41 0.24 116.57 119.43 1kfi h LYS 109 Ca 0.21 0.06 0.08 0.00 -1.27 0.00 0.00 60.65 59.73 1kfi h LYS 109 Cb 0.39 0.21 -0.07 0.00 -0.41 0.00 0.00 32.23 32.36 1kfi h LYS 109 CO 0.01 -0.63 0.38 0.28 -2.27 0.00 0.00 179.45 177.22 1kfi h VAL 110 N -0.97 0.89 0.00 2.00 2.07 -1.40 -0.16 116.25 118.67 1kfi h VAL 110 Ca -0.07 -0.23 0.00 0.00 0.82 0.00 0.00 66.70 67.22 1kfi h VAL 110 Cb 0.81 0.18 0.00 0.00 -1.52 0.00 0.00 31.29 30.76 1kfi h VAL 110 CO 0.03 0.12 0.00 0.59 0.02 0.00 0.00 177.57 178.33 1kfi n ASN 111 N -4.82 0.00 -0.04 0.57 3.02 -0.63 0.67 115.26 114.03 1kfi n ASN 111 Ca 0.11 0.40 0.03 0.00 -0.03 0.00 0.00 54.58 55.08 1kfi n ASN 111 Cb 0.24 -0.46 -0.16 0.00 -0.61 0.00 0.00 39.78 38.80 1kfi n ASN 111 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1kfi n GLU 112 N -1.46 0.71 -0.07 3.52 1.02 0.79 -3.77 120.64 121.39 1kfi n GLU 112 Ca 0.06 -0.12 -0.22 0.00 -0.02 0.00 0.00 57.16 56.86 1kfi n GLU 112 Cb 0.21 -1.50 -0.12 0.00 -0.02 0.00 0.00 31.44 30.00 1kfi n GLU 112 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1kfi n GLU 113 N -2.42 0.67 -3.35 3.49 1.02 -0.23 -4.80 120.64 115.01 1kfi n GLU 113 Ca -0.15 0.31 -0.20 0.00 -0.02 0.00 0.00 57.16 57.10 1kfi n GLU 113 Cb 0.78 -1.64 -0.08 0.00 -0.02 0.00 0.00 31.44 30.47 1kfi n GLU 113 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1kfi s VAL 114 N -2.50 -0.18 0.00 2.62 1.01 0.21 -5.05 120.40 116.51 1kfi s VAL 114 Ca -0.29 -1.38 0.00 0.00 0.00 0.00 0.00 61.98 60.31 1kfi s VAL 114 Cb 0.08 -0.80 0.00 0.00 0.00 0.00 0.00 36.38 35.66 1kfi s VAL 114 CO 0.65 -0.73 0.45 0.61 0.00 0.00 0.00 175.10 176.08 1kfi n GLY 115 N 3.91 0.88 0.27 4.51 0.00 -1.22 -4.11 105.19 109.42 1kfi n GLY 115 Ca 0.15 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.22 1kfi n GLY 115 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1kfi n ASN 116 N 2.90 2.56 -4.70 1.61 2.04 -1.26 -4.97 115.26 113.44 1kfi n ASN 116 Ca 0.00 -2.52 -0.39 0.00 -0.44 0.00 0.00 54.58 51.22 1kfi n ASN 116 Cb 0.00 -0.27 -0.05 0.00 -2.53 0.00 0.00 39.78 36.93 1kfi n ASN 116 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1kfi n ILE 118 N 3.97 0.38 0.00 0.00 -5.35 -0.07 -4.74 119.36 113.54 1kfi n ILE 118 Ca -0.03 -0.41 0.00 0.00 -0.27 0.00 0.00 62.75 62.04 1kfi n ILE 118 Cb 0.51 0.25 0.00 0.00 -1.74 0.00 0.00 39.64 38.66 1kfi n ILE 118 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1kfi n GLY 119 N 1.05 -0.37 3.31 3.28 0.00 -1.26 -4.41 105.19 106.80 1kfi n GLY 119 Ca 0.13 -2.23 -0.14 0.00 0.00 0.00 0.00 46.02 43.78 1kfi n GLY 119 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1kfi s GLY 120 N 0.00 -0.26 -0.18 -0.02 0.00 -0.26 -2.04 107.32 104.57 1kfi s GLY 120 Ca 0.00 0.45 -0.15 0.00 0.00 0.00 0.00 44.72 45.02 1kfi s GLY 120 CO 0.00 0.20 0.35 -0.42 0.00 0.00 0.00 173.10 173.23 1kfi s ILE 121 N -1.76 5.26 -0.26 0.90 1.01 0.15 -0.37 121.20 126.11 1kfi s ILE 121 Ca -0.10 0.64 -0.01 0.00 0.00 0.00 0.00 60.65 61.17 1kfi s ILE 121 Cb -0.03 -3.68 0.03 0.00 0.01 0.00 0.00 42.46 38.79 1kfi s ILE 121 CO 0.03 0.33 -0.05 -0.63 0.00 0.00 0.00 174.94 174.61 1kfi s ILE 122 N 0.84 2.87 -0.82 2.92 1.01 0.47 -0.71 121.20 127.78 1kfi s ILE 122 Ca 0.18 -1.14 -0.26 0.00 0.00 0.00 0.00 60.65 59.44 1kfi s ILE 122 Cb -0.14 -2.51 0.03 0.00 0.01 0.00 0.00 42.46 39.85 1kfi s ILE 122 CO 0.06 0.12 1.34 -0.76 0.00 0.00 0.00 174.94 175.70 1kfi s LEU 123 N 1.30 3.26 -0.26 2.97 1.43 0.11 -1.71 118.68 125.77 1kfi s LEU 123 Ca -0.02 -0.73 -0.25 0.00 -1.03 0.00 0.00 54.13 52.11 1kfi s LEU 123 Cb -0.18 -2.56 0.07 0.00 0.03 0.00 0.00 46.19 43.55 1kfi s LEU 123 CO -0.04 -1.76 0.70 -0.89 0.23 0.00 0.00 176.35 174.60 1kfi s THR 124 N 5.59 0.00 -0.22 5.49 2.01 -0.61 -1.62 115.64 126.27 1kfi s THR 124 Ca 0.39 -0.00 0.15 0.00 0.31 0.00 0.00 61.69 62.53 1kfi s THR 124 Cb -0.06 -0.98 0.66 0.00 0.01 0.00 0.00 72.50 72.13 1kfi s THR 124 CO 0.08 -0.00 1.59 0.00 -0.69 0.00 0.00 174.62 175.60 1kfi n ALA 125 N 2.68 3.57 -1.20 7.40 0.00 -1.26 -3.49 120.51 128.20 1kfi n ALA 125 Ca -0.14 -2.22 0.00 0.00 0.00 0.00 0.00 53.44 51.08 1kfi n ALA 125 Cb 0.55 -0.93 0.00 0.00 0.00 0.00 0.00 19.45 19.08 1kfi n ALA 125 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1kfi n SER 126 N -0.10 0.00 0.00 0.00 3.41 -1.26 -2.67 113.62 113.00 1kfi n SER 126 Ca 0.27 0.68 0.00 0.00 -0.26 0.00 0.00 58.87 59.55 1kfi n SER 126 Cb 1.07 -1.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.01 1kfi n SER 126 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1kfi n HIS 127 N 1.54 0.00 -3.26 7.33 1.44 -1.26 -4.88 115.22 116.13 1kfi n HIS 127 Ca 0.00 0.00 -0.33 0.00 -2.01 0.00 0.00 57.72 55.38 1kfi n HIS 127 Cb 0.00 -0.72 -0.06 0.00 0.12 0.00 0.00 29.99 29.33 1kfi n HIS 127 CO 0.00 0.00 0.00 -0.80 -2.81 0.00 0.00 176.34 172.73 1kfi s ASN 128 N -0.48 6.77 0.75 4.39 0.01 -1.09 -3.73 114.94 121.55 1kfi s ASN 128 Ca 0.00 1.15 -0.15 0.00 -0.71 0.00 0.00 52.86 53.15 1kfi s ASN 128 Cb 0.00 -2.32 0.03 0.00 0.41 0.00 0.00 41.25 39.37 1kfi s ASN 128 CO 0.00 -0.09 1.03 -2.65 -1.51 0.00 0.00 177.10 173.88 1kfi n PRO 129 N 0.00 0.42 -4.61 -0.60 -0.02 -1.26 -4.67 135.00 124.26 1kfi n PRO 129 Ca 0.01 0.21 -0.29 0.00 -2.02 0.00 0.00 63.50 61.40 1kfi n PRO 129 Cb 0.52 -2.29 -0.07 0.00 -0.02 0.00 0.00 33.50 31.64 1kfi n PRO 129 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1kfi s GLY 130 N -1.77 2.85 0.00 -1.23 0.00 -1.26 -0.43 107.32 105.48 1kfi s GLY 130 Ca 0.73 -0.79 0.00 0.00 0.00 0.00 0.00 44.72 44.66 1kfi s GLY 130 CO 0.50 -1.96 0.00 0.61 0.00 0.00 0.00 173.10 172.26 1kfi n GLY 131 N -1.07 3.29 0.36 0.20 0.00 -1.21 -4.09 105.19 102.67 1kfi n GLY 131 Ca -0.11 -1.65 0.03 0.00 0.00 0.00 0.00 46.02 44.29 1kfi n GLY 131 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1kfi h LYS 132 N 0.00 1.00 0.00 1.61 3.64 -1.90 -1.04 116.57 119.88 1kfi h LYS 132 Ca 0.00 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 1kfi h LYS 132 Cb 0.00 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 31.59 1kfi h LYS 132 CO 0.00 0.66 0.00 0.39 -2.27 0.00 0.00 179.45 178.23 1kfi n GLU 133 N -4.46 0.00 -0.64 1.90 4.71 -1.26 -4.49 120.64 116.40 1kfi n GLU 133 Ca 0.12 0.04 0.06 0.00 -0.01 0.00 0.00 57.16 57.37 1kfi n GLU 133 Cb 0.14 -0.69 0.20 0.00 -1.01 0.00 0.00 31.44 30.08 1kfi n GLU 133 CO 0.00 0.00 0.00 0.72 0.09 0.00 0.00 177.13 177.94 1kfi n HIS 134 N -0.23 0.00 -2.38 -0.32 8.25 -1.26 -4.88 115.22 114.40 1kfi n HIS 134 Ca 0.00 -1.42 -0.25 0.00 -0.26 0.00 0.00 57.72 55.79 1kfi n HIS 134 Cb 0.00 -0.24 0.11 0.00 1.12 0.00 0.00 29.99 30.98 1kfi n HIS 134 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 1kfi s GLY 135 N -3.15 1.76 0.21 -1.41 0.00 -0.39 -4.85 107.32 99.48 1kfi s GLY 135 Ca 0.38 -1.46 0.10 0.00 0.00 0.00 0.00 44.72 43.74 1kfi s GLY 135 CO -0.07 -0.89 -0.14 0.99 0.00 0.00 0.00 173.10 172.99 1kfi s ASP 136 N -4.72 3.96 -0.02 1.64 -0.00 0.43 -1.55 116.67 116.42 1kfi s ASP 136 Ca 0.66 -0.73 0.05 0.00 -0.00 0.00 0.00 52.55 52.53 1kfi s ASP 136 Cb -0.06 -0.54 -0.01 0.00 -0.00 0.00 0.00 42.92 42.30 1kfi s ASP 136 CO 0.46 0.09 -0.18 0.12 -0.00 0.00 0.00 175.17 175.66 1kfi s PHE 137 N -1.89 1.65 0.06 4.23 5.36 0.12 -4.55 117.98 122.94 1kfi s PHE 137 Ca 0.25 -0.36 0.00 0.00 -0.96 0.00 0.00 56.93 55.87 1kfi s PHE 137 Cb -0.08 -1.07 -0.03 0.00 -0.34 0.00 0.00 43.02 41.49 1kfi s PHE 137 CO 0.14 -0.07 -0.05 0.20 -1.46 0.00 0.00 175.22 173.99 1kfi s GLY 138 N -0.28 0.53 -0.15 13.12 0.00 -1.25 -1.19 107.32 118.09 1kfi s GLY 138 Ca 0.04 -1.09 -0.08 0.00 0.00 0.00 0.00 44.72 43.60 1kfi s GLY 138 CO 0.00 -1.18 0.36 -1.50 0.00 0.00 0.00 173.10 170.78 1kfi s ILE 139 N -3.04 -0.12 0.18 0.90 2.07 -0.03 -1.57 121.20 119.59 1kfi s ILE 139 Ca 0.02 0.13 0.02 0.00 -1.41 0.00 0.00 60.65 59.41 1kfi s ILE 139 Cb 0.01 -0.54 -0.05 0.00 0.13 0.00 0.00 42.46 42.01 1kfi s ILE 139 CO -0.05 0.05 -0.01 -1.59 -1.91 0.00 0.00 174.94 171.43 1kfi s LYS 140 N 1.55 1.15 -0.05 3.50 -2.85 -0.69 -1.24 119.74 121.11 1kfi s LYS 140 Ca -0.08 -1.56 0.04 0.00 -1.00 0.00 0.00 55.97 53.37 1kfi s LYS 140 Cb -0.10 -0.36 0.00 0.00 -2.06 0.00 0.00 37.83 35.32 1kfi s LYS 140 CO -0.11 -0.11 -0.16 0.12 0.10 0.00 0.00 175.35 175.19 1kfi s PHE 141 N -3.59 1.61 -0.05 1.78 5.36 -1.26 -0.39 117.98 121.43 1kfi s PHE 141 Ca 0.24 -0.49 0.02 0.00 -0.96 0.00 0.00 56.93 55.74 1kfi s PHE 141 Cb 0.06 -1.11 -0.03 0.00 -0.34 0.00 0.00 43.02 41.60 1kfi s PHE 141 CO 0.05 -0.19 -0.09 -0.80 -1.46 0.00 0.00 175.22 172.72 1kfi s ASN 142 N 0.19 4.45 0.98 6.13 0.02 0.50 -0.64 114.94 126.57 1kfi s ASN 142 Ca -0.06 -0.09 -0.14 0.00 -1.02 0.00 0.00 52.86 51.55 1kfi s ASN 142 Cb -0.12 -1.06 0.19 0.00 0.02 0.00 0.00 41.25 40.28 1kfi s ASN 142 CO 0.03 0.35 1.14 1.33 0.02 0.00 0.00 177.10 179.97 1kfi n VAL 143 N 2.18 0.00 0.13 1.60 0.24 0.12 -1.10 118.33 121.49 1kfi n VAL 143 Ca -0.17 -0.89 0.19 0.00 -2.04 0.00 0.00 64.34 61.43 1kfi n VAL 143 Cb 0.53 -1.53 0.70 0.00 -1.47 0.00 0.00 33.84 32.07 1kfi n VAL 143 CO 0.00 0.00 0.00 0.03 -2.14 0.00 0.00 176.83 174.72 1kfi h ARG 144 N 0.00 0.00 -0.09 7.34 3.08 -1.85 0.38 114.38 123.24 1kfi h ARG 144 Ca -0.37 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.68 1kfi h ARG 144 Cb 1.03 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.08 1kfi h ARG 144 CO 0.27 0.00 0.00 0.25 -1.07 0.00 0.00 179.97 179.42 1kfi n THR 145 N -3.40 0.10 -0.90 2.04 -2.24 -1.26 -4.64 114.28 103.99 1kfi n THR 145 Ca 0.06 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.53 1kfi n THR 145 Cb 0.67 0.47 0.00 0.00 -2.10 0.00 0.00 70.33 69.38 1kfi n THR 145 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1kfi n GLY 146 N 1.17 0.86 3.90 3.38 0.00 0.13 -4.59 105.19 110.05 1kfi n GLY 146 Ca 0.18 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.92 1kfi n GLY 146 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1kfi s ALA 147 N -3.39 3.54 0.23 4.61 0.00 -1.26 -4.43 121.76 121.06 1kfi s ALA 147 Ca 0.00 -0.52 -0.30 0.00 0.00 0.00 0.00 51.96 51.13 1kfi s ALA 147 Cb 0.00 -2.41 -0.10 0.00 0.00 0.00 0.00 23.12 20.61 1kfi s ALA 147 CO 0.00 0.05 1.41 -1.25 0.00 0.00 0.00 175.76 175.97 1kfi s PRO 148 N -3.94 4.30 0.13 0.00 0.04 -1.26 0.11 135.00 134.38 1kfi s PRO 148 Ca 0.45 2.23 -0.33 0.00 0.04 0.00 0.00 61.00 63.40 1kfi s PRO 148 Cb -0.10 -3.14 -0.17 0.00 0.04 0.00 0.00 34.50 31.13 1kfi s PRO 148 CO 0.34 -0.38 0.89 0.00 0.04 0.00 0.00 177.00 177.88 1kfi n ALA 149 N 2.52 -2.43 -1.18 8.56 0.00 0.19 -4.72 120.51 123.45 1kfi n ALA 149 Ca 0.07 0.49 -0.30 0.00 0.00 0.00 0.00 53.44 53.71 1kfi n ALA 149 Cb 0.41 -1.79 0.14 0.00 0.00 0.00 0.00 19.45 18.21 1kfi n ALA 149 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1kfi s PRO 150 N -0.55 1.19 0.14 0.00 0.04 -1.26 -4.73 135.00 129.83 1kfi s PRO 150 Ca 0.75 0.83 -0.30 0.00 0.04 0.00 0.00 61.00 62.32 1kfi s PRO 150 Cb -1.00 -1.80 -0.05 0.00 0.04 0.00 0.00 34.50 31.68 1kfi s PRO 150 CO 0.55 -2.29 1.56 1.49 0.04 0.00 0.00 177.00 178.35 1kfi h GLU 151 N -1.59 -0.33 -0.75 4.56 4.57 -1.98 -1.22 114.58 117.84 1kfi h GLU 151 Ca -0.50 0.02 0.11 0.00 -1.18 0.00 0.00 59.36 57.82 1kfi h GLU 151 Cb 1.29 0.08 -0.08 0.00 -0.16 0.00 0.00 28.75 29.87 1kfi h GLU 151 CO 0.54 -0.22 0.37 0.38 -1.18 0.00 0.00 179.01 178.90 1kfi h ASP 152 N -0.35 0.46 0.35 1.04 2.03 -1.99 0.66 116.42 118.62 1kfi h ASP 152 Ca 0.11 0.07 -0.01 0.00 -0.73 0.00 0.00 57.03 56.47 1kfi h ASP 152 Cb 0.59 -0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 39.08 1kfi h ASP 152 CO -0.61 0.24 -0.20 0.15 -1.03 0.00 0.00 179.24 177.79 1kfi h PHE 153 N 0.60 -0.52 -0.25 4.15 3.57 -1.72 -1.97 116.94 120.78 1kfi h PHE 153 Ca 0.38 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.87 1kfi h PHE 153 Cb 0.46 0.18 -0.01 0.00 2.79 0.00 0.00 35.95 39.37 1kfi h PHE 153 CO -0.11 -0.31 0.13 1.79 -2.23 0.00 0.00 178.31 177.57 1kfi h THR 154 N -0.52 1.09 -0.42 4.41 1.35 -0.67 -1.46 112.91 116.69 1kfi h THR 154 Ca -0.04 -0.25 -0.02 0.00 -0.55 0.00 0.00 66.41 65.56 1kfi h THR 154 Cb 0.42 0.76 -0.02 0.00 -1.73 0.00 0.00 68.15 67.58 1kfi h THR 154 CO 0.05 0.10 0.20 0.44 -0.25 0.00 0.00 175.52 176.06 1kfi h ASP 155 N 0.35 0.56 -0.73 5.36 3.45 -0.51 -2.25 116.42 122.64 1kfi h ASP 155 Ca 0.09 -0.13 0.06 0.00 0.43 0.00 0.00 57.03 57.48 1kfi h ASP 155 Cb 0.03 -0.14 -0.06 0.00 -0.56 0.00 0.00 39.33 38.60 1kfi h ASP 155 CO -0.01 0.53 0.43 1.56 -1.57 0.00 0.00 179.24 180.17 1kfi h GLN 156 N 0.54 0.76 0.26 3.56 1.08 -0.53 -1.15 115.11 119.63 1kfi h GLN 156 Ca 0.14 -0.05 0.01 0.00 -1.45 0.00 0.00 58.65 57.31 1kfi h GLN 156 Cb 0.13 -0.17 -0.03 0.00 -0.05 0.00 0.00 27.48 27.35 1kfi h GLN 156 CO -0.02 0.50 -0.41 0.82 -0.95 0.00 0.00 178.83 178.78 1kfi h ILE 157 N 0.78 0.18 -0.30 2.54 2.04 -0.96 -0.84 117.51 120.95 1kfi h ILE 157 Ca 0.32 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.25 1kfi h ILE 157 Cb 0.18 0.18 -0.07 0.00 -0.74 0.00 0.00 36.82 36.36 1kfi h ILE 157 CO -0.18 0.00 -0.21 0.22 0.00 0.00 0.00 178.15 177.98 1kfi h TYR 158 N -0.73 -0.54 -0.55 1.37 3.20 -0.85 -0.83 116.97 118.04 1kfi h TYR 158 Ca -0.01 0.04 0.11 0.00 3.14 0.00 0.00 58.73 62.01 1kfi h TYR 158 Cb 0.70 0.28 -0.10 0.00 1.54 0.00 0.00 36.73 39.15 1kfi h TYR 158 CO -0.29 -0.29 -0.14 1.15 -1.64 0.00 0.00 178.16 176.95 1kfi h THR 159 N -0.18 0.44 -0.85 1.81 2.02 -0.85 -0.19 112.91 115.11 1kfi h THR 159 Ca 0.16 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.36 1kfi h THR 159 Cb 0.42 0.44 -0.05 0.00 -1.74 0.00 0.00 68.15 67.23 1kfi h THR 159 CO -0.41 0.00 0.56 0.45 0.37 0.00 0.00 175.52 176.49 1kfi h HIS 160 N -0.00 1.04 0.00 3.16 3.86 -0.03 -1.45 115.15 121.72 1kfi h HIS 160 Ca 0.26 0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 59.47 1kfi h HIS 160 Cb 0.41 -0.35 -0.00 0.00 1.06 0.00 0.00 27.41 28.52 1kfi h HIS 160 CO -0.46 0.62 -0.11 1.79 0.86 0.00 0.00 177.93 180.62 1kfi h THR 161 N 1.09 0.76 -0.01 2.45 1.35 0.29 0.25 112.91 119.09 1kfi h THR 161 Ca 0.33 -0.45 0.00 0.00 -0.55 0.00 0.00 66.41 65.74 1kfi h THR 161 Cb -0.03 1.27 0.00 0.00 -1.73 0.00 0.00 68.15 67.66 1kfi h THR 161 CO -0.09 0.11 -0.27 0.35 -0.25 0.00 0.00 175.52 175.38 1kfi n THR 162 N -3.93 0.00 -0.02 6.82 -2.24 -0.57 -3.77 114.28 110.57 1kfi n THR 162 Ca -0.02 -0.09 -0.01 0.00 -2.27 0.00 0.00 64.05 61.65 1kfi n THR 162 Cb 0.21 0.26 -0.03 0.00 -2.10 0.00 0.00 70.33 68.66 1kfi n THR 162 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1kfi n LYS 163 N -0.88 2.66 -1.51 -0.78 5.02 -0.60 -4.91 118.16 117.16 1kfi n LYS 163 Ca 0.11 -0.01 -0.57 0.00 -2.02 0.00 0.00 58.31 55.83 1kfi n LYS 163 Cb 0.33 -1.11 -0.07 0.00 -0.02 0.00 0.00 35.03 34.16 1kfi n LYS 163 CO 0.00 0.00 0.00 1.51 -0.52 0.00 0.00 177.40 178.39 1kfi n ILE 164 N -2.06 0.21 -0.03 -0.18 3.06 0.76 -4.88 119.36 116.24 1kfi n ILE 164 Ca -0.06 -0.05 0.00 0.00 -2.50 0.00 0.00 62.75 60.14 1kfi n ILE 164 Cb 0.54 -0.14 0.00 0.00 0.54 0.00 0.00 39.64 40.58 1kfi n ILE 164 CO 0.00 0.00 0.00 0.29 -2.50 0.00 0.00 176.55 174.34 1kfi n LYS 165 N 1.60 4.48 -3.66 9.51 5.02 -1.26 -3.43 118.16 130.42 1kfi n LYS 165 Ca 0.19 -0.06 -0.06 0.00 -2.02 0.00 0.00 58.31 56.37 1kfi n LYS 165 Cb 0.12 -0.47 -0.02 0.00 -0.02 0.00 0.00 35.03 34.64 1kfi n LYS 165 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 1kfi s GLU 166 N -0.66 1.11 0.02 1.97 -1.05 -1.26 0.45 118.70 119.29 1kfi s GLU 166 Ca 0.00 -0.55 -0.18 0.00 -0.15 0.00 0.00 54.97 54.09 1kfi s GLU 166 Cb 0.00 0.42 0.03 0.00 -0.44 0.00 0.00 34.13 34.14 1kfi s GLU 166 CO 0.00 -0.50 0.39 1.52 0.95 0.00 0.00 175.26 177.62 1kfi s TYR 167 N -3.29 -0.25 -0.06 4.83 -0.85 -0.35 -4.87 117.35 112.51 1kfi s TYR 167 Ca 0.09 0.27 -0.21 0.00 -0.52 0.00 0.00 57.07 56.70 1kfi s TYR 167 Cb -0.01 0.19 -0.04 0.00 0.38 0.00 0.00 41.96 42.47 1kfi s TYR 167 CO -0.02 -0.52 0.59 -0.51 -1.52 0.00 0.00 175.55 173.57 1kfi s LEU 168 N -1.79 4.34 0.00 -3.49 1.43 -1.26 -1.33 118.68 116.57 1kfi s LEU 168 Ca -0.08 1.05 0.00 0.00 -1.03 0.00 0.00 54.13 54.08 1kfi s LEU 168 Cb -0.02 -2.89 -0.00 0.00 0.03 0.00 0.00 46.19 43.31 1kfi s LEU 168 CO 0.00 -0.00 0.06 1.07 0.23 0.00 0.00 176.35 177.71 1kfi n THR 169 N 3.38 0.00 -3.74 5.49 5.66 -0.68 -4.39 114.28 119.99 1kfi n THR 169 Ca -0.05 -0.29 -0.13 0.00 -3.05 0.00 0.00 64.05 60.53 1kfi n THR 169 Cb 0.51 0.17 -0.10 0.00 -1.55 0.00 0.00 70.33 69.36 1kfi n THR 169 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 1kfi s VAL 170 N -2.41 0.02 -0.71 1.08 0.11 -1.26 0.01 120.40 117.23 1kfi s VAL 170 Ca 0.05 -0.14 -0.20 0.00 -2.93 0.00 0.00 61.98 58.76 1kfi s VAL 170 Cb -0.00 -0.58 0.10 0.00 -1.53 0.00 0.00 36.38 34.37 1kfi s VAL 170 CO 0.03 -0.08 0.92 -1.81 -3.33 0.00 0.00 175.10 170.84 1kfi s ASP 171 N -0.29 6.31 -0.19 3.54 1.01 -1.26 -4.96 116.67 120.83 1kfi s ASP 171 Ca -0.04 -1.45 -0.20 0.00 0.71 0.00 0.00 52.55 51.57 1kfi s ASP 171 Cb -0.03 -2.37 0.05 0.00 1.01 0.00 0.00 42.92 41.58 1kfi s ASP 171 CO 0.02 -1.22 0.56 -0.47 0.21 0.00 0.00 175.17 174.27 1kfi s TYR 172 N 3.17 -0.60 -1.28 4.23 5.04 -1.26 -4.65 117.35 122.00 1kfi s TYR 172 Ca 0.21 1.43 -0.09 0.00 -2.44 0.00 0.00 57.07 56.19 1kfi s TYR 172 Cb -0.16 0.22 0.17 0.00 0.35 0.00 0.00 41.96 42.54 1kfi s TYR 172 CO 0.03 -0.32 1.90 0.39 -1.34 0.00 0.00 175.55 176.22 1kfi n GLU 173 N 2.62 3.72 0.00 4.97 1.02 -1.26 -4.75 120.64 126.96 1kfi n GLU 173 Ca -0.14 -3.55 0.13 0.00 -0.02 0.00 0.00 57.16 53.57 1kfi n GLU 173 Cb 0.56 -2.89 0.57 0.00 -0.02 0.00 0.00 31.44 29.66 1kfi n GLU 173 CO 0.00 0.00 0.00 0.74 1.18 0.00 0.00 177.13 179.05 1kfi h PHE 174 N 5.65 0.26 -0.46 -0.32 0.04 -1.98 -2.58 116.94 117.55 1kfi h PHE 174 Ca 0.41 0.01 0.08 0.00 2.80 0.00 0.00 57.97 61.26 1kfi h PHE 174 Cb 0.61 -0.08 -0.06 0.00 2.20 0.00 0.00 35.95 38.61 1kfi h PHE 174 CO 1.27 0.13 0.08 0.93 -0.60 0.00 0.00 178.31 180.11 1kfi h GLU 175 N 0.25 0.20 -0.96 1.51 4.39 -1.85 -0.42 114.58 117.69 1kfi h GLU 175 Ca 0.22 -0.01 -0.10 0.00 0.34 0.00 0.00 59.36 59.80 1kfi h GLU 175 Cb 0.53 -0.05 -0.06 0.00 -0.10 0.00 0.00 28.75 29.07 1kfi h GLU 175 CO -0.04 0.13 0.13 0.36 -1.16 0.00 0.00 179.01 178.43 1kfi n LYS 176 N -5.12 1.59 0.00 2.33 2.85 -0.97 -3.39 118.16 115.44 1kfi n LYS 176 Ca 0.04 -0.86 0.00 0.00 -1.05 0.00 0.00 58.31 56.45 1kfi n LYS 176 Cb 0.22 -1.45 0.00 0.00 -0.65 0.00 0.00 35.03 33.15 1kfi n LYS 176 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 1kfi n HIS 177 N 0.08 0.00 -5.01 5.58 8.25 -0.75 -5.07 115.22 118.30 1kfi n HIS 177 Ca 0.14 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 57.28 1kfi n HIS 177 Cb 0.73 0.00 -0.15 0.00 1.12 0.00 0.00 29.99 31.69 1kfi n HIS 177 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1kfi s ILE 178 N -0.33 2.65 -0.35 1.59 1.01 -0.24 -5.04 121.20 120.50 1kfi s ILE 178 Ca 0.00 -0.84 0.01 0.00 0.00 0.00 0.00 60.65 59.82 1kfi s ILE 178 Cb 0.00 -2.04 0.09 0.00 0.01 0.00 0.00 42.46 40.52 1kfi s ILE 178 CO 0.00 0.56 0.07 0.21 0.00 0.00 0.00 174.94 175.79 1kfi s ASN 179 N -0.14 4.91 0.60 3.58 3.84 -1.26 -4.74 114.94 121.72 1kfi s ASN 179 Ca -0.02 -1.92 0.32 0.00 0.21 0.00 0.00 52.86 51.45 1kfi s ASN 179 Cb -0.14 -1.70 1.90 0.00 -0.55 0.00 0.00 41.25 40.77 1kfi s ASN 179 CO 0.04 -0.40 2.26 -0.07 -2.79 0.00 0.00 177.10 176.14 1kfi h LEU 180 N 7.82 0.00 -0.32 3.21 3.38 -1.95 0.34 115.31 127.78 1kfi h LEU 180 Ca -0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.86 1kfi h LEU 180 Cb 1.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.79 1kfi h LEU 180 CO 0.57 0.01 -0.08 0.47 0.09 0.00 0.00 178.44 179.50 1kfi n ASP 181 N -3.69 0.58 -4.15 -0.43 8.00 -1.26 0.30 116.55 115.91 1kfi n ASP 181 Ca -0.03 -0.78 -0.33 0.00 0.71 0.00 0.00 54.79 54.35 1kfi n ASP 181 Cb 0.09 -0.04 -0.15 0.00 -0.02 0.00 0.00 41.12 41.00 1kfi n ASP 181 CO 0.00 0.00 0.00 -1.58 -0.39 0.00 0.00 177.20 175.23 1kfi s GLN 182 N -2.34 2.74 0.53 -1.24 -0.44 0.11 -4.81 119.66 114.21 1kfi s GLN 182 Ca 0.33 -1.02 -0.21 0.00 -2.50 0.00 0.00 55.36 51.95 1kfi s GLN 182 Cb 0.20 -2.84 -0.05 0.00 -1.64 0.00 0.00 33.01 28.68 1kfi s GLN 182 CO 0.44 -0.38 1.26 0.42 0.50 0.00 0.00 175.29 177.53 1kfi s ILE 183 N 1.26 2.54 -5.00 -2.34 1.01 -1.26 -4.73 121.20 112.67 1kfi s ILE 183 Ca -0.01 0.39 0.00 0.00 0.00 0.00 0.00 60.65 61.03 1kfi s ILE 183 Cb -0.16 -3.19 0.00 0.00 0.01 0.00 0.00 42.46 39.12 1kfi s ILE 183 CO -0.07 -0.02 0.00 0.61 0.00 0.00 0.00 174.94 175.46 1kfi n GLY 184 N 0.59 0.11 3.52 6.18 0.00 -0.22 -4.97 105.19 110.39 1kfi n GLY 184 Ca 0.10 -1.79 -0.35 0.00 0.00 0.00 0.00 46.02 43.99 1kfi n GLY 184 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1kfi s VAL 185 N -1.43 4.23 -0.48 1.61 1.01 -1.26 -1.51 120.40 122.56 1kfi s VAL 185 Ca 0.00 -0.23 -0.05 0.00 0.00 0.00 0.00 61.98 61.70 1kfi s VAL 185 Cb 0.00 -2.90 0.13 0.00 0.00 0.00 0.00 36.38 33.60 1kfi s VAL 185 CO 0.00 0.45 0.31 -0.31 0.00 0.00 0.00 175.10 175.54 1kfi s TYR 186 N 0.70 3.51 0.08 5.22 1.51 0.05 -5.00 117.35 123.42 1kfi s TYR 186 Ca 0.01 -2.27 -0.24 0.00 -1.01 0.00 0.00 57.07 53.56 1kfi s TYR 186 Cb -0.14 -3.34 -0.07 0.00 -0.11 0.00 0.00 41.96 38.31 1kfi s TYR 186 CO 0.02 -0.96 0.71 0.15 -1.11 0.00 0.00 175.55 174.36 1kfi s LYS 187 N 0.99 4.45 0.21 -0.62 1.02 -1.26 -1.69 119.74 122.83 1kfi s LYS 187 Ca 0.09 1.00 0.05 0.00 0.02 0.00 0.00 55.97 57.13 1kfi s LYS 187 Cb -0.23 -3.30 -0.05 0.00 -0.52 0.00 0.00 37.83 33.72 1kfi s LYS 187 CO -0.03 0.45 -0.07 -0.06 -0.92 0.00 0.00 175.35 174.72 1kfi s PHE 188 N -0.63 1.58 -0.06 3.18 0.40 0.33 -4.97 117.98 117.80 1kfi s PHE 188 Ca 0.35 -0.76 0.01 0.00 -0.60 0.00 0.00 56.93 55.93 1kfi s PHE 188 Cb -0.21 -0.85 -0.03 0.00 0.51 0.00 0.00 43.02 42.44 1kfi s PHE 188 CO 0.23 0.14 -0.08 -2.00 0.70 0.00 0.00 175.22 174.20 1kfi s GLU 189 N -3.76 2.70 0.25 0.44 2.56 -1.26 -2.31 118.70 117.31 1kfi s GLU 189 Ca 0.24 -0.58 0.01 0.00 0.00 0.00 0.00 54.97 54.64 1kfi s GLU 189 Cb 0.03 -2.55 -0.03 0.00 2.00 0.00 0.00 34.13 33.58 1kfi s GLU 189 CO 0.07 0.66 0.21 0.20 -0.56 0.00 0.00 175.26 175.83 1kfi s GLY 190 N -0.79 1.65 -0.74 -1.50 0.00 0.16 0.44 107.32 106.54 1kfi s GLY 190 Ca 0.12 -1.76 0.01 0.00 0.00 0.00 0.00 44.72 43.09 1kfi s GLY 190 CO 0.01 -1.36 0.57 -1.59 0.00 0.00 0.00 173.10 170.73 1kfi s THR 191 N -3.90 3.59 0.04 0.90 2.01 -0.67 -4.61 115.64 113.00 1kfi s THR 191 Ca 0.38 -3.76 0.00 0.00 0.31 0.00 0.00 61.69 58.62 1kfi s THR 191 Cb 0.05 -3.31 -0.03 0.00 0.01 0.00 0.00 72.50 69.22 1kfi s THR 191 CO 0.17 -0.99 -0.04 -0.13 -0.69 0.00 0.00 174.62 172.93 1kfi s ARG 192 N -1.02 0.52 -0.12 4.92 0.52 -1.24 -3.86 118.95 118.66 1kfi s ARG 192 Ca 0.23 -0.93 -0.29 0.00 -0.52 0.00 0.00 55.73 54.22 1kfi s ARG 192 Cb -0.11 0.02 -0.02 0.00 0.52 0.00 0.00 34.95 35.37 1kfi s ARG 192 CO -0.11 -0.05 1.16 -0.51 0.02 0.00 0.00 175.30 175.82 1kfi s LEU 193 N -2.16 4.21 0.00 2.53 1.43 -1.26 -3.38 118.68 120.05 1kfi s LEU 193 Ca -0.04 1.66 0.00 0.00 -1.03 0.00 0.00 54.13 54.72 1kfi s LEU 193 Cb -0.02 -3.55 0.00 0.00 0.03 0.00 0.00 46.19 42.65 1kfi s LEU 193 CO -0.04 -0.63 0.00 -0.62 0.23 0.00 0.00 176.35 175.29 1kfi n GLU 194 N 5.78 0.00 -3.37 1.70 1.02 -1.26 -4.93 120.64 119.58 1kfi n GLU 194 Ca 0.12 0.00 -0.15 0.00 -0.02 0.00 0.00 57.16 57.11 1kfi n GLU 194 Cb 0.46 -2.49 -0.08 0.00 -0.02 0.00 0.00 31.44 29.31 1kfi n GLU 194 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 1kfi s LYS 195 N -0.10 0.38 0.00 3.49 2.20 -1.22 -5.00 119.74 119.50 1kfi s LYS 195 Ca 0.00 -0.14 0.25 0.00 -0.36 0.00 0.00 55.97 55.72 1kfi s LYS 195 Cb 0.00 -0.56 0.48 0.00 -1.51 0.00 0.00 37.83 36.25 1kfi s LYS 195 CO 0.00 -1.05 1.39 -1.13 -0.36 0.00 0.00 175.35 174.20 1kfi n SER 196 N 5.22 1.19 -4.71 1.43 3.41 -1.26 -3.69 113.62 115.20 1kfi n SER 196 Ca 0.00 -0.96 -0.23 0.00 -0.26 0.00 0.00 58.87 57.42 1kfi n SER 196 Cb 0.47 0.29 -0.06 0.00 -0.26 0.00 0.00 64.21 64.64 1kfi n SER 196 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 1kfi s HIS 197 N -2.59 2.77 -0.16 7.33 3.76 -1.26 0.41 115.29 125.54 1kfi s HIS 197 Ca 0.20 -0.26 -0.29 0.00 -0.15 0.00 0.00 55.06 54.56 1kfi s HIS 197 Cb 0.19 -1.40 0.10 0.00 1.11 0.00 0.00 32.58 32.57 1kfi s HIS 197 CO 0.58 0.49 0.87 0.12 -0.85 0.00 0.00 174.74 175.95 1kfi s PHE 198 N -2.33 -0.53 0.11 1.40 5.36 -0.98 -4.80 117.98 116.21 1kfi s PHE 198 Ca 0.34 1.05 -0.19 0.00 -0.96 0.00 0.00 56.93 57.17 1kfi s PHE 198 Cb -0.05 0.40 0.05 0.00 -0.34 0.00 0.00 43.02 43.07 1kfi s PHE 198 CO 0.22 -0.41 0.47 -1.83 -1.46 0.00 0.00 175.22 172.21 1kfi s GLU 199 N -0.69 1.09 -0.07 10.12 -1.05 -1.02 0.12 118.70 127.21 1kfi s GLU 199 Ca -0.03 -0.53 0.03 0.00 -0.15 0.00 0.00 54.97 54.28 1kfi s GLU 199 Cb -0.02 0.49 0.01 0.00 -0.44 0.00 0.00 34.13 34.17 1kfi s GLU 199 CO 0.03 -0.43 -0.15 0.08 0.95 0.00 0.00 175.26 175.73 1kfi s VAL 200 N -3.40 1.37 -0.25 1.83 1.01 -0.68 -1.60 120.40 118.69 1kfi s VAL 200 Ca 0.00 -0.63 0.02 0.00 0.00 0.00 0.00 61.98 61.37 1kfi s VAL 200 Cb 0.01 -1.22 0.05 0.00 0.00 0.00 0.00 36.38 35.21 1kfi s VAL 200 CO -0.09 0.41 -0.12 -0.75 0.00 0.00 0.00 175.10 174.55 1kfi s LYS 201 N 0.52 2.47 -0.45 2.72 2.20 0.10 -0.77 119.74 126.54 1kfi s LYS 201 Ca -0.14 -1.19 -0.21 0.00 -0.36 0.00 0.00 55.97 54.06 1kfi s LYS 201 Cb -0.16 -2.85 0.03 0.00 -1.51 0.00 0.00 37.83 33.33 1kfi s LYS 201 CO 0.05 -0.48 0.65 0.54 -0.36 0.00 0.00 175.35 175.75 1kfi s VAL 202 N 1.18 4.82 0.32 4.02 0.11 -0.57 -1.44 120.40 128.83 1kfi s VAL 202 Ca -0.05 0.08 0.03 0.00 -2.93 0.00 0.00 61.98 59.11 1kfi s VAL 202 Cb -0.18 -4.22 -0.03 0.00 -1.53 0.00 0.00 36.38 30.42 1kfi s VAL 202 CO -0.06 -0.63 0.48 0.54 -3.33 0.00 0.00 175.10 172.10 1kfi s VAL 203 N 2.84 4.97 0.16 2.04 0.11 -0.13 -1.06 120.40 129.34 1kfi s VAL 203 Ca 0.22 -0.70 -0.32 0.00 -2.93 0.00 0.00 61.98 58.26 1kfi s VAL 203 Cb -0.14 -3.79 -0.10 0.00 -1.53 0.00 0.00 36.38 30.82 1kfi s VAL 203 CO 0.19 -0.42 1.61 -0.62 -3.33 0.00 0.00 175.10 172.52 1kfi s ASP 204 N -4.04 6.55 0.41 3.54 -1.08 -1.26 -0.90 116.67 119.88 1kfi s ASP 204 Ca 0.39 2.65 0.22 0.00 -0.52 0.00 0.00 52.55 55.28 1kfi s ASP 204 Cb -0.09 -2.59 0.73 0.00 -1.46 0.00 0.00 42.92 39.50 1kfi s ASP 204 CO 0.33 -0.86 1.74 0.71 0.52 0.00 0.00 175.17 177.62 1kfi h THR 205 N 4.09 0.62 0.00 1.71 1.35 -1.89 -3.35 112.91 115.45 1kfi h THR 205 Ca -0.43 -1.34 -0.27 0.00 -0.55 0.00 0.00 66.41 63.82 1kfi h THR 205 Cb 1.20 1.90 -0.05 0.00 -1.73 0.00 0.00 68.15 69.48 1kfi h THR 205 CO 0.92 0.27 -2.01 1.33 -0.25 0.00 0.00 175.52 175.78 1kfi n VAL 206 N -3.36 1.02 0.00 6.82 0.24 -1.26 -4.73 118.33 117.05 1kfi n VAL 206 Ca 0.01 -0.61 0.00 0.00 -2.04 0.00 0.00 64.34 61.69 1kfi n VAL 206 Cb 0.49 -0.65 0.00 0.00 -1.47 0.00 0.00 33.84 32.22 1kfi n VAL 206 CO 0.00 0.00 0.00 1.67 -2.14 0.00 0.00 176.83 176.36 1kfi n GLN 207 N -2.58 0.00 -0.13 7.34 -0.06 -1.26 -1.26 117.38 119.43 1kfi n GLN 207 Ca -0.25 0.59 -0.09 0.00 -2.00 0.00 0.00 57.00 55.26 1kfi n GLN 207 Cb 0.97 -0.91 -0.00 0.00 -4.06 0.00 0.00 30.24 26.24 1kfi n GLN 207 CO 0.00 0.00 0.00 -0.44 -0.20 0.00 0.00 177.06 176.42 1kfi h ASP 208 N 0.00 0.51 -0.46 1.69 3.32 -1.87 -2.33 116.42 117.28 1kfi h ASP 208 Ca 0.00 -0.10 0.07 0.00 0.02 0.00 0.00 57.03 57.02 1kfi h ASP 208 Cb 0.00 -0.13 -0.06 0.00 0.22 0.00 0.00 39.33 39.36 1kfi h ASP 208 CO 0.00 0.47 0.12 0.22 -1.72 0.00 0.00 179.24 178.33 1kfi h TYR 209 N 0.52 0.21 -0.31 4.55 3.20 -1.77 -1.88 116.97 121.49 1kfi h TYR 209 Ca 0.14 0.03 0.03 0.00 3.14 0.00 0.00 58.73 62.06 1kfi h TYR 209 Cb 0.08 -0.03 -0.03 0.00 1.54 0.00 0.00 36.73 38.30 1kfi h TYR 209 CO -0.02 0.04 0.14 1.15 -1.64 0.00 0.00 178.16 177.83 1kfi h THR 210 N 0.27 0.96 -0.77 1.81 2.02 -0.99 -1.46 112.91 114.75 1kfi h THR 210 Ca 0.22 -0.10 0.01 0.00 0.77 0.00 0.00 66.41 67.31 1kfi h THR 210 Cb 0.26 0.65 -0.04 0.00 -1.74 0.00 0.00 68.15 67.28 1kfi h THR 210 CO -0.26 0.05 0.50 1.56 0.37 0.00 0.00 175.52 177.74 1kfi h GLN 211 N 0.29 1.02 -0.76 6.66 4.20 -1.05 0.26 115.11 125.73 1kfi h GLN 211 Ca 0.13 -0.07 -0.04 0.00 0.06 0.00 0.00 58.65 58.74 1kfi h GLN 211 Cb 0.07 -0.23 -0.03 0.00 0.30 0.00 0.00 27.48 27.59 1kfi h GLN 211 CO -0.11 0.68 0.34 1.25 -0.67 0.00 0.00 178.83 180.32 1kfi h LEU 212 N 1.04 1.02 -0.42 1.46 5.85 -0.76 -1.38 115.31 122.12 1kfi h LEU 212 Ca 0.28 -0.15 -0.12 0.00 0.84 0.00 0.00 57.88 58.72 1kfi h LEU 212 Cb -0.11 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 40.65 1kfi h LEU 212 CO -0.06 0.89 -0.22 0.24 -0.34 0.00 0.00 178.44 178.95 1kfi h MET 213 N 1.08 0.89 0.00 1.25 2.86 -0.15 0.08 114.93 120.94 1kfi h MET 213 Ca 0.26 -0.40 -0.01 0.00 -2.06 0.00 0.00 59.70 57.49 1kfi h MET 213 Cb 0.16 -0.02 -0.00 0.00 0.06 0.00 0.00 31.60 31.80 1kfi h MET 213 CO -0.03 1.05 -0.04 1.96 1.06 0.00 0.00 176.91 180.91 1kfi h GLN 214 N 0.71 0.00 0.20 1.72 4.20 -0.16 0.11 115.11 121.90 1kfi h GLN 214 Ca 0.09 0.00 -0.34 0.00 0.06 0.00 0.00 58.65 58.46 1kfi h GLN 214 Cb 0.79 0.00 0.02 0.00 0.30 0.00 0.00 27.48 28.58 1kfi h GLN 214 CO 0.06 0.04 -1.65 -0.22 -0.67 0.00 0.00 178.83 176.39 1kfi h LYS 215 N 0.00 0.43 -0.01 1.46 3.64 -0.84 -3.36 116.57 117.89 1kfi h LYS 215 Ca -0.00 -0.73 -0.12 0.00 -1.27 0.00 0.00 60.65 58.53 1kfi h LYS 215 Cb 0.07 0.27 -0.02 0.00 -0.41 0.00 0.00 32.23 32.15 1kfi h LYS 215 CO 0.00 1.34 -0.56 -0.07 -2.27 0.00 0.00 179.45 177.89 1kfi h LEU 216 N 0.12 0.04 -9.25 5.20 3.38 -0.32 -3.46 115.31 111.02 1kfi h LEU 216 Ca -0.31 -0.02 -0.56 0.00 0.09 0.00 0.00 57.88 57.08 1kfi h LEU 216 Cb 2.11 -0.01 -0.14 0.00 0.09 0.00 0.00 40.66 42.71 1kfi h LEU 216 CO 0.21 0.59 -0.69 -0.36 0.09 0.00 0.00 178.44 178.28 1kfi s PHE 217 N -3.76 2.17 -0.69 1.13 0.08 0.33 -4.88 117.98 112.35 1kfi s PHE 217 Ca -0.02 -0.55 -0.17 0.00 0.12 0.00 0.00 56.93 56.31 1kfi s PHE 217 Cb 0.13 -1.18 0.15 0.00 -0.57 0.00 0.00 43.02 41.54 1kfi s PHE 217 CO 0.76 0.48 0.73 0.34 -0.10 0.00 0.00 175.22 177.43 1kfi s ASP 218 N -3.51 6.41 0.50 1.36 -1.08 -1.26 -4.66 116.67 114.42 1kfi s ASP 218 Ca 0.30 -1.95 0.21 0.00 -0.52 0.00 0.00 52.55 50.59 1kfi s ASP 218 Cb 0.02 -2.27 1.28 0.00 -1.46 0.00 0.00 42.92 40.49 1kfi s ASP 218 CO 0.14 -0.90 2.07 -0.26 0.52 0.00 0.00 175.17 176.74 1kfi h PHE 219 N 8.67 0.00 -0.30 -5.34 -1.00 -1.92 -2.03 116.94 115.03 1kfi h PHE 219 Ca -0.12 0.00 -0.14 0.00 2.81 0.00 0.00 57.97 60.52 1kfi h PHE 219 Cb 1.07 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.63 1kfi h PHE 219 CO 0.91 0.12 -0.37 -0.44 -1.61 0.00 0.00 178.31 176.92 1kfi h ASP 220 N 0.00 0.84 -0.65 2.17 3.45 -1.98 0.53 116.42 120.78 1kfi h ASP 220 Ca -0.00 -0.49 0.04 0.00 0.43 0.00 0.00 57.03 57.00 1kfi h ASP 220 Cb 0.25 -0.24 -0.04 0.00 -0.56 0.00 0.00 39.33 38.73 1kfi h ASP 220 CO 0.02 1.16 0.39 0.25 -1.57 0.00 0.00 179.24 179.49 1kfi h LEU 221 N 0.54 0.63 -0.47 1.55 5.85 -1.85 -2.02 115.31 119.54 1kfi h LEU 221 Ca 0.04 0.01 -0.16 0.00 0.84 0.00 0.00 57.88 58.61 1kfi h LEU 221 Cb 0.95 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.86 1kfi h LEU 221 CO 0.09 0.43 -0.43 -0.07 -0.34 0.00 0.00 178.44 178.12 1kfi h LEU 222 N 0.76 0.85 -1.86 2.25 3.38 -1.18 -2.71 115.31 116.79 1kfi h LEU 222 Ca 0.27 -0.40 -0.02 0.00 0.09 0.00 0.00 57.88 57.82 1kfi h LEU 222 Cb 0.07 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.57 1kfi h LEU 222 CO -0.13 1.16 -0.07 0.11 0.09 0.00 0.00 178.44 179.60 1kfi h LYS 223 N 0.64 0.00 -0.04 1.13 1.57 -0.51 0.40 116.57 119.75 1kfi h LYS 223 Ca 0.04 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.70 1kfi h LYS 223 Cb 1.00 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.29 1kfi h LYS 223 CO 0.10 0.07 -0.57 0.78 -0.57 0.00 0.00 179.45 179.26 1kfi h GLY 224 N 0.23 0.13 0.74 3.86 0.00 -1.07 0.39 103.07 107.34 1kfi h GLY 224 Ca -0.00 -0.16 -0.03 0.00 0.00 0.00 0.00 47.33 47.14 1kfi h GLY 224 CO 0.01 0.14 -0.04 -2.00 0.00 0.00 0.00 176.54 174.65 1kfi h LEU 225 N 0.09 0.27 -1.82 3.11 6.46 -0.72 -2.75 115.31 119.95 1kfi h LEU 225 Ca -0.00 -0.38 -0.02 0.00 -0.12 0.00 0.00 57.88 57.36 1kfi h LEU 225 Cb 1.03 -0.07 -0.00 0.00 -0.73 0.00 0.00 40.66 40.88 1kfi h LEU 225 CO 0.08 0.59 -0.09 -0.26 -0.62 0.00 0.00 178.44 178.13 1kfi h PHE 226 N -0.05 0.00 -0.01 1.25 -1.00 -1.06 -1.42 116.94 114.64 1kfi h PHE 226 Ca 0.03 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.81 1kfi h PHE 226 Cb 0.47 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.03 1kfi h PHE 226 CO 0.06 0.09 -0.00 0.43 -1.61 0.00 0.00 178.31 177.28 1kfi n SER 227 N -3.39 0.80 -4.64 2.17 7.64 0.11 -4.80 113.62 111.51 1kfi n SER 227 Ca -0.01 -1.25 -0.43 0.00 1.01 0.00 0.00 58.87 58.19 1kfi n SER 227 Cb 0.26 -0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.44 1kfi n SER 227 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 1kfi s ASN 228 N -2.01 6.93 0.52 6.43 3.84 -0.54 -4.91 114.94 125.20 1kfi s ASN 228 Ca 0.42 1.23 0.24 0.00 0.21 0.00 0.00 52.86 54.96 1kfi s ASN 228 Cb 0.21 -2.54 1.36 0.00 -0.55 0.00 0.00 41.25 39.73 1kfi s ASN 228 CO 0.35 -0.85 1.99 0.07 -2.79 0.00 0.00 177.10 175.87 1kfi h LYS 229 N 8.15 0.04 -0.07 0.43 2.10 -1.87 0.03 116.57 125.38 1kfi h LYS 229 Ca -0.22 -0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.43 1kfi h LYS 229 Cb 1.07 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 32.39 1kfi h LYS 229 CO 1.01 0.03 0.00 -0.25 -2.00 0.00 0.00 179.45 178.24 1kfi n ASP 230 N -4.39 1.30 -4.65 7.07 9.92 -1.26 -4.83 116.55 119.71 1kfi n ASP 230 Ca 0.10 -1.53 -0.36 0.00 -0.53 0.00 0.00 54.79 52.48 1kfi n ASP 230 Cb 0.59 -0.04 -0.10 0.00 -0.64 0.00 0.00 41.12 40.93 1kfi n ASP 230 CO 0.00 0.00 0.00 0.12 0.13 0.00 0.00 177.20 177.45 1kfi s PHE 231 N -1.92 3.29 -0.03 1.24 5.36 -0.01 -4.90 117.98 121.02 1kfi s PHE 231 Ca 0.36 0.14 0.06 0.00 -0.96 0.00 0.00 56.93 56.53 1kfi s PHE 231 Cb 0.19 -2.20 -0.01 0.00 -0.34 0.00 0.00 43.02 40.66 1kfi s PHE 231 CO 0.30 0.09 -0.21 -1.54 -1.46 0.00 0.00 175.22 172.40 1kfi s SER 232 N 0.80 2.56 -0.00 6.13 1.04 -1.26 -4.87 113.70 118.10 1kfi s SER 232 Ca 0.06 -0.41 0.03 0.00 0.48 0.00 0.00 55.95 56.11 1kfi s SER 232 Cb -0.13 -0.50 -0.01 0.00 0.10 0.00 0.00 66.02 65.48 1kfi s SER 232 CO 0.02 0.23 -0.10 0.12 0.98 0.00 0.00 173.24 174.49 1kfi s PHE 233 N -0.27 0.92 -0.02 5.02 5.36 -1.26 -1.92 117.98 125.81 1kfi s PHE 233 Ca 0.02 -0.20 0.00 0.00 -0.96 0.00 0.00 56.93 55.79 1kfi s PHE 233 Cb -0.10 -0.58 0.02 0.00 -0.34 0.00 0.00 43.02 42.01 1kfi s PHE 233 CO 0.01 -0.01 0.02 0.50 -1.46 0.00 0.00 175.22 174.28 1kfi s ARG 234 N -0.38 -0.01 -0.08 10.12 6.06 -0.21 -4.55 118.95 129.90 1kfi s ARG 234 Ca 0.03 0.14 0.01 0.00 -2.50 0.00 0.00 55.73 53.40 1kfi s ARG 234 Cb -0.04 -0.21 0.02 0.00 0.06 0.00 0.00 34.95 34.78 1kfi s ARG 234 CO -0.00 -0.13 -0.07 0.12 -2.50 0.00 0.00 175.30 172.72 1kfi s PHE 235 N 0.83 1.22 -0.37 5.12 5.36 -0.03 -1.87 117.98 128.22 1kfi s PHE 235 Ca -0.07 -0.50 -0.11 0.00 -0.96 0.00 0.00 56.93 55.29 1kfi s PHE 235 Cb -0.10 -1.01 0.03 0.00 -0.34 0.00 0.00 43.02 41.60 1kfi s PHE 235 CO -0.02 -0.35 0.21 0.34 -1.46 0.00 0.00 175.22 173.94 1kfi s ASP 236 N 1.27 5.76 0.00 6.13 -1.08 0.19 -0.58 116.67 128.36 1kfi s ASP 236 Ca -0.04 -0.97 0.28 0.00 -0.52 0.00 0.00 52.55 51.30 1kfi s ASP 236 Cb -0.14 -2.03 1.13 0.00 -1.46 0.00 0.00 42.92 40.42 1kfi s ASP 236 CO -0.03 -0.38 1.82 0.61 0.52 0.00 0.00 175.17 177.71 1kfi n GLY 237 N 5.01 -1.13 3.18 2.66 0.00 -0.39 -2.01 105.19 112.50 1kfi n GLY 237 Ca -0.12 -0.24 -0.22 0.00 0.00 0.00 0.00 46.02 45.44 1kfi n GLY 237 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1kfi n MET 238 N -1.18 -3.90 -1.41 1.61 0.00 -1.18 -1.66 117.12 109.40 1kfi n MET 238 Ca 0.11 0.65 -0.14 0.00 0.00 0.00 0.00 57.70 58.32 1kfi n MET 238 Cb 0.30 -5.41 -0.06 0.00 0.00 0.00 0.00 33.22 28.05 1kfi n MET 238 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 175.97 176.69 1kfi n HIS 239 N -4.13 0.00 -2.88 2.03 8.25 0.34 -4.64 115.22 114.19 1kfi n HIS 239 Ca -0.06 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.40 1kfi n HIS 239 Cb 0.58 -2.71 0.00 0.00 1.12 0.00 0.00 29.99 28.98 1kfi n HIS 239 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1kfi n GLY 240 N -0.74 3.48 0.08 -1.41 0.00 -0.66 -1.03 105.19 104.90 1kfi n GLY 240 Ca -0.14 -2.10 0.09 0.00 0.00 0.00 0.00 46.02 43.87 1kfi n GLY 240 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1kfi n VAL 241 N -0.31 1.05 0.15 1.61 3.14 -0.72 -2.70 118.33 120.55 1kfi n VAL 241 Ca 0.00 0.34 0.03 0.00 -2.96 0.00 0.00 64.34 61.75 1kfi n VAL 241 Cb 0.00 -1.23 0.41 0.00 -1.06 0.00 0.00 33.84 31.95 1kfi n VAL 241 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1kfi h ALA 242 N 2.27 1.52 -0.43 1.55 0.00 -1.80 -3.35 119.26 119.02 1kfi h ALA 242 Ca 0.00 -0.22 0.04 0.00 0.00 0.00 0.00 54.91 54.72 1kfi h ALA 242 Cb 0.23 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 17.90 1kfi h ALA 242 CO 0.00 0.35 -0.26 0.41 0.00 0.00 0.00 179.25 179.75 1kfi n GLY 243 N -0.82 -2.61 0.37 0.00 0.00 -1.10 -1.39 105.19 99.64 1kfi n GLY 243 Ca -0.01 0.79 0.09 0.00 0.00 0.00 0.00 46.02 46.89 1kfi n GLY 243 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1kfi h PRO 244 N 0.00 0.87 -0.27 1.61 0.11 -1.70 -0.79 132.00 131.82 1kfi h PRO 244 Ca 0.07 -0.05 -0.09 0.00 0.11 0.00 0.00 66.00 66.04 1kfi h PRO 244 Cb 0.18 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 31.09 1kfi h PRO 244 CO -0.41 0.57 -0.17 1.88 -0.21 0.00 0.00 178.00 179.66 1kfi h TYR 245 N 0.89 0.69 -0.35 0.65 -1.99 -1.57 -2.37 116.97 112.92 1kfi h TYR 245 Ca 0.48 -0.18 -0.02 0.00 2.00 0.00 0.00 58.73 61.01 1kfi h TYR 245 Cb 0.57 -0.16 -0.02 0.00 2.00 0.00 0.00 36.73 39.13 1kfi h TYR 245 CO -0.00 0.86 0.14 0.00 -0.00 0.00 0.00 178.16 179.16 1kfi h ALA 246 N 0.72 0.46 -0.20 3.88 0.00 -0.51 0.17 119.26 123.78 1kfi h ALA 246 Ca 0.06 -0.13 0.01 0.00 0.00 0.00 0.00 54.91 54.84 1kfi h ALA 246 Cb 0.70 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1kfi h ALA 246 CO 0.05 0.06 0.12 0.87 0.00 0.00 0.00 179.25 180.35 1kfi h LYS 247 N 0.42 0.24 -0.01 0.00 1.57 -1.19 0.15 116.57 117.74 1kfi h LYS 247 Ca 0.12 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.88 1kfi h LYS 247 Cb 0.19 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.45 1kfi h LYS 247 CO -0.01 0.16 -0.00 1.25 -0.57 0.00 0.00 179.45 180.27 1kfi h HIS 248 N 0.24 0.02 0.21 -1.35 2.76 -1.31 -1.28 115.15 114.44 1kfi h HIS 248 Ca 0.08 -0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.23 1kfi h HIS 248 Cb -0.01 -0.00 0.00 0.00 1.55 0.00 0.00 27.41 28.95 1kfi h HIS 248 CO -0.08 0.43 -0.10 0.82 -1.30 0.00 0.00 177.93 177.70 1kfi h ILE 249 N -0.39 0.54 -0.18 6.26 2.04 -0.62 -1.75 117.51 123.40 1kfi h ILE 249 Ca 0.00 -1.01 -0.21 0.00 1.00 0.00 0.00 64.86 64.64 1kfi h ILE 249 Cb 0.42 0.93 0.01 0.00 -0.74 0.00 0.00 36.82 37.44 1kfi h ILE 249 CO 0.00 0.15 -0.72 -0.26 0.00 0.00 0.00 178.15 177.32 1kfi h PHE 250 N -0.97 1.04 0.00 1.37 0.04 -0.88 -1.21 116.94 116.34 1kfi h PHE 250 Ca -0.03 -0.44 0.00 0.00 2.80 0.00 0.00 57.97 60.30 1kfi h PHE 250 Cb 0.45 -0.17 0.00 0.00 2.20 0.00 0.00 35.95 38.43 1kfi h PHE 250 CO 0.06 1.27 0.00 0.41 -0.60 0.00 0.00 178.31 179.45 1kfi n GLY 251 N 0.61 0.15 0.34 -1.45 0.00 -0.59 -0.55 105.19 103.69 1kfi n GLY 251 Ca -0.06 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.81 1kfi n GLY 251 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1kfi h THR 252 N 0.00 0.34 0.25 2.61 2.02 -1.19 0.33 112.91 117.27 1kfi h THR 252 Ca 0.00 0.00 -0.34 0.00 0.77 0.00 0.00 66.41 66.84 1kfi h THR 252 Cb 0.00 0.34 0.04 0.00 -1.74 0.00 0.00 68.15 66.79 1kfi h THR 252 CO 0.00 0.00 -1.50 -0.07 0.37 0.00 0.00 175.52 174.32 1kfi h LEU 253 N -0.60 0.84 0.00 2.58 3.38 -1.34 -3.35 115.31 116.81 1kfi h LEU 253 Ca 0.00 -0.91 0.00 0.00 0.09 0.00 0.00 57.88 57.06 1kfi h LEU 253 Cb 0.58 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.06 1kfi h LEU 253 CO -0.11 1.72 -0.86 0.18 0.09 0.00 0.00 178.44 179.45 1kfi n LEU 254 N -3.71 0.67 -0.63 1.67 4.77 -0.46 -4.94 117.00 114.37 1kfi n LEU 254 Ca -0.17 -0.13 -0.05 0.00 -0.03 0.00 0.00 56.01 55.62 1kfi n LEU 254 Cb 1.11 -0.12 -0.00 0.00 -2.33 0.00 0.00 43.42 42.08 1kfi n LEU 254 CO 0.60 0.12 -0.05 0.61 -1.33 0.00 0.00 177.39 177.34 1kfi n GLY 255 N 1.44 0.20 3.83 -0.72 0.00 0.12 -4.70 105.19 105.36 1kfi n GLY 255 Ca 0.04 -0.66 -0.31 0.00 0.00 0.00 0.00 46.02 45.09 1kfi n GLY 255 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1kfi s SER 257 N -3.90 5.73 0.28 0.00 1.04 -1.26 -4.56 113.70 111.03 1kfi s SER 257 Ca 0.58 1.18 -0.02 0.00 0.48 0.00 0.00 55.95 58.17 1kfi s SER 257 Cb -0.14 -2.09 0.39 0.00 0.10 0.00 0.00 66.02 64.29 1kfi s SER 257 CO 0.54 -1.15 1.89 0.11 0.98 0.00 0.00 173.24 175.62 1kfi h LYS 258 N -0.48 1.00 0.00 4.02 6.56 -1.96 -1.87 116.57 123.84 1kfi h LYS 258 Ca -0.45 -0.13 -0.01 0.00 -1.06 0.00 0.00 60.65 59.01 1kfi h LYS 258 Cb 1.23 -0.19 -0.00 0.00 -0.57 0.00 0.00 32.23 32.70 1kfi h LYS 258 CO 0.63 0.76 -0.03 1.05 -2.06 0.00 0.00 179.45 179.81 1kfi h GLU 259 N 1.00 0.00 0.00 3.15 4.11 -1.98 -2.27 114.58 118.59 1kfi h GLU 259 Ca 0.25 0.00 -0.08 0.00 0.07 0.00 0.00 59.36 59.60 1kfi h GLU 259 Cb 0.08 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 1kfi h GLU 259 CO -0.03 0.03 -0.38 0.77 0.07 0.00 0.00 179.01 179.46 1kfi h SER 260 N 0.00 0.00 -3.61 3.06 0.02 -1.57 -3.42 113.55 108.03 1kfi h SER 260 Ca -0.00 0.00 -0.67 0.00 -0.84 0.00 0.00 61.79 60.28 1kfi h SER 260 Cb 0.13 0.00 -0.17 0.00 0.14 0.00 0.00 62.40 62.50 1kfi h SER 260 CO 0.00 0.38 -0.19 -0.76 -1.14 0.00 0.00 176.83 175.12 1kfi s LEU 261 N -7.19 4.56 -0.08 5.07 1.43 -0.85 -0.85 118.68 120.76 1kfi s LEU 261 Ca -0.00 -0.34 -0.03 0.00 -1.03 0.00 0.00 54.13 52.72 1kfi s LEU 261 Cb 0.11 -2.43 -0.04 0.00 0.03 0.00 0.00 46.19 43.87 1kfi s LEU 261 CO 0.69 -0.47 0.05 -0.76 0.23 0.00 0.00 176.35 176.09 1kfi s LEU 262 N 2.18 3.87 -1.67 1.79 1.43 0.26 -4.57 118.68 121.97 1kfi s LEU 262 Ca 0.14 0.24 -0.18 0.00 -1.03 0.00 0.00 54.13 53.30 1kfi s LEU 262 Cb -0.16 -1.96 0.14 0.00 0.03 0.00 0.00 46.19 44.24 1kfi s LEU 262 CO 0.13 0.37 0.84 0.59 0.23 0.00 0.00 176.35 178.51 1kfi n ASN 263 N 1.95 -3.71 -1.51 2.29 5.03 -1.26 -1.27 115.26 116.77 1kfi n ASN 263 Ca -0.18 -0.95 0.02 0.00 0.87 0.00 0.00 54.58 54.34 1kfi n ASN 263 Cb 0.54 -3.02 0.26 0.00 -1.02 0.00 0.00 39.78 36.54 1kfi n ASN 263 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1kfi s ASP 265 N -0.54 5.25 0.26 0.00 1.01 -1.26 -4.06 116.67 117.34 1kfi s ASP 265 Ca 0.38 -1.28 -0.28 0.00 0.71 0.00 0.00 52.55 52.07 1kfi s ASP 265 Cb 0.29 -1.84 -0.15 0.00 1.01 0.00 0.00 42.92 42.23 1kfi s ASP 265 CO 0.11 -0.35 0.91 -2.65 0.21 0.00 0.00 175.17 173.39 1kfi n PRO 266 N 4.76 1.04 -4.12 8.23 -0.02 -1.25 -4.59 135.00 139.04 1kfi n PRO 266 Ca -0.11 0.36 -0.19 0.00 -2.02 0.00 0.00 63.50 61.54 1kfi n PRO 266 Cb 0.44 -1.66 -0.16 0.00 -0.02 0.00 0.00 33.50 32.10 1kfi n PRO 266 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1kfi s SER 267 N -0.63 0.76 0.63 2.55 0.15 -0.20 -4.96 113.70 112.00 1kfi s SER 267 Ca 0.61 -0.10 0.30 0.00 0.70 0.00 0.00 55.95 57.46 1kfi s SER 267 Cb -0.76 -0.33 1.63 0.00 -1.71 0.00 0.00 66.02 64.85 1kfi s SER 267 CO 0.59 -0.04 1.97 1.05 1.20 0.00 0.00 173.24 178.01 1kfi h GLU 268 N 6.97 0.00 0.00 5.44 4.11 -1.86 0.36 114.58 129.60 1kfi h GLU 268 Ca -0.38 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.05 1kfi h GLU 268 Cb 1.15 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.40 1kfi h GLU 268 CO 0.48 0.00 -0.15 -0.40 0.07 0.00 0.00 179.01 179.02 1kfi n ASP 269 N -3.35 2.04 -4.12 3.06 3.85 -1.26 -0.72 116.55 116.05 1kfi n ASP 269 Ca 0.02 -3.14 -0.31 0.00 -0.71 0.00 0.00 54.79 50.65 1kfi n ASP 269 Cb 0.44 -0.43 -0.03 0.00 -1.35 0.00 0.00 41.12 39.75 1kfi n ASP 269 CO 0.00 0.00 0.00 0.49 -1.01 0.00 0.00 177.20 176.68 1kfi n PHE 270 N -1.24 -1.66 -1.40 2.11 3.72 0.13 0.27 117.46 119.38 1kfi n PHE 270 Ca 0.15 0.76 -0.14 0.00 -0.05 0.00 0.00 57.45 58.18 1kfi n PHE 270 Cb 0.66 -3.27 -0.06 0.00 -0.94 0.00 0.00 39.48 35.87 1kfi n PHE 270 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1kfi n GLY 271 N -1.75 1.37 2.46 1.37 0.00 -1.26 -2.55 105.19 104.83 1kfi n GLY 271 Ca -0.12 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.74 1kfi n GLY 271 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1kfi n GLY 272 N -0.63 0.87 0.30 -0.02 0.00 0.14 -5.03 105.19 100.84 1kfi n GLY 272 Ca -0.14 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.86 1kfi n GLY 272 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1kfi n GLY 273 N -2.14 3.53 3.57 -0.02 0.00 -1.06 -5.06 105.19 104.02 1kfi n GLY 273 Ca 0.00 -2.20 -0.41 0.00 0.00 0.00 0.00 46.02 43.41 1kfi n GLY 273 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1kfi s HIS 274 N -0.63 3.18 -1.60 1.61 0.09 -1.26 -4.58 115.29 112.10 1kfi s HIS 274 Ca 0.01 0.32 -0.10 0.00 -0.00 0.00 0.00 55.06 55.29 1kfi s HIS 274 Cb -0.00 -3.00 -0.07 0.00 -0.00 0.00 0.00 32.58 29.51 1kfi s HIS 274 CO 0.01 -0.54 2.87 -0.35 -0.00 0.00 0.00 174.74 176.73 1kfi n PRO 275 N 5.85 3.66 -3.79 8.40 -0.04 -1.24 -4.78 135.00 143.05 1kfi n PRO 275 Ca -0.03 -2.29 -0.29 0.00 -0.04 0.00 0.00 63.50 60.85 1kfi n PRO 275 Cb 0.49 -2.84 -0.16 0.00 -0.04 0.00 0.00 33.50 30.95 1kfi n PRO 275 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1kfi s ASP 276 N 2.19 3.43 -0.44 3.54 2.15 -1.25 -0.47 116.67 125.81 1kfi s ASP 276 Ca 0.67 -1.10 -0.28 0.00 0.43 0.00 0.00 52.55 52.27 1kfi s ASP 276 Cb 0.18 -0.82 -0.02 0.00 -0.30 0.00 0.00 42.92 41.96 1kfi s ASP 276 CO -0.06 -0.31 1.78 -2.16 -0.17 0.00 0.00 175.17 174.24 1kfi s PRO 277 N 1.67 3.10 0.34 4.34 0.04 -1.26 -4.43 135.00 138.80 1kfi s PRO 277 Ca 0.00 1.07 -0.18 0.00 0.04 0.00 0.00 61.00 61.93 1kfi s PRO 277 Cb -0.18 -4.25 0.04 0.00 0.04 0.00 0.00 34.50 30.16 1kfi s PRO 277 CO -0.11 -2.15 0.76 0.54 0.04 0.00 0.00 177.00 176.08 1kfi s ASN 278 N 6.59 -0.09 0.54 6.66 2.20 -1.26 -4.77 114.94 124.81 1kfi s ASN 278 Ca 0.73 -0.94 0.25 0.00 -0.94 0.00 0.00 52.86 51.95 1kfi s ASN 278 Cb -0.18 0.80 1.43 0.00 -2.00 0.00 0.00 41.25 41.30 1kfi s ASN 278 CO 0.29 -1.55 2.04 -0.07 -2.94 0.00 0.00 177.10 174.86 1kfi h LEU 279 N 2.00 0.00 0.06 3.54 3.38 -1.92 -2.55 115.31 119.82 1kfi h LEU 279 Ca -0.27 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.36 1kfi h LEU 279 Cb 1.25 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.96 1kfi h LEU 279 CO 0.34 0.00 -1.94 0.35 0.09 0.00 0.00 178.44 177.28 1kfi n THR 280 N -4.26 1.64 0.19 0.22 -2.24 -1.26 -4.05 114.28 104.53 1kfi n THR 280 Ca 0.06 -0.44 0.08 0.00 -2.27 0.00 0.00 64.05 61.48 1kfi n THR 280 Cb 0.47 -1.78 0.27 0.00 -2.10 0.00 0.00 70.33 67.19 1kfi n THR 280 CO 0.00 0.00 0.00 1.88 -0.57 0.00 0.00 175.07 176.38 1kfi h TYR 281 N -0.35 0.00 -1.41 4.78 0.05 -1.78 -3.01 116.97 115.25 1kfi h TYR 281 Ca -0.46 0.00 -0.67 0.00 0.05 0.00 0.00 58.73 57.64 1kfi h TYR 281 Cb 1.77 0.00 -0.33 0.00 1.01 0.00 0.00 36.73 39.18 1kfi h TYR 281 CO 0.06 0.29 0.38 0.00 -1.05 0.00 0.00 178.16 177.83 1kfi n ALA 282 N -2.20 5.96 -0.32 3.88 0.00 -0.96 -4.79 120.51 122.08 1kfi n ALA 282 Ca 0.01 -3.92 0.05 0.00 0.00 0.00 0.00 53.44 49.58 1kfi n ALA 282 Cb 0.55 -1.39 0.24 0.00 0.00 0.00 0.00 19.45 18.85 1kfi n ALA 282 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.50 178.62 1kfi h HIS 283 N 2.49 1.07 -0.38 0.00 2.07 -1.67 -0.79 115.15 117.94 1kfi h HIS 283 Ca 0.50 0.03 -0.06 0.00 -2.85 0.00 0.00 60.37 57.99 1kfi h HIS 283 Cb 0.67 -0.35 -0.01 0.00 2.57 0.00 0.00 27.41 30.28 1kfi h HIS 283 CO 1.14 0.53 0.01 -0.44 -3.07 0.00 0.00 177.93 176.11 1kfi h ASP 284 N 1.03 0.65 -0.43 3.10 3.32 -1.90 0.54 116.42 122.73 1kfi h ASP 284 Ca 0.41 -0.30 -0.02 0.00 0.02 0.00 0.00 57.03 57.14 1kfi h ASP 284 Cb 0.26 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.61 1kfi h ASP 284 CO -0.17 0.78 0.19 0.25 -1.72 0.00 0.00 179.24 178.58 1kfi h LEU 285 N 0.49 0.58 -0.85 1.55 7.12 -1.90 0.35 115.31 122.65 1kfi h LEU 285 Ca 0.11 -0.15 -0.01 0.00 0.13 0.00 0.00 57.88 57.96 1kfi h LEU 285 Cb 0.44 -0.15 -0.04 0.00 -0.53 0.00 0.00 40.66 40.38 1kfi h LEU 285 CO 0.02 0.57 0.49 0.58 -0.13 0.00 0.00 178.44 179.97 1kfi h VAL 286 N 0.56 1.24 -0.30 1.05 2.07 -0.96 -0.90 116.25 119.01 1kfi h VAL 286 Ca 0.15 -0.57 -0.17 0.00 0.82 0.00 0.00 66.70 66.93 1kfi h VAL 286 Cb 0.16 0.07 -0.00 0.00 -1.52 0.00 0.00 31.29 30.00 1kfi h VAL 286 CO -0.01 0.27 -0.47 -0.08 0.02 0.00 0.00 177.57 177.29 1kfi h GLU 287 N 1.18 0.79 -0.49 1.57 4.81 -0.67 -2.55 114.58 119.22 1kfi h GLU 287 Ca 0.30 -0.46 0.01 0.00 -0.13 0.00 0.00 59.36 59.09 1kfi h GLU 287 Cb -0.01 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.38 1kfi h GLU 287 CO -0.05 1.09 0.31 -0.07 -0.73 0.00 0.00 179.01 179.56 1kfi h LEU 288 N 0.63 0.53 -1.01 1.64 3.38 -0.39 -1.28 115.31 118.80 1kfi h LEU 288 Ca 0.03 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1kfi h LEU 288 Cb 1.05 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.68 1kfi h LEU 288 CO 0.10 0.38 0.00 0.18 0.09 0.00 0.00 178.44 179.19 1kfi n LEU 289 N -4.77 1.34 -3.98 1.67 4.32 -0.39 -4.32 117.00 110.88 1kfi n LEU 289 Ca 0.03 -0.68 -0.33 0.00 -0.02 0.00 0.00 56.01 55.01 1kfi n LEU 289 Cb 0.04 -0.32 -0.01 0.00 -1.62 0.00 0.00 43.42 41.51 1kfi n LEU 289 CO 0.34 0.26 -0.20 -0.67 -1.22 0.00 0.00 177.39 175.90 1kfi n ASP 290 N 0.02 -2.03 0.23 -1.43 4.64 -0.48 -0.65 116.55 116.84 1kfi n ASP 290 Ca 0.05 -0.99 0.09 0.00 -1.38 0.00 0.00 54.79 52.55 1kfi n ASP 290 Cb 0.28 -1.20 0.57 0.00 -1.04 0.00 0.00 41.12 39.73 1kfi n ASP 290 CO 0.00 0.00 0.00 0.40 -0.82 0.00 0.00 177.20 176.78 1kfi h ILE 291 N -1.25 0.80 -0.01 5.18 1.08 -1.72 -1.67 117.51 119.92 1kfi h ILE 291 Ca -0.53 -0.82 0.00 0.00 -0.39 0.00 0.00 64.86 63.11 1kfi h ILE 291 Cb 1.07 1.49 0.00 0.00 -3.07 0.00 0.00 36.82 36.31 1kfi h ILE 291 CO 0.44 0.20 -0.01 1.41 -0.69 0.00 0.00 178.15 179.50 1kfi n HIS 292 N -3.79 0.00 -3.26 1.37 8.25 -1.26 -4.73 115.22 111.80 1kfi n HIS 292 Ca -0.02 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.31 1kfi n HIS 292 Cb 0.31 -0.02 0.05 0.00 1.12 0.00 0.00 29.99 31.46 1kfi n HIS 292 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1kfi n LYS 293 N -0.41 -1.96 -0.01 -0.41 5.02 -0.63 -4.96 118.16 114.79 1kfi n LYS 293 Ca 0.21 0.96 0.01 0.00 -2.02 0.00 0.00 58.31 57.46 1kfi n LYS 293 Cb 0.25 -5.63 0.01 0.00 -0.02 0.00 0.00 35.03 29.64 1kfi n LYS 293 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1kfi n LYS 294 N -3.02 2.38 -4.33 1.97 5.02 -1.26 -5.05 118.16 113.88 1kfi n LYS 294 Ca -0.06 -1.45 -0.17 0.00 -2.02 0.00 0.00 58.31 54.61 1kfi n LYS 294 Cb 0.59 -0.97 -0.10 0.00 -0.02 0.00 0.00 35.03 34.53 1kfi n LYS 294 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1kfi s LYS 295 N -1.02 1.36 0.09 1.97 1.02 -1.26 -5.11 119.74 116.79 1kfi s LYS 295 Ca 0.03 -1.71 -0.31 0.00 0.02 0.00 0.00 55.97 54.00 1kfi s LYS 295 Cb 0.03 -0.48 -0.07 0.00 -0.52 0.00 0.00 37.83 36.79 1kfi s LYS 295 CO 0.00 -0.18 1.34 -0.51 -0.92 0.00 0.00 175.35 175.08 1kfi s ASP 296 N -3.31 6.89 0.38 2.83 1.11 -1.26 -4.89 116.67 118.42 1kfi s ASP 296 Ca 0.32 2.23 0.17 0.00 0.18 0.00 0.00 52.55 55.44 1kfi s ASP 296 Cb 0.07 -2.58 1.06 0.00 1.07 0.00 0.00 42.92 42.54 1kfi s ASP 296 CO 0.10 -0.61 1.75 -0.37 1.18 0.00 0.00 175.17 177.22 1kfi h VAL 297 N 4.37 0.50 0.00 -1.27 -1.51 -1.99 -0.22 116.25 116.12 1kfi h VAL 297 Ca -0.42 -0.15 -0.01 0.00 -1.23 0.00 0.00 66.70 64.90 1kfi h VAL 297 Cb 1.21 0.03 -0.00 0.00 -2.13 0.00 0.00 31.29 30.40 1kfi h VAL 297 CO 0.85 0.08 -0.04 1.23 -1.23 0.00 0.00 177.57 178.46 1kfi h GLY 298 N 0.43 0.00 -1.09 5.19 0.00 -2.02 -2.19 103.07 103.39 1kfi h GLY 298 Ca 0.63 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.96 1kfi h GLY 298 CO -0.36 0.00 0.00 -1.30 0.00 0.00 0.00 176.54 174.88 1kfi n THR 299 N -3.52 0.07 -3.98 4.70 -2.24 -0.10 -4.91 114.28 104.30 1kfi n THR 299 Ca -0.02 -0.38 -0.35 0.00 -2.27 0.00 0.00 64.05 61.03 1kfi n THR 299 Cb 0.15 0.82 -0.09 0.00 -2.10 0.00 0.00 70.33 69.11 1kfi n THR 299 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1kfi s VAL 300 N -1.93 4.92 0.72 2.28 1.01 -0.82 -5.03 120.40 121.54 1kfi s VAL 300 Ca 0.34 0.01 -0.16 0.00 0.00 0.00 0.00 61.98 62.17 1kfi s VAL 300 Cb 0.20 -3.20 -0.01 0.00 0.00 0.00 0.00 36.38 33.38 1kfi s VAL 300 CO 0.31 0.49 0.85 -2.65 0.00 0.00 0.00 175.10 174.10 1kfi n PRO 301 N 3.23 0.44 0.10 2.72 -0.02 -1.26 -4.90 135.00 135.32 1kfi n PRO 301 Ca -0.17 0.20 -0.16 0.00 -2.02 0.00 0.00 63.50 61.36 1kfi n PRO 301 Cb 0.53 -2.11 -0.14 0.00 -0.02 0.00 0.00 33.50 31.75 1kfi n PRO 301 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 1kfi h GLN 302 N -0.29 0.27 -4.11 -0.52 5.75 -1.89 -3.27 115.11 111.06 1kfi h GLN 302 Ca -0.47 -0.46 -0.34 0.00 -0.15 0.00 0.00 58.65 57.23 1kfi h GLN 302 Cb 1.34 0.17 -0.31 0.00 1.07 0.00 0.00 27.48 29.75 1kfi h GLN 302 CO 0.46 1.22 -0.75 0.12 -2.65 0.00 0.00 178.83 177.22 1kfi s PHE 303 N -2.68 0.47 -0.01 3.99 5.36 -0.81 -1.26 117.98 123.05 1kfi s PHE 303 Ca -0.04 -0.09 -0.02 0.00 -0.96 0.00 0.00 56.93 55.82 1kfi s PHE 303 Cb 0.07 -0.38 -0.00 0.00 -0.34 0.00 0.00 43.02 42.37 1kfi s PHE 303 CO 0.88 -0.07 0.05 0.20 -1.46 0.00 0.00 175.22 174.82 1kfi s GLY 304 N 0.31 0.04 -0.03 13.12 0.00 0.42 -1.04 107.32 120.14 1kfi s GLY 304 Ca -0.03 -0.08 -0.16 0.00 0.00 0.00 0.00 44.72 44.45 1kfi s GLY 304 CO -0.00 -0.13 0.34 0.00 0.00 0.00 0.00 173.10 173.31 1kfi s ALA 305 N -0.57 -0.86 0.06 3.20 0.00 -0.78 0.25 121.76 123.05 1kfi s ALA 305 Ca -0.06 0.46 0.05 0.00 0.00 0.00 0.00 51.96 52.41 1kfi s ALA 305 Cb -0.04 0.00 -0.03 0.00 0.00 0.00 0.00 23.12 23.06 1kfi s ALA 305 CO 0.00 -0.26 -0.14 0.00 0.00 0.00 0.00 175.76 175.37 1kfi s ALA 306 N -1.17 1.12 0.14 0.00 0.00 -1.01 0.53 121.76 121.38 1kfi s ALA 306 Ca -0.12 -0.92 0.08 0.00 0.00 0.00 0.00 51.96 50.99 1kfi s ALA 306 Cb -0.05 -0.11 -0.04 0.00 0.00 0.00 0.00 23.12 22.92 1kfi s ALA 306 CO 0.04 0.17 -0.18 0.00 0.00 0.00 0.00 175.76 175.80 1kfi s ASP 308 N -2.40 3.50 0.18 0.00 -4.77 -1.19 -4.39 116.67 107.60 1kfi s ASP 308 Ca 0.11 -0.09 -0.24 0.00 -3.30 0.00 0.00 52.55 49.03 1kfi s ASP 308 Cb -0.07 -0.03 0.06 0.00 -1.09 0.00 0.00 42.92 41.79 1kfi s ASP 308 CO 0.05 -2.45 1.47 0.61 0.70 0.00 0.00 175.17 175.55 1kfi n GLY 309 N -3.41 -2.25 0.77 2.12 0.00 0.38 0.12 105.19 102.91 1kfi n GLY 309 Ca 0.16 1.10 0.06 0.00 0.00 0.00 0.00 46.02 47.35 1kfi n GLY 309 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1kfi n ASP 310 N -5.28 2.22 -2.23 1.61 3.85 -1.26 -1.76 116.55 113.70 1kfi n ASP 310 Ca 0.05 -2.03 -0.21 0.00 -0.71 0.00 0.00 54.79 51.90 1kfi n ASP 310 Cb 0.31 -0.29 -0.03 0.00 -1.35 0.00 0.00 41.12 39.76 1kfi n ASP 310 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1kfi n ALA 311 N 0.66 -0.56 1.00 2.12 0.00 0.12 -2.02 120.51 121.82 1kfi n ALA 311 Ca 0.13 0.20 0.10 0.00 0.00 0.00 0.00 53.44 53.88 1kfi n ALA 311 Cb 0.36 -2.14 -0.09 0.00 0.00 0.00 0.00 19.45 17.58 1kfi n ALA 311 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1kfi n ASP 312 N -1.87 1.22 -4.77 0.00 5.75 -1.26 -1.66 116.55 113.96 1kfi n ASP 312 Ca -0.24 -1.11 -0.25 0.00 -0.01 0.00 0.00 54.79 53.19 1kfi n ASP 312 Cb 0.68 0.89 -0.06 0.00 -1.03 0.00 0.00 41.12 41.60 1kfi n ASP 312 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1kfi s ARG 313 N -2.88 2.76 -0.04 0.11 0.52 -1.26 -3.25 118.95 114.92 1kfi s ARG 313 Ca 0.10 -1.01 -0.11 0.00 -0.52 0.00 0.00 55.73 54.19 1kfi s ARG 313 Cb 0.16 -2.53 0.02 0.00 0.52 0.00 0.00 34.95 33.12 1kfi s ARG 313 CO 0.80 0.45 0.24 0.54 0.02 0.00 0.00 175.30 177.35 1kfi s ASN 314 N -3.33 -0.15 -0.08 0.23 2.20 0.96 -3.19 114.94 111.57 1kfi s ASN 314 Ca 0.31 0.15 0.03 0.00 -0.94 0.00 0.00 52.86 52.41 1kfi s ASN 314 Cb -0.09 0.36 0.01 0.00 -2.00 0.00 0.00 41.25 39.53 1kfi s ASN 314 CO 0.23 -0.30 -0.16 -0.32 -2.94 0.00 0.00 177.10 173.61 1kfi s MET 315 N -0.83 2.15 -0.20 3.55 1.75 -0.62 -4.57 119.30 120.53 1kfi s MET 315 Ca -0.09 -0.56 -0.06 0.00 -1.25 0.00 0.00 55.69 53.72 1kfi s MET 315 Cb -0.05 -1.72 -0.03 0.00 2.84 0.00 0.00 34.83 35.87 1kfi s MET 315 CO 0.02 0.06 0.03 0.42 -0.65 0.00 0.00 175.02 174.90 1kfi s ILE 316 N 0.62 4.25 -0.01 10.11 -1.09 -1.26 -2.39 121.20 131.43 1kfi s ILE 316 Ca -0.15 -0.21 0.06 0.00 -2.23 0.00 0.00 60.65 58.12 1kfi s ILE 316 Cb -0.16 -2.93 -0.02 0.00 -1.58 0.00 0.00 42.46 37.77 1kfi s ILE 316 CO 0.04 0.42 -0.18 -0.76 -1.23 0.00 0.00 174.94 173.23 1kfi s LEU 317 N 0.89 2.05 0.39 2.97 1.43 0.14 -1.46 118.68 125.10 1kfi s LEU 317 Ca 0.02 -0.35 0.08 0.00 -1.03 0.00 0.00 54.13 52.85 1kfi s LEU 317 Cb -0.14 -0.94 -0.07 0.00 0.03 0.00 0.00 46.19 45.07 1kfi s LEU 317 CO 0.02 0.22 0.05 -0.83 0.23 0.00 0.00 176.35 176.04 1kfi s GLY 318 N -0.51 2.36 -0.33 -3.19 0.00 0.91 -0.44 107.32 106.12 1kfi s GLY 318 Ca 0.07 -2.18 -0.40 0.00 0.00 0.00 0.00 44.72 42.21 1kfi s GLY 318 CO -0.00 -2.01 1.88 -2.13 0.00 0.00 0.00 173.10 170.84 1kfi n ARG 319 N -1.04 0.97 -3.92 2.90 0.63 -0.39 -0.89 116.66 114.92 1kfi n ARG 319 Ca -0.04 0.33 -0.31 0.00 -0.92 0.00 0.00 57.85 56.91 1kfi n ARG 319 Cb 0.65 -2.09 0.01 0.00 0.45 0.00 0.00 32.46 31.48 1kfi n ARG 319 CO 0.00 0.00 0.00 1.04 -2.51 0.00 0.00 177.63 176.16 1kfi n GLN 320 N 6.18 -4.58 -3.65 -0.14 6.02 0.17 -4.84 117.38 116.54 1kfi n GLN 320 Ca 0.33 0.52 -0.08 0.00 -0.01 0.00 0.00 57.00 57.77 1kfi n GLN 320 Cb 0.12 -5.35 -0.08 0.00 1.02 0.00 0.00 30.24 25.95 1kfi n GLN 320 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 177.06 176.17 1kfi s PHE 321 N -3.24 -0.97 -0.25 1.08 5.36 -0.07 -4.83 117.98 115.06 1kfi s PHE 321 Ca 0.65 1.95 -0.08 0.00 -0.96 0.00 0.00 56.93 58.49 1kfi s PHE 321 Cb -0.34 0.56 -0.03 0.00 -0.34 0.00 0.00 43.02 42.87 1kfi s PHE 321 CO 0.80 -0.49 0.09 0.12 -1.46 0.00 0.00 175.22 174.29 1kfi s PHE 322 N 1.63 3.13 -0.51 10.12 5.36 -1.26 -0.07 117.98 136.38 1kfi s PHE 322 Ca -0.10 -0.26 -0.20 0.00 -0.96 0.00 0.00 56.93 55.41 1kfi s PHE 322 Cb -0.06 -2.25 0.05 0.00 -0.34 0.00 0.00 43.02 40.42 1kfi s PHE 322 CO -0.18 -0.27 0.70 0.08 -1.46 0.00 0.00 175.22 174.09 1kfi s VAL 323 N 1.53 4.76 0.67 3.12 1.01 -0.53 -5.01 120.40 125.95 1kfi s VAL 323 Ca 0.06 -0.29 -0.17 0.00 0.00 0.00 0.00 61.98 61.58 1kfi s VAL 323 Cb -0.15 -4.35 0.00 0.00 0.00 0.00 0.00 36.38 31.88 1kfi s VAL 323 CO 0.05 -0.87 1.28 0.42 0.00 0.00 0.00 175.10 175.98 1kfi s THR 324 N 2.94 2.07 0.32 3.92 -4.23 -1.26 -4.24 115.64 115.17 1kfi s THR 324 Ca 0.19 0.04 0.05 0.00 -1.18 0.00 0.00 61.69 60.79 1kfi s THR 324 Cb -0.17 -2.93 0.30 0.00 1.34 0.00 0.00 72.50 71.03 1kfi s THR 324 CO 0.14 -0.01 1.88 -0.65 -0.54 0.00 0.00 174.62 175.44 1kfi h PRO 325 N 0.36 0.84 -0.14 3.99 0.11 -1.90 -0.06 132.00 135.19 1kfi h PRO 325 Ca -0.50 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 65.52 1kfi h PRO 325 Cb 1.33 -0.19 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 1kfi h PRO 325 CO 0.52 0.55 -0.05 0.77 -0.21 0.00 0.00 178.00 179.59 1kfi h SER 326 N 0.86 0.29 -0.71 -2.05 0.02 -1.82 -2.14 113.55 108.00 1kfi h SER 326 Ca 0.43 -0.38 -0.05 0.00 -0.84 0.00 0.00 61.79 60.95 1kfi h SER 326 Cb 0.47 -0.08 -0.03 0.00 0.14 0.00 0.00 62.40 62.90 1kfi h SER 326 CO -0.19 0.60 0.27 0.44 -1.14 0.00 0.00 176.83 176.81 1kfi h ASP 327 N -0.04 1.00 -0.74 3.07 3.45 -1.84 -2.65 116.42 118.67 1kfi h ASP 327 Ca 0.03 -0.16 0.01 0.00 0.43 0.00 0.00 57.03 57.35 1kfi h ASP 327 Cb 0.49 -0.26 -0.04 0.00 -0.56 0.00 0.00 39.33 38.96 1kfi h ASP 327 CO 0.02 0.91 0.49 -1.28 -1.57 0.00 0.00 179.24 177.80 1kfi h SER 328 N 1.06 0.83 -0.23 6.45 0.87 -0.95 0.27 113.55 121.86 1kfi h SER 328 Ca 0.24 -0.02 0.05 0.00 -1.23 0.00 0.00 61.79 60.83 1kfi h SER 328 Cb 0.23 -0.20 -0.04 0.00 -0.44 0.00 0.00 62.40 61.95 1kfi h SER 328 CO -0.02 0.59 -0.06 0.25 -0.53 0.00 0.00 176.83 177.07 1kfi h LEU 329 N 0.98 -0.22 -0.29 2.23 6.46 -1.05 -0.31 115.31 123.11 1kfi h LEU 329 Ca 0.28 0.07 -0.09 0.00 -0.12 0.00 0.00 57.88 58.02 1kfi h LEU 329 Cb -0.08 0.15 -0.01 0.00 -0.73 0.00 0.00 40.66 39.99 1kfi h LEU 329 CO -0.07 -0.08 -0.17 0.00 -0.62 0.00 0.00 178.44 177.50 1kfi h ALA 330 N 1.22 0.42 -0.73 1.25 0.00 -1.11 -1.61 119.26 118.70 1kfi h ALA 330 Ca 0.11 -0.34 0.03 0.00 0.00 0.00 0.00 54.91 54.71 1kfi h ALA 330 Cb 0.17 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 1kfi h ALA 330 CO -0.24 0.33 0.48 0.28 0.00 0.00 0.00 179.25 180.10 1kfi h VAL 331 N 0.38 1.12 -0.49 0.00 2.07 -0.29 0.39 116.25 119.43 1kfi h VAL 331 Ca 0.06 -0.31 -0.11 0.00 0.82 0.00 0.00 66.70 67.16 1kfi h VAL 331 Cb 0.70 0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 30.60 1kfi h VAL 331 CO 0.05 0.16 -0.12 0.40 0.02 0.00 0.00 177.57 178.08 1kfi h ILE 332 N 0.90 1.27 0.08 4.57 2.04 -0.92 -2.20 117.51 123.25 1kfi h ILE 332 Ca 0.29 -1.26 -0.00 0.00 1.00 0.00 0.00 64.86 64.89 1kfi h ILE 332 Cb 0.03 1.08 0.00 0.00 -0.74 0.00 0.00 36.82 37.19 1kfi h ILE 332 CO -0.08 0.44 -0.04 0.00 0.00 0.00 0.00 178.15 178.47 1kfi h ALA 333 N 0.89 -0.10 -0.29 1.87 0.00 -0.00 -1.98 119.26 119.64 1kfi h ALA 333 Ca 0.12 -0.04 0.05 0.00 0.00 0.00 0.00 54.91 55.04 1kfi h ALA 333 Cb 0.68 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 1kfi h ALA 333 CO 0.05 -0.54 0.20 0.00 0.00 0.00 0.00 179.25 178.95 1kfi h ALA 334 N 0.78 2.03 -0.67 0.00 0.00 -0.21 -1.71 119.26 119.48 1kfi h ALA 334 Ca -0.01 -0.01 -0.27 0.00 0.00 0.00 0.00 54.91 54.62 1kfi h ALA 334 Cb 0.11 -0.04 -0.16 0.00 0.00 0.00 0.00 17.79 17.70 1kfi h ALA 334 CO 0.02 -0.09 0.27 0.09 0.00 0.00 0.00 179.25 179.54 1kfi n ASN 335 N -4.49 3.88 -0.15 0.00 4.13 -0.84 -4.70 115.26 113.10 1kfi n ASN 335 Ca 0.03 -3.44 0.10 0.00 1.68 0.00 0.00 54.58 52.95 1kfi n ASN 335 Cb 0.22 -0.72 0.43 0.00 -1.54 0.00 0.00 39.78 38.17 1kfi n ASN 335 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1kfi h ALA 336 N 1.72 1.89 0.00 5.41 0.00 -0.56 -1.71 119.26 126.02 1kfi h ALA 336 Ca 0.33 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.23 1kfi h ALA 336 Cb 2.23 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.90 1kfi h ALA 336 CO 0.70 -0.04 0.00 0.09 0.00 0.00 0.00 179.25 180.00 1kfi n ASN 337 N -4.49 0.00 -0.05 0.00 5.03 -1.26 -0.58 115.26 113.92 1kfi n ASN 337 Ca 0.12 0.14 0.01 0.00 0.87 0.00 0.00 54.58 55.71 1kfi n ASN 337 Cb 0.35 -0.33 -0.16 0.00 -1.02 0.00 0.00 39.78 38.62 1kfi n ASN 337 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 1kfi n LEU 338 N -1.33 0.05 -0.13 3.41 4.77 -0.65 -4.69 117.00 118.43 1kfi n LEU 338 Ca 0.07 0.02 -0.26 0.00 -0.03 0.00 0.00 56.01 55.81 1kfi n LEU 338 Cb 0.14 0.24 -0.10 0.00 -2.33 0.00 0.00 43.42 41.37 1kfi n LEU 338 CO 0.13 0.24 -1.41 -0.38 -1.33 0.00 0.00 177.39 174.64 1kfi n ILE 339 N -2.52 1.48 -3.48 -0.08 5.41 -0.83 -4.92 119.36 114.41 1kfi n ILE 339 Ca -0.18 -0.42 -0.37 0.00 1.00 0.00 0.00 62.75 62.77 1kfi n ILE 339 Cb 0.86 -1.75 -0.06 0.00 -0.71 0.00 0.00 39.64 37.98 1kfi n ILE 339 CO 0.00 0.00 0.00 -0.36 0.00 0.00 0.00 176.55 176.19 1kfi s PHE 340 N -2.50 3.55 0.22 1.39 0.40 0.26 -4.93 117.98 116.37 1kfi s PHE 340 Ca -0.37 0.78 -0.11 0.00 -0.60 0.00 0.00 56.93 56.63 1kfi s PHE 340 Cb 0.13 -2.37 0.30 0.00 0.51 0.00 0.00 43.02 41.60 1kfi s PHE 340 CO 0.50 0.35 1.65 -0.22 0.70 0.00 0.00 175.22 178.20 1kfi h LYS 341 N 6.08 0.08 -0.55 0.44 3.64 -1.90 -1.35 116.57 123.01 1kfi h LYS 341 Ca -0.45 -0.00 -0.33 0.00 -1.27 0.00 0.00 60.65 58.60 1kfi h LYS 341 Cb 1.19 -0.02 -0.20 0.00 -0.41 0.00 0.00 32.23 32.79 1kfi h LYS 341 CO 0.71 0.05 0.01 -1.71 -2.27 0.00 0.00 179.45 176.24 1kfi n ASN 342 N -5.33 3.51 0.00 4.20 5.15 -1.26 -5.08 115.26 116.45 1kfi n ASN 342 Ca 0.09 -3.77 0.00 0.00 -0.60 0.00 0.00 54.58 50.30 1kfi n ASN 342 Cb 0.37 -0.66 0.00 0.00 -0.53 0.00 0.00 39.78 38.96 1kfi n ASN 342 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1kfi n GLY 343 N -1.05 0.07 3.73 8.20 0.00 -0.51 -4.76 105.19 110.87 1kfi n GLY 343 Ca 0.41 -0.94 -0.35 0.00 0.00 0.00 0.00 46.02 45.14 1kfi n GLY 343 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1kfi s LEU 344 N 0.00 4.21 -0.09 0.99 2.96 -1.26 -4.71 118.68 120.78 1kfi s LEU 344 Ca 0.00 0.28 -0.06 0.00 -0.22 0.00 0.00 54.13 54.12 1kfi s LEU 344 Cb 0.00 -2.14 -0.27 0.00 0.50 0.00 0.00 46.19 44.28 1kfi s LEU 344 CO 0.00 0.16 0.49 0.25 -1.32 0.00 0.00 176.35 175.93 1kfi h LEU 345 N 6.69 0.44 0.00 -0.68 5.85 -1.89 -3.49 115.31 122.23 1kfi h LEU 345 Ca -0.41 -0.87 0.00 0.00 0.84 0.00 0.00 57.88 57.44 1kfi h LEU 345 Cb 1.15 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 42.04 1kfi h LEU 345 CO 0.76 1.77 0.00 0.61 -0.34 0.00 0.00 178.44 181.23 1kfi n GLY 346 N 1.92 1.90 3.05 3.75 0.00 -1.22 -4.59 105.19 109.99 1kfi n GLY 346 Ca -0.28 -0.73 -0.11 0.00 0.00 0.00 0.00 46.02 44.90 1kfi n GLY 346 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1kfi s ALA 347 N -2.00 0.45 0.04 4.61 0.00 0.52 -1.66 121.76 123.73 1kfi s ALA 347 Ca 0.00 -0.80 0.02 0.00 0.00 0.00 0.00 51.96 51.18 1kfi s ALA 347 Cb 0.00 0.11 -0.02 0.00 0.00 0.00 0.00 23.12 23.20 1kfi s ALA 347 CO 0.00 -0.12 -0.08 0.00 0.00 0.00 0.00 175.76 175.57 1kfi s ALA 348 N -1.83 0.57 0.05 0.00 0.00 -0.64 -0.59 121.76 119.33 1kfi s ALA 348 Ca -0.09 -0.78 0.01 0.00 0.00 0.00 0.00 51.96 51.11 1kfi s ALA 348 Cb -0.07 0.05 -0.03 0.00 0.00 0.00 0.00 23.12 23.07 1kfi s ALA 348 CO -0.01 -0.03 -0.06 -0.98 0.00 0.00 0.00 175.76 174.67 1kfi s ARG 349 N -1.65 0.55 0.51 0.00 1.70 -0.56 -2.69 118.95 116.81 1kfi s ARG 349 Ca -0.09 -0.87 -0.20 0.00 -0.47 0.00 0.00 55.73 54.09 1kfi s ARG 349 Cb -0.10 -0.17 -0.07 0.00 -0.57 0.00 0.00 34.95 34.05 1kfi s ARG 349 CO 0.00 0.01 1.11 -1.54 -1.08 0.00 0.00 175.30 173.80 1kfi s SER 350 N -1.92 6.02 0.30 -2.89 1.04 -1.18 -1.46 113.70 113.61 1kfi s SER 350 Ca -0.06 2.12 0.05 0.00 0.48 0.00 0.00 55.95 58.54 1kfi s SER 350 Cb -0.06 -2.58 0.75 0.00 0.10 0.00 0.00 66.02 64.23 1kfi s SER 350 CO -0.02 -1.01 1.74 -0.03 0.98 0.00 0.00 173.24 174.90 1kfi h MET 351 N 1.50 0.56 0.00 4.02 4.05 0.88 -0.92 114.93 125.02 1kfi h MET 351 Ca -0.50 -0.03 0.00 0.00 -0.28 0.00 0.00 59.70 58.89 1kfi h MET 351 Cb 1.25 -0.13 0.00 0.00 -0.80 0.00 0.00 31.60 31.92 1kfi h MET 351 CO 0.58 0.37 0.00 -1.35 0.23 0.00 0.00 176.91 176.74 1kfi h PRO 352 N 0.58 0.00 -7.05 0.39 0.11 -1.91 -3.45 132.00 120.66 1kfi h PRO 352 Ca 0.57 0.00 -0.51 0.00 0.11 0.00 0.00 66.00 66.18 1kfi h PRO 352 Cb 1.01 0.00 0.08 0.00 0.11 0.00 0.00 31.00 32.19 1kfi h PRO 352 CO -0.45 0.00 0.46 0.99 -0.21 0.00 0.00 178.00 178.79 1kfi s THR 353 N -3.50 3.03 0.66 -1.15 2.01 -0.35 -4.91 115.64 111.43 1kfi s THR 353 Ca 0.03 0.70 -0.17 0.00 0.31 0.00 0.00 61.69 62.55 1kfi s THR 353 Cb 0.09 -3.31 -0.00 0.00 0.01 0.00 0.00 72.50 69.29 1kfi s THR 353 CO 0.49 -0.09 1.23 -0.94 -0.69 0.00 0.00 174.62 174.63 1kfi s SER 354 N -1.56 4.66 0.00 3.53 1.04 -1.26 -4.89 113.70 115.21 1kfi s SER 354 Ca 0.70 2.44 0.00 0.00 0.48 0.00 0.00 55.95 59.57 1kfi s SER 354 Cb -0.27 -2.60 0.00 0.00 0.10 0.00 0.00 66.02 63.25 1kfi s SER 354 CO 0.31 -1.96 0.66 0.61 0.98 0.00 0.00 173.24 173.84 1kfi n GLY 355 N 0.56 0.15 0.36 7.32 0.00 -1.26 -4.00 105.19 108.32 1kfi n GLY 355 Ca 0.14 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.23 1kfi n GLY 355 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1kfi h ALA 356 N 2.32 1.50 -0.59 4.61 0.00 -1.90 0.12 119.26 125.32 1kfi h ALA 356 Ca 0.00 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 1kfi h ALA 356 Cb 0.20 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 1kfi h ALA 356 CO 0.00 0.21 0.13 1.25 0.00 0.00 0.00 179.25 180.84 1kfi h LEU 357 N 0.98 0.86 -0.83 0.00 5.85 -1.83 -2.76 115.31 117.58 1kfi h LEU 357 Ca 0.49 -0.17 0.04 0.00 0.84 0.00 0.00 57.88 59.09 1kfi h LEU 357 Cb 0.49 -0.23 -0.05 0.00 0.37 0.00 0.00 40.66 41.24 1kfi h LEU 357 CO -0.27 0.85 0.52 0.44 -0.34 0.00 0.00 178.44 179.64 1kfi h ASP 358 N 0.88 0.85 0.34 1.25 3.45 -1.27 -0.85 116.42 121.06 1kfi h ASP 358 Ca 0.19 0.00 -0.00 0.00 0.43 0.00 0.00 57.03 57.65 1kfi h ASP 358 Cb 0.34 -0.18 -0.00 0.00 -0.56 0.00 0.00 39.33 38.93 1kfi h ASP 358 CO 0.00 0.57 -0.01 0.11 -1.57 0.00 0.00 179.24 178.34 1kfi h LYS 359 N 0.99 0.00 0.13 3.56 1.79 -1.15 0.19 116.57 122.09 1kfi h LYS 359 Ca 0.34 0.00 -0.34 0.00 -2.18 0.00 0.00 60.65 58.48 1kfi h LYS 359 Cb 0.07 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.71 1kfi h LYS 359 CO -0.14 0.01 -1.75 0.28 -1.08 0.00 0.00 179.45 176.78 1kfi h VAL 360 N 0.00 0.91 -0.57 0.50 2.07 -1.18 -2.79 116.25 115.19 1kfi h VAL 360 Ca -0.00 -2.57 -0.09 0.00 0.82 0.00 0.00 66.70 64.85 1kfi h VAL 360 Cb 0.19 2.66 -0.02 0.00 -1.52 0.00 0.00 31.29 32.59 1kfi h VAL 360 CO 0.00 0.82 -0.01 0.00 0.02 0.00 0.00 177.57 178.40 1kfi h ALA 361 N 0.31 0.76 0.03 1.67 0.00 -0.63 0.49 119.26 121.90 1kfi h ALA 361 Ca -0.33 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 54.27 1kfi h ALA 361 Cb 2.05 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 19.63 1kfi h ALA 361 CO 0.14 0.60 -0.01 0.00 0.00 0.00 0.00 179.25 179.98 1kfi h ALA 362 N 0.96 -0.04 -0.43 0.00 0.00 -0.77 0.57 119.26 119.57 1kfi h ALA 362 Ca 0.16 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 1kfi h ALA 362 Cb 0.56 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 1kfi h ALA 362 CO 0.03 -0.37 -0.00 -0.22 0.00 0.00 0.00 179.25 178.68 1kfi h LYS 363 N -0.33 0.76 -0.13 0.00 1.63 -1.39 -3.22 116.57 113.90 1kfi h LYS 363 Ca -0.00 -0.24 0.00 0.00 -0.85 0.00 0.00 60.65 59.55 1kfi h LYS 363 Cb 0.31 -0.07 0.00 0.00 -0.60 0.00 0.00 32.23 31.87 1kfi h LYS 363 CO 0.01 0.83 0.00 0.09 -3.45 0.00 0.00 179.45 176.93 1kfi n ASN 364 N -4.41 2.54 -3.21 4.20 5.03 0.17 -4.98 115.26 114.61 1kfi n ASN 364 Ca -0.00 -1.84 -0.15 0.00 0.87 0.00 0.00 54.58 53.46 1kfi n ASN 364 Cb 0.30 -0.07 0.08 0.00 -1.02 0.00 0.00 39.78 39.07 1kfi n ASN 364 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1kfi n GLY 365 N 1.31 -0.46 3.67 7.41 0.00 0.18 -4.99 105.19 112.31 1kfi n GLY 365 Ca 0.17 0.16 -0.35 0.00 0.00 0.00 0.00 46.02 46.00 1kfi n GLY 365 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1kfi s ILE 366 N -3.34 4.25 0.21 -0.61 -1.09 -0.05 -5.03 121.20 115.54 1kfi s ILE 366 Ca 0.10 -0.29 -0.31 0.00 -2.23 0.00 0.00 60.65 57.93 1kfi s ILE 366 Cb -0.01 -2.79 -0.10 0.00 -1.58 0.00 0.00 42.46 37.98 1kfi s ILE 366 CO 0.68 0.59 1.45 -0.75 -1.23 0.00 0.00 174.94 175.68 1kfi s LYS 367 N -0.91 4.28 -0.06 2.79 2.47 -1.26 -4.66 119.74 122.38 1kfi s LYS 367 Ca 0.14 2.26 0.06 0.00 -1.56 0.00 0.00 55.97 56.86 1kfi s LYS 367 Cb -0.11 -3.15 -0.01 0.00 -1.46 0.00 0.00 37.83 33.10 1kfi s LYS 367 CO 0.03 -0.45 -0.24 -1.17 0.16 0.00 0.00 175.35 173.68 1kfi s LEU 368 N 0.20 2.16 0.00 5.43 2.96 -1.26 -0.36 118.68 127.82 1kfi s LEU 368 Ca 0.62 -0.47 0.05 0.00 -0.22 0.00 0.00 54.13 54.11 1kfi s LEU 368 Cb -0.41 -1.40 -0.01 0.00 0.50 0.00 0.00 46.19 44.87 1kfi s LEU 368 CO 0.38 0.25 -0.14 -0.36 -1.32 0.00 0.00 176.35 175.16 1kfi s PHE 369 N -0.21 1.28 -0.05 5.38 0.08 0.25 -4.97 117.98 119.73 1kfi s PHE 369 Ca -0.02 -0.27 0.04 0.00 0.12 0.00 0.00 56.93 56.81 1kfi s PHE 369 Cb -0.13 -0.81 -0.02 0.00 -0.57 0.00 0.00 43.02 41.49 1kfi s PHE 369 CO 0.03 -0.01 -0.16 -2.00 -0.10 0.00 0.00 175.22 172.98 1kfi s GLU 370 N -0.52 2.49 0.22 0.44 2.12 -1.26 -1.49 118.70 120.69 1kfi s GLU 370 Ca 0.05 -0.74 0.00 0.00 0.36 0.00 0.00 54.97 54.64 1kfi s GLU 370 Cb -0.06 -2.33 -0.05 0.00 0.26 0.00 0.00 34.13 31.95 1kfi s GLU 370 CO -0.00 0.59 0.10 0.95 -0.54 0.00 0.00 175.26 176.35 1kfi s THR 371 N -0.64 0.31 0.59 -1.70 -4.23 -0.54 -4.90 115.64 104.53 1kfi s THR 371 Ca 0.10 -1.99 -0.16 0.00 -1.18 0.00 0.00 61.69 58.46 1kfi s THR 371 Cb -0.11 -2.48 -0.04 0.00 1.34 0.00 0.00 72.50 71.21 1kfi s THR 371 CO 0.01 -0.09 1.06 -2.84 -0.54 0.00 0.00 174.62 172.21 1kfi s PRO 372 N -4.07 3.34 0.29 3.99 0.02 -1.26 0.14 135.00 137.44 1kfi s PRO 372 Ca 0.36 1.22 -0.28 0.00 0.02 0.00 0.00 61.00 62.32 1kfi s PRO 372 Cb 0.07 -2.03 -0.14 0.00 0.02 0.00 0.00 34.50 32.42 1kfi s PRO 372 CO 0.11 -0.80 0.96 2.41 -0.33 0.00 0.00 177.00 179.35 1kfi n THR 373 N -1.98 2.01 0.00 0.99 -1.04 -1.26 -4.71 114.28 108.29 1kfi n THR 373 Ca 0.09 -0.50 0.00 0.00 -2.04 0.00 0.00 64.05 61.60 1kfi n THR 373 Cb 0.53 -0.92 0.00 0.00 -1.82 0.00 0.00 70.33 68.11 1kfi n THR 373 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1kfi n GLY 374 N 1.29 3.14 0.26 3.41 0.00 -1.26 -4.90 105.19 107.13 1kfi n GLY 374 Ca 0.10 -1.35 0.17 0.00 0.00 0.00 0.00 46.02 44.95 1kfi n GLY 374 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 1kfi h TRP 375 N 0.00 0.00 0.00 1.61 4.06 -1.91 -2.62 115.95 117.09 1kfi h TRP 375 Ca 0.00 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 60.94 1kfi h TRP 375 Cb 0.00 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.16 1kfi h TRP 375 CO 0.00 0.00 -0.04 1.57 -3.56 0.00 0.00 178.44 176.41 1kfi h LYS 376 N 0.00 0.00 0.00 0.49 2.10 -1.90 -1.47 116.57 115.79 1kfi h LYS 376 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1kfi h LYS 376 Cb 0.36 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.69 1kfi h LYS 376 CO 0.00 0.04 0.00 0.74 -2.00 0.00 0.00 179.45 178.23 1kfi h PHE 377 N 0.00 0.00 0.00 0.07 0.04 -1.77 -2.98 116.94 112.30 1kfi h PHE 377 Ca -0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1kfi h PHE 377 Cb 0.16 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.31 1kfi h PHE 377 CO 0.00 0.00 -0.41 0.74 -0.60 0.00 0.00 178.31 178.04 1kfi h PHE 378 N 0.00 0.00 0.07 -0.55 0.05 -1.44 -3.39 116.94 111.67 1kfi h PHE 378 Ca 0.00 0.00 0.02 0.00 3.82 0.00 0.00 57.97 61.81 1kfi h PHE 378 Cb 0.77 0.00 -0.05 0.00 2.00 0.00 0.00 35.95 38.67 1kfi h PHE 378 CO 0.00 0.00 -0.41 0.78 -0.18 0.00 0.00 178.31 178.50 1kfi h GLY 379 N 4.32 -0.79 0.89 -1.45 0.00 -1.51 -1.34 103.07 103.19 1kfi h GLY 379 Ca 0.00 0.49 0.02 0.00 0.00 0.00 0.00 47.33 47.85 1kfi h GLY 379 CO 0.00 -0.26 0.40 3.43 0.00 0.00 0.00 176.54 180.12 1kfi h ASN 380 N -0.61 0.67 -0.46 0.19 -0.26 -1.77 0.17 115.58 113.51 1kfi h ASN 380 Ca 0.03 -0.00 0.04 0.00 -0.56 0.00 0.00 56.30 55.81 1kfi h ASN 380 Cb 0.66 -0.15 -0.03 0.00 -1.06 0.00 0.00 38.32 37.74 1kfi h ASN 380 CO -0.27 0.47 0.31 -0.07 -1.06 0.00 0.00 177.43 176.80 1kfi h LEU 381 N 0.80 0.42 0.23 1.61 3.38 -1.71 0.31 115.31 120.35 1kfi h LEU 381 Ca 0.26 -0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.89 1kfi h LEU 381 Cb -0.00 -0.10 0.03 0.00 0.09 0.00 0.00 40.66 40.68 1kfi h LEU 381 CO -0.10 0.29 -1.50 0.24 0.09 0.00 0.00 178.44 177.46 1kfi h MET 382 N 0.49 0.49 -0.68 1.13 2.86 -0.22 0.95 114.93 119.95 1kfi h MET 382 Ca 0.19 -0.84 -0.08 0.00 -2.06 0.00 0.00 59.70 56.91 1kfi h MET 382 Cb 0.14 0.31 -0.03 0.00 0.06 0.00 0.00 31.60 32.09 1kfi h MET 382 CO -0.05 1.40 0.12 -0.44 1.06 0.00 0.00 176.91 179.01 1kfi h ASP 383 N 0.13 1.07 0.00 1.22 3.45 -0.27 -1.94 116.42 120.09 1kfi h ASP 383 Ca -0.26 -0.25 0.00 0.00 0.43 0.00 0.00 57.03 56.95 1kfi h ASP 383 Cb 2.14 -0.28 0.00 0.00 -0.56 0.00 0.00 39.33 40.63 1kfi h ASP 383 CO 0.25 1.05 0.00 0.00 -1.57 0.00 0.00 179.24 178.98 1kfi n ALA 384 N -2.46 2.45 -1.99 3.45 0.00 0.11 -4.86 120.51 117.21 1kfi n ALA 384 Ca 0.05 -0.13 -0.15 0.00 0.00 0.00 0.00 53.44 53.21 1kfi n ALA 384 Cb 0.29 -1.34 -0.03 0.00 0.00 0.00 0.00 19.45 18.37 1kfi n ALA 384 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1kfi n GLY 385 N 0.59 0.38 0.08 0.00 0.00 -0.73 -4.90 105.19 100.61 1kfi n GLY 385 Ca 0.15 -0.28 -0.05 0.00 0.00 0.00 0.00 46.02 45.84 1kfi n GLY 385 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1kfi h LEU 386 N 0.00 0.00 -8.11 0.99 3.38 -1.04 -3.48 115.31 107.04 1kfi h LEU 386 Ca -0.34 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.52 1kfi h LEU 386 Cb 1.16 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 41.77 1kfi h LEU 386 CO 0.43 0.88 -0.59 0.27 0.09 0.00 0.00 178.44 179.52 1kfi s ILE 387 N -2.73 0.20 -0.01 1.22 -4.36 -1.02 -3.37 121.20 111.13 1kfi s ILE 387 Ca -0.02 -1.63 0.01 0.00 -0.26 0.00 0.00 60.65 58.76 1kfi s ILE 387 Cb 0.09 -1.47 0.02 0.00 1.25 0.00 0.00 42.46 42.35 1kfi s ILE 387 CO 0.81 -0.90 0.87 -0.46 0.24 0.00 0.00 174.94 175.50 1kfi n ASN 388 N 0.06 0.23 -3.70 4.36 6.94 -0.66 -4.52 115.26 117.97 1kfi n ASN 388 Ca -0.14 -1.79 -0.12 0.00 -0.02 0.00 0.00 54.58 52.51 1kfi n ASN 388 Cb 0.61 -0.15 -0.10 0.00 -2.36 0.00 0.00 39.78 37.78 1kfi n ASN 388 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 1kfi s LEU 389 N -0.23 -0.03 -0.00 -4.53 2.96 -1.21 -3.69 118.68 111.93 1kfi s LEU 389 Ca 0.02 0.98 -0.27 0.00 -0.22 0.00 0.00 54.13 54.65 1kfi s LEU 389 Cb 0.02 1.59 0.06 0.00 0.50 0.00 0.00 46.19 48.36 1kfi s LEU 389 CO 0.00 -0.18 0.60 0.00 -1.32 0.00 0.00 176.35 175.45 1kfi s GLY 391 N -1.53 -0.32 0.08 0.00 0.00 -1.10 0.33 107.32 104.77 1kfi s GLY 391 Ca -0.09 0.15 0.03 0.00 0.00 0.00 0.00 44.72 44.81 1kfi s GLY 391 CO 0.05 0.05 -0.09 -0.54 0.00 0.00 0.00 173.10 172.56 1kfi s GLU 392 N -3.69 0.73 0.61 2.90 2.02 0.60 -3.10 118.70 118.78 1kfi s GLU 392 Ca 0.07 -1.02 0.32 0.00 0.02 0.00 0.00 54.97 54.36 1kfi s GLU 392 Cb -0.03 -0.44 1.87 0.00 0.10 0.00 0.00 34.13 35.62 1kfi s GLU 392 CO -0.02 0.07 2.20 1.05 0.02 0.00 0.00 175.26 178.59 1kfi h GLU 393 N 3.89 0.00 -2.22 1.61 9.09 -1.87 -2.99 114.58 122.08 1kfi h GLU 393 Ca -0.37 0.00 -0.38 0.00 0.05 0.00 0.00 59.36 58.66 1kfi h GLU 393 Cb 1.19 0.00 -0.08 0.00 -1.65 0.00 0.00 28.75 28.21 1kfi h GLU 393 CO 0.49 0.00 0.73 -1.13 0.05 0.00 0.00 179.01 179.15 1kfi n SER 394 N -3.63 6.32 -2.79 3.06 3.41 -1.26 -4.52 113.62 114.21 1kfi n SER 394 Ca -0.01 -2.69 -0.18 0.00 -0.26 0.00 0.00 58.87 55.72 1kfi n SER 394 Cb 0.18 -1.40 0.00 0.00 -0.26 0.00 0.00 64.21 62.73 1kfi n SER 394 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1kfi n PHE 395 N 2.31 -1.57 -4.99 7.33 3.72 -1.21 -4.89 117.46 118.17 1kfi n PHE 395 Ca 0.52 0.23 -0.32 0.00 -0.05 0.00 0.00 57.45 57.83 1kfi n PHE 395 Cb 0.67 -3.35 -0.16 0.00 -0.94 0.00 0.00 39.48 35.71 1kfi n PHE 395 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1kfi s GLY 396 N -2.35 1.44 -0.06 1.37 0.00 -1.13 -0.03 107.32 106.56 1kfi s GLY 396 Ca 0.17 -0.93 -0.06 0.00 0.00 0.00 0.00 44.72 43.90 1kfi s GLY 396 CO 0.20 -0.27 0.16 -1.59 0.00 0.00 0.00 173.10 171.61 1kfi s THR 397 N 0.32 -0.00 0.20 0.90 2.01 -1.26 -0.29 115.64 117.51 1kfi s THR 397 Ca -0.14 0.01 -0.06 0.00 0.31 0.00 0.00 61.69 61.80 1kfi s THR 397 Cb -0.17 -0.24 0.03 0.00 0.01 0.00 0.00 72.50 72.13 1kfi s THR 397 CO 0.07 0.00 0.38 0.61 -0.69 0.00 0.00 174.62 174.99 1kfi n GLY 398 N 3.06 1.66 1.77 4.40 0.00 0.15 -1.87 105.19 114.36 1kfi n GLY 398 Ca -0.13 -1.19 -0.07 0.00 0.00 0.00 0.00 46.02 44.62 1kfi n GLY 398 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1kfi n SER 399 N -1.36 -0.75 -0.77 1.61 2.88 -1.26 -1.83 113.62 112.14 1kfi n SER 399 Ca -0.04 -1.97 0.03 0.00 -1.33 0.00 0.00 58.87 55.56 1kfi n SER 399 Cb 0.30 1.38 0.13 0.00 -0.75 0.00 0.00 64.21 65.26 1kfi n SER 399 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 1kfi n ASN 400 N -1.82 2.11 0.15 -3.46 0.23 -1.24 -3.71 115.26 107.53 1kfi n ASN 400 Ca -0.00 -2.19 0.13 0.00 -0.53 0.00 0.00 54.58 51.99 1kfi n ASN 400 Cb 0.31 -0.41 0.44 0.00 -2.08 0.00 0.00 39.78 38.04 1kfi n ASN 400 CO 0.00 0.00 0.00 1.12 -0.93 0.00 0.00 177.26 177.45 1kfi h HIS 401 N 1.41 0.00 -1.07 -2.53 2.07 -1.96 -3.46 115.15 109.61 1kfi h HIS 401 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 1kfi h HIS 401 Cb 0.74 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.72 1kfi h HIS 401 CO 0.29 0.00 0.00 0.44 -3.07 0.00 0.00 177.93 175.59 1kfi n ILE 402 N -2.48 0.00 -2.23 6.12 -5.35 -1.24 -4.91 119.36 109.27 1kfi n ILE 402 Ca 0.03 0.00 0.05 0.00 -0.27 0.00 0.00 62.75 62.56 1kfi n ILE 402 Cb 0.36 0.00 0.08 0.00 -1.74 0.00 0.00 39.64 38.33 1kfi n ILE 402 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1kfi n ARG 403 N 0.00 0.47 -4.09 6.28 5.12 -1.26 -4.87 116.66 118.30 1kfi n ARG 403 Ca 0.00 -2.37 -0.09 0.00 -1.93 0.00 0.00 57.85 53.46 1kfi n ARG 403 Cb 0.00 -0.48 -0.10 0.00 -1.16 0.00 0.00 32.46 30.72 1kfi n ARG 403 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 1kfi s GLU 404 N -0.95 0.62 0.56 5.56 0.41 -1.26 -4.27 118.70 119.38 1kfi s GLU 404 Ca 0.35 -1.13 -0.19 0.00 -0.41 0.00 0.00 54.97 53.59 1kfi s GLU 404 Cb 0.38 0.04 -0.05 0.00 -1.78 0.00 0.00 34.13 32.72 1kfi s GLU 404 CO -0.14 -0.06 1.17 -1.59 -0.49 0.00 0.00 175.26 174.15 1kfi s LYS 405 N -3.36 3.18 -0.20 1.61 -2.85 -1.26 -4.69 119.74 112.17 1kfi s LYS 405 Ca 0.04 1.73 -0.02 0.00 -1.00 0.00 0.00 55.97 56.72 1kfi s LYS 405 Cb 0.03 -1.99 0.06 0.00 -2.06 0.00 0.00 37.83 33.88 1kfi s LYS 405 CO -0.06 -1.02 0.02 0.34 0.10 0.00 0.00 175.35 174.73 1kfi s ASP 406 N -1.65 3.12 0.05 0.03 -1.08 -0.78 -4.31 116.67 112.04 1kfi s ASP 406 Ca 0.75 -0.91 -0.28 0.00 -0.52 0.00 0.00 52.55 51.59 1kfi s ASP 406 Cb -0.27 -0.72 -0.17 0.00 -1.46 0.00 0.00 42.92 40.29 1kfi s ASP 406 CO 0.30 -0.29 1.49 1.23 0.52 0.00 0.00 175.17 178.42 1kfi h GLY 407 N 8.18 -0.58 1.24 2.66 0.00 -1.29 -2.74 103.07 110.54 1kfi h GLY 407 Ca -0.16 0.22 -0.01 0.00 0.00 0.00 0.00 47.33 47.37 1kfi h GLY 407 CO 0.35 -0.21 0.42 -2.22 0.00 0.00 0.00 176.54 174.88 1kfi h ILE 408 N -0.70 1.21 -0.19 2.60 1.08 -1.86 -2.26 117.51 117.39 1kfi h ILE 408 Ca -0.06 -0.51 0.03 0.00 -0.39 0.00 0.00 64.86 63.93 1kfi h ILE 408 Cb 0.50 0.21 -0.03 0.00 -3.07 0.00 0.00 36.82 34.43 1kfi h ILE 408 CO 0.09 0.23 0.02 -0.25 -0.69 0.00 0.00 178.15 177.56 1kfi h TRP 409 N 1.02 0.03 -0.96 1.37 7.01 -1.93 0.10 115.95 122.60 1kfi h TRP 409 Ca 0.26 0.01 0.08 0.00 2.11 0.00 0.00 58.89 61.35 1kfi h TRP 409 Cb 0.00 0.02 -0.07 0.00 -2.10 0.00 0.00 29.16 27.01 1kfi h TRP 409 CO 0.01 -0.00 0.62 0.00 -2.79 0.00 0.00 178.44 176.27 1kfi h ALA 410 N 1.15 1.50 -0.48 2.65 0.00 -1.15 0.32 119.26 123.24 1kfi h ALA 410 Ca 0.09 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.87 1kfi h ALA 410 Cb 0.10 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 1kfi h ALA 410 CO -0.13 0.34 -0.16 0.28 0.00 0.00 0.00 179.25 179.58 1kfi h VAL 411 N 1.06 1.27 -0.30 0.00 2.07 -0.72 -2.09 116.25 117.54 1kfi h VAL 411 Ca 0.43 -1.30 -0.10 0.00 0.82 0.00 0.00 66.70 66.55 1kfi h VAL 411 Cb 0.27 1.06 -0.01 0.00 -1.52 0.00 0.00 31.29 31.08 1kfi h VAL 411 CO -0.18 0.45 -0.22 -0.07 0.02 0.00 0.00 177.57 177.57 1kfi h LEU 412 N 0.82 0.57 -0.52 2.57 3.38 0.11 -0.76 115.31 121.48 1kfi h LEU 412 Ca 0.12 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 1kfi h LEU 412 Cb 0.70 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 1kfi h LEU 412 CO 0.05 0.79 0.29 0.00 0.09 0.00 0.00 178.44 179.66 1kfi h ALA 413 N 1.26 0.67 -0.38 1.53 0.00 -0.16 0.14 119.26 122.32 1kfi h ALA 413 Ca 0.08 -0.09 -0.13 0.00 0.00 0.00 0.00 54.91 54.76 1kfi h ALA 413 Cb 0.66 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1kfi h ALA 413 CO 0.05 0.19 -0.27 -1.49 0.00 0.00 0.00 179.25 177.72 1kfi h TRP 414 N 0.70 1.00 -0.50 0.00 4.06 -1.05 -1.40 115.95 118.77 1kfi h TRP 414 Ca 0.18 -0.28 -0.01 0.00 2.06 0.00 0.00 58.89 60.85 1kfi h TRP 414 Cb 0.05 -0.22 -0.02 0.00 -1.00 0.00 0.00 29.16 27.96 1kfi h TRP 414 CO -0.02 1.06 0.26 -0.07 -3.56 0.00 0.00 178.44 176.12 1kfi h LEU 415 N 0.66 0.61 -0.42 -4.49 3.38 -0.98 0.34 115.31 114.41 1kfi h LEU 415 Ca 0.07 -0.04 -0.06 0.00 0.09 0.00 0.00 57.88 57.94 1kfi h LEU 415 Cb 0.85 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.43 1kfi h LEU 415 CO 0.07 0.51 0.04 0.74 0.09 0.00 0.00 178.44 179.89 1kfi h THR 416 N 0.69 1.25 -0.77 0.22 2.02 -0.66 0.31 112.91 115.97 1kfi h THR 416 Ca 0.18 -0.95 -0.04 0.00 0.77 0.00 0.00 66.41 66.37 1kfi h THR 416 Cb 0.04 1.04 -0.03 0.00 -1.74 0.00 0.00 68.15 67.46 1kfi h THR 416 CO -0.03 0.33 0.33 0.40 0.37 0.00 0.00 175.52 176.92 1kfi h ILE 417 N 0.57 1.25 -0.59 3.11 2.04 -0.40 -2.42 117.51 121.07 1kfi h ILE 417 Ca 0.12 -0.77 -0.09 0.00 1.00 0.00 0.00 64.86 65.13 1kfi h ILE 417 Cb 0.42 0.32 -0.02 0.00 -0.74 0.00 0.00 36.82 36.81 1kfi h ILE 417 CO 0.01 0.32 0.03 -0.07 0.00 0.00 0.00 178.15 178.44 1kfi h LEU 418 N 1.10 0.96 -0.39 1.44 3.38 -0.52 -1.84 115.31 119.44 1kfi h LEU 418 Ca 0.26 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 1kfi h LEU 418 Cb 0.18 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 1kfi h LEU 418 CO -0.03 1.00 0.22 0.00 0.09 0.00 0.00 178.44 179.73 1kfi h ALA 419 N 1.10 0.50 -0.29 1.53 0.00 -0.06 -1.28 119.26 120.76 1kfi h ALA 419 Ca 0.17 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 1kfi h ALA 419 Cb 0.50 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1kfi h ALA 419 CO 0.02 0.02 -0.03 0.45 0.00 0.00 0.00 179.25 179.71 1kfi h HIS 420 N 0.51 0.58 0.00 0.00 3.86 -1.36 -2.61 115.15 116.13 1kfi h HIS 420 Ca 0.14 -0.11 -0.01 0.00 -1.16 0.00 0.00 60.37 59.23 1kfi h HIS 420 Cb 0.04 -0.15 -0.00 0.00 1.06 0.00 0.00 27.41 28.36 1kfi h HIS 420 CO -0.03 0.70 -0.04 0.87 0.86 0.00 0.00 177.93 180.29 1kfi h LYS 421 N 0.30 0.00 -0.21 2.45 6.56 -1.21 -3.04 116.57 121.43 1kfi h LYS 421 Ca 0.08 0.00 -0.10 0.00 -1.06 0.00 0.00 60.65 59.57 1kfi h LYS 421 Cb 0.48 0.00 -0.06 0.00 -0.57 0.00 0.00 32.23 32.08 1kfi h LYS 421 CO 0.02 0.04 -0.20 0.09 -2.06 0.00 0.00 179.45 177.34 1kfi n ASN 422 N -3.21 2.32 -4.53 0.86 4.13 -0.49 -4.62 115.26 109.71 1kfi n ASN 422 Ca -0.01 -3.72 -0.42 0.00 1.68 0.00 0.00 54.58 52.12 1kfi n ASN 422 Cb 0.25 -0.58 -0.03 0.00 -1.54 0.00 0.00 39.78 37.88 1kfi n ASN 422 CO 0.00 0.00 0.00 -0.75 0.28 0.00 0.00 177.26 176.79 1kfi s LYS 423 N -3.19 3.46 -0.39 3.52 2.47 -1.00 -4.45 119.74 120.15 1kfi s LYS 423 Ca 0.41 -1.02 -0.15 0.00 -1.56 0.00 0.00 55.97 53.65 1kfi s LYS 423 Cb 0.38 -4.91 0.02 0.00 -1.46 0.00 0.00 37.83 31.86 1kfi s LYS 423 CO -0.02 -2.08 0.47 0.09 0.16 0.00 0.00 175.35 173.98 1kfi n ASN 424 N 8.44 -7.64 -4.21 1.43 3.02 -1.26 -5.05 115.26 109.99 1kfi n ASN 424 Ca 0.21 0.63 -0.12 0.00 -0.03 0.00 0.00 54.58 55.27 1kfi n ASN 424 Cb 0.50 -4.81 -0.10 0.00 -0.61 0.00 0.00 39.78 34.75 1kfi n ASN 424 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1kfi s THR 425 N -2.23 0.62 0.24 3.41 -4.23 -1.26 -5.06 115.64 107.13 1kfi s THR 425 Ca 0.21 -1.96 -0.07 0.00 -1.18 0.00 0.00 61.69 58.69 1kfi s THR 425 Cb -0.05 -1.98 0.23 0.00 1.34 0.00 0.00 72.50 72.04 1kfi s THR 425 CO 0.76 -0.60 1.90 -2.24 -0.54 0.00 0.00 174.62 173.91 1kfi h ASP 426 N 2.79 1.10 -4.98 3.99 2.03 -1.98 -3.45 116.42 115.93 1kfi h ASP 426 Ca -0.36 -0.05 -0.29 0.00 -0.73 0.00 0.00 57.03 55.60 1kfi h ASP 426 Cb 1.19 -0.28 -0.15 0.00 -0.83 0.00 0.00 39.33 39.27 1kfi h ASP 426 CO 0.63 0.82 -0.62 -1.38 -1.03 0.00 0.00 179.24 177.66 1kfi s HIS 427 N -6.05 1.30 -0.21 4.15 -3.43 -1.26 -5.12 115.29 104.68 1kfi s HIS 427 Ca -0.13 -1.24 -0.27 0.00 -0.80 0.00 0.00 55.06 52.62 1kfi s HIS 427 Cb 0.17 -0.72 -0.00 0.00 -1.43 0.00 0.00 32.58 30.61 1kfi s HIS 427 CO 0.82 -0.45 0.95 0.12 -2.00 0.00 0.00 174.74 174.17 1kfi s PHE 428 N -3.92 3.37 -0.23 0.38 5.36 -1.26 -4.98 117.98 116.70 1kfi s PHE 428 Ca 0.36 1.37 -0.28 0.00 -0.96 0.00 0.00 56.93 57.41 1kfi s PHE 428 Cb 0.07 -3.16 0.01 0.00 -0.34 0.00 0.00 43.02 39.60 1kfi s PHE 428 CO 0.11 -0.38 1.01 0.08 -1.46 0.00 0.00 175.22 174.58 1kfi s VAL 429 N 2.77 4.70 0.54 3.12 1.01 -1.26 -5.03 120.40 126.25 1kfi s VAL 429 Ca 0.41 1.98 -0.02 0.00 0.00 0.00 0.00 61.98 64.34 1kfi s VAL 429 Cb -0.16 -4.29 0.01 0.00 0.00 0.00 0.00 36.38 31.95 1kfi s VAL 429 CO 0.09 -0.16 0.80 0.42 0.00 0.00 0.00 175.10 176.25 1kfi s THR 430 N 3.10 3.53 0.34 3.92 -4.23 -1.26 -4.88 115.64 116.15 1kfi s THR 430 Ca 0.43 -0.31 0.09 0.00 -1.18 0.00 0.00 61.69 60.72 1kfi s THR 430 Cb -0.15 -3.36 0.08 0.00 1.34 0.00 0.00 72.50 70.41 1kfi s THR 430 CO 0.07 -0.31 1.79 -0.37 -0.54 0.00 0.00 174.62 175.26 1kfi h VAL 431 N 0.05 1.27 -0.67 2.29 -1.51 -1.94 -0.42 116.25 115.32 1kfi h VAL 431 Ca -0.45 -1.28 -0.06 0.00 -1.23 0.00 0.00 66.70 63.67 1kfi h VAL 431 Cb 1.27 1.58 -0.03 0.00 -2.13 0.00 0.00 31.29 31.98 1kfi h VAL 431 CO 0.58 0.38 0.17 -0.08 -1.23 0.00 0.00 177.57 177.39 1kfi h GLU 432 N 0.15 1.06 -0.52 5.19 4.81 -1.93 0.14 114.58 123.47 1kfi h GLU 432 Ca 0.02 -0.25 -0.03 0.00 -0.13 0.00 0.00 59.36 58.97 1kfi h GLU 432 Cb 0.67 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.88 1kfi h GLU 432 CO 0.05 0.95 0.22 1.49 -0.73 0.00 0.00 179.01 180.98 1kfi h GLU 433 N 0.99 0.78 -0.10 1.92 4.81 -1.73 0.34 114.58 121.59 1kfi h GLU 433 Ca 0.21 -0.14 -0.00 0.00 -0.13 0.00 0.00 59.36 59.30 1kfi h GLU 433 Cb 0.36 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 29.60 1kfi h GLU 433 CO 0.00 0.68 0.04 0.82 -0.73 0.00 0.00 179.01 179.82 1kfi h ILE 434 N 0.71 1.13 -0.15 2.32 2.04 -0.56 -0.03 117.51 122.97 1kfi h ILE 434 Ca 0.18 -0.40 -0.14 0.00 1.00 0.00 0.00 64.86 65.50 1kfi h ILE 434 Cb 0.18 1.22 -0.01 0.00 -0.74 0.00 0.00 36.82 37.48 1kfi h ILE 434 CO -0.02 0.12 -0.49 0.58 0.00 0.00 0.00 178.15 178.34 1kfi h VAL 435 N 0.01 1.33 -0.60 1.67 2.07 -0.59 -0.07 116.25 120.07 1kfi h VAL 435 Ca 0.03 -1.71 -0.07 0.00 0.82 0.00 0.00 66.70 65.77 1kfi h VAL 435 Cb 0.15 1.75 -0.02 0.00 -1.52 0.00 0.00 31.29 31.65 1kfi h VAL 435 CO -0.00 0.52 0.10 0.74 0.02 0.00 0.00 177.57 178.95 1kfi h THR 436 N 0.32 1.26 -0.23 2.57 2.02 -0.20 -0.13 112.91 118.51 1kfi h THR 436 Ca 0.02 -0.98 -0.10 0.00 0.77 0.00 0.00 66.41 66.11 1kfi h THR 436 Cb 0.98 0.73 -0.01 0.00 -1.74 0.00 0.00 68.15 68.10 1kfi h THR 436 CO 0.08 0.36 -0.30 1.56 0.37 0.00 0.00 175.52 177.60 1kfi h GLN 437 N 0.90 0.47 -0.06 6.66 4.20 -0.77 -1.20 115.11 125.31 1kfi h GLN 437 Ca 0.18 -0.19 0.02 0.00 0.06 0.00 0.00 58.65 58.72 1kfi h GLN 437 Cb 0.41 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.16 1kfi h GLN 437 CO 0.01 0.72 -0.04 -0.92 -0.67 0.00 0.00 178.83 177.93 1kfi h TYR 438 N 0.41 -0.09 -0.81 2.96 3.20 -0.23 -1.57 116.97 120.84 1kfi h TYR 438 Ca 0.05 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.91 1kfi h TYR 438 Cb 0.73 0.05 -0.04 0.00 1.54 0.00 0.00 36.73 39.01 1kfi h TYR 438 CO 0.02 -0.06 0.42 -1.49 -1.64 0.00 0.00 178.16 175.41 1kfi h TRP 439 N -0.04 1.14 0.00 -3.82 6.55 -0.73 -0.38 115.95 118.67 1kfi h TRP 439 Ca 0.04 -0.04 -0.01 0.00 0.95 0.00 0.00 58.89 59.83 1kfi h TRP 439 Cb 0.09 -0.36 -0.00 0.00 -0.86 0.00 0.00 29.16 28.03 1kfi h TRP 439 CO -0.14 0.81 -0.05 1.96 -1.05 0.00 0.00 178.44 179.97 1kfi h GLN 440 N 1.15 0.00 0.01 0.49 4.20 -0.68 0.27 115.11 120.55 1kfi h GLN 440 Ca 0.28 0.00 -0.37 0.00 0.06 0.00 0.00 58.65 58.62 1kfi h GLN 440 Cb 0.08 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 27.79 1kfi h GLN 440 CO -0.04 0.05 -2.35 0.94 -0.67 0.00 0.00 178.83 176.77 1kfi n GLN 441 N -3.43 0.68 -0.00 1.46 7.27 -0.64 -4.68 117.38 118.03 1kfi n GLN 441 Ca -0.02 0.08 0.03 0.00 0.07 0.00 0.00 57.00 57.17 1kfi n GLN 441 Cb 0.19 -1.55 -0.05 0.00 2.41 0.00 0.00 30.24 31.24 1kfi n GLN 441 CO 0.00 0.00 0.00 1.19 0.07 0.00 0.00 177.06 178.32 1kfi n PHE 442 N -2.98 0.00 0.00 3.69 3.72 -0.23 -5.11 117.46 116.55 1kfi n PHE 442 Ca -0.36 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.04 1kfi n PHE 442 Cb 1.09 -0.12 0.00 0.00 -0.94 0.00 0.00 39.48 39.51 1kfi n PHE 442 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1kfi n GLY 443 N 1.87 0.80 3.31 1.37 0.00 0.94 -4.96 105.19 108.52 1kfi n GLY 443 Ca -0.01 -2.08 -0.32 0.00 0.00 0.00 0.00 46.02 43.62 1kfi n GLY 443 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1kfi s ARG 444 N -1.39 2.45 -0.70 1.61 3.52 -0.15 -4.43 118.95 119.86 1kfi s ARG 444 Ca 0.00 -0.88 -0.08 0.00 -0.13 0.00 0.00 55.73 54.64 1kfi s ARG 444 Cb 0.00 -2.17 0.18 0.00 -1.56 0.00 0.00 34.95 31.40 1kfi s ARG 444 CO 0.00 0.46 0.57 -0.80 -0.81 0.00 0.00 175.30 174.72 1kfi s ASN 445 N -0.34 5.94 0.32 -2.12 -0.87 -1.26 -1.16 114.94 115.45 1kfi s ASN 445 Ca 0.02 -2.69 -0.29 0.00 -1.57 0.00 0.00 52.86 48.33 1kfi s ASN 445 Cb -0.12 -2.02 -0.11 0.00 -0.02 0.00 0.00 41.25 38.98 1kfi s ASN 445 CO 0.02 -0.49 1.45 -0.31 -2.57 0.00 0.00 177.10 175.20 1kfi s TYR 446 N 0.18 2.84 -0.22 2.20 1.51 -0.68 -4.88 117.35 118.30 1kfi s TYR 446 Ca 0.16 1.13 -0.19 0.00 -1.01 0.00 0.00 57.07 57.16 1kfi s TYR 446 Cb -0.17 -3.89 0.06 0.00 -0.11 0.00 0.00 41.96 37.85 1kfi s TYR 446 CO -0.05 -2.72 0.57 -0.47 -1.11 0.00 0.00 175.55 171.77 1kfi s TYR 447 N -0.65 -0.66 0.04 2.71 5.04 -1.26 -1.57 117.35 121.01 1kfi s TYR 447 Ca 0.55 1.56 -0.07 0.00 -2.44 0.00 0.00 57.07 56.67 1kfi s TYR 447 Cb -0.44 0.25 -0.00 0.00 0.35 0.00 0.00 41.96 42.12 1kfi s TYR 447 CO 0.53 -0.32 0.14 0.45 -1.34 0.00 0.00 175.55 175.01 1kfi s SER 448 N 0.48 0.11 -0.07 4.32 0.15 0.29 -4.98 113.70 114.01 1kfi s SER 448 Ca -0.01 -0.47 0.02 0.00 0.70 0.00 0.00 55.95 56.19 1kfi s SER 448 Cb -0.04 0.26 0.01 0.00 -1.71 0.00 0.00 66.02 64.54 1kfi s SER 448 CO -0.02 -0.54 -0.11 -0.60 1.20 0.00 0.00 173.24 173.17 1kfi s ARG 449 N -2.66 1.62 -0.21 5.44 3.52 -1.26 -0.28 118.95 125.12 1kfi s ARG 449 Ca -0.04 -0.38 -0.07 0.00 -0.13 0.00 0.00 55.73 55.10 1kfi s ARG 449 Cb -0.01 -1.37 -0.04 0.00 -1.56 0.00 0.00 34.95 31.97 1kfi s ARG 449 CO -0.05 0.00 0.07 0.71 -0.81 0.00 0.00 175.30 175.23 1kfi s TYR 450 N 0.75 3.17 -0.16 5.12 4.12 0.46 -2.27 117.35 128.54 1kfi s TYR 450 Ca -0.13 -0.12 -0.02 0.00 0.02 0.00 0.00 57.07 56.82 1kfi s TYR 450 Cb -0.15 -2.16 -0.02 0.00 -1.52 0.00 0.00 41.96 38.11 1kfi s TYR 450 CO 0.03 -0.07 -0.08 -0.51 0.02 0.00 0.00 175.55 174.94 1kfi s ASP 451 N 0.94 4.32 -0.50 2.29 -0.00 -0.28 -0.41 116.67 123.02 1kfi s ASP 451 Ca 0.04 -0.29 0.02 0.00 -0.00 0.00 0.00 52.55 52.32 1kfi s ASP 451 Cb -0.14 -1.70 0.13 0.00 -0.00 0.00 0.00 42.92 41.22 1kfi s ASP 451 CO 0.03 0.12 0.26 -0.31 -0.00 0.00 0.00 175.17 175.26 1kfi s TYR 452 N 0.66 3.37 0.21 4.23 2.02 0.71 0.11 117.35 128.67 1kfi s TYR 452 Ca -0.04 -2.99 -0.24 0.00 -0.37 0.00 0.00 57.07 53.43 1kfi s TYR 452 Cb -0.15 -2.96 -0.08 0.00 -0.40 0.00 0.00 41.96 38.37 1kfi s TYR 452 CO 0.02 -0.82 0.79 -1.21 -1.57 0.00 0.00 175.55 172.77 1kfi s GLU 453 N 0.07 4.46 -1.27 -0.62 2.02 -1.26 -1.30 118.70 120.80 1kfi s GLU 453 Ca 0.15 1.09 -0.14 0.00 0.02 0.00 0.00 54.97 56.10 1kfi s GLU 453 Cb -0.23 -3.05 0.00 0.00 0.10 0.00 0.00 34.13 30.95 1kfi s GLU 453 CO -0.03 0.46 0.59 1.04 0.02 0.00 0.00 175.26 177.34 1kfi n GLN 454 N 1.10 -1.92 -2.98 1.61 6.02 -0.29 -4.96 117.38 115.97 1kfi n GLN 454 Ca -0.03 0.37 -0.20 0.00 -0.01 0.00 0.00 57.00 57.13 1kfi n GLN 454 Cb 0.50 -4.04 0.02 0.00 1.02 0.00 0.00 30.24 27.73 1kfi n GLN 454 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 1kfi s VAL 455 N -3.72 3.27 -0.04 5.09 -7.23 0.19 -4.75 120.40 113.22 1kfi s VAL 455 Ca 0.27 -0.81 -0.34 0.00 -1.81 0.00 0.00 61.98 59.29 1kfi s VAL 455 Cb -0.11 -3.16 -0.12 0.00 0.56 0.00 0.00 36.38 33.55 1kfi s VAL 455 CO 0.89 -0.09 1.82 -0.67 -0.31 0.00 0.00 175.10 176.75 1kfi n ASP 456 N -2.01 3.39 0.14 4.85 2.03 -1.26 -1.66 116.55 122.02 1kfi n ASP 456 Ca 0.05 0.99 -0.13 0.00 0.52 0.00 0.00 54.79 56.22 1kfi n ASP 456 Cb 0.59 -1.38 -0.07 0.00 -0.72 0.00 0.00 41.12 39.54 1kfi n ASP 456 CO 0.00 0.00 0.00 -1.28 -1.92 0.00 0.00 177.20 174.00 1kfi h SER 457 N 8.56 -0.36 -1.00 1.67 0.87 -1.92 -0.01 113.55 121.36 1kfi h SER 457 Ca -0.48 0.03 0.05 0.00 -1.23 0.00 0.00 61.79 60.16 1kfi h SER 457 Cb 1.27 0.12 -0.06 0.00 -0.44 0.00 0.00 62.40 63.28 1kfi h SER 457 CO 0.94 -0.22 0.65 0.00 -0.53 0.00 0.00 176.83 177.67 1kfi h ALA 458 N 0.45 1.37 -0.65 6.23 0.00 -1.98 -0.27 119.26 124.40 1kfi h ALA 458 Ca -0.01 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 1kfi h ALA 458 Cb 0.30 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 1kfi h ALA 458 CO -0.00 0.52 0.14 0.78 0.00 0.00 0.00 179.25 180.69 1kfi h GLY 459 N 1.24 1.13 0.97 0.00 0.00 -1.72 -1.63 103.07 103.06 1kfi h GLY 459 Ca 0.41 -0.72 -0.01 0.00 0.00 0.00 0.00 47.33 47.01 1kfi h GLY 459 CO -0.14 0.67 0.24 0.00 0.00 0.00 0.00 176.54 177.31 1kfi h ALA 460 N 1.05 0.58 -0.32 3.60 0.00 -0.12 -1.89 119.26 122.16 1kfi h ALA 460 Ca 0.20 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1kfi h ALA 460 Cb 0.38 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 1kfi h ALA 460 CO 0.01 0.11 0.14 -0.91 0.00 0.00 0.00 179.25 178.59 1kfi h ASN 461 N 0.59 0.40 -0.26 0.00 -0.26 -0.81 -1.74 115.58 113.50 1kfi h ASN 461 Ca 0.16 -0.03 -0.17 0.00 -0.56 0.00 0.00 56.30 55.70 1kfi h ASN 461 Cb 0.06 -0.10 -0.00 0.00 -1.06 0.00 0.00 38.32 37.22 1kfi h ASN 461 CO -0.02 0.36 -0.47 0.11 -1.06 0.00 0.00 177.43 176.35 1kfi h LYS 462 N 0.45 0.83 -0.38 0.81 1.57 -0.79 -2.51 116.57 116.56 1kfi h LYS 462 Ca 0.11 -0.48 -0.02 0.00 -1.87 0.00 0.00 60.65 58.40 1kfi h LYS 462 Cb 0.08 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.41 1kfi h LYS 462 CO -0.01 1.11 0.16 1.98 -0.57 0.00 0.00 179.45 182.13 1kfi h MET 463 N 0.66 0.55 -0.40 3.15 4.05 -0.67 0.17 114.93 122.45 1kfi h MET 463 Ca 0.04 -0.09 0.04 0.00 -0.28 0.00 0.00 59.70 59.40 1kfi h MET 463 Cb 1.05 -0.09 -0.04 0.00 -0.80 0.00 0.00 31.60 31.72 1kfi h MET 463 CO 0.10 0.52 0.17 0.52 0.23 0.00 0.00 176.91 178.45 1kfi h MET 464 N 0.47 0.35 -0.80 0.39 2.86 -1.30 0.64 114.93 117.54 1kfi h MET 464 Ca 0.13 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.73 1kfi h MET 464 Cb 0.16 -0.08 -0.04 0.00 0.06 0.00 0.00 31.60 31.70 1kfi h MET 464 CO -0.01 0.23 0.45 1.49 1.06 0.00 0.00 176.91 180.12 1kfi h GLU 465 N 0.36 1.10 -0.74 1.72 4.57 -1.08 -1.78 114.58 118.73 1kfi h GLU 465 Ca 0.18 -0.12 0.02 0.00 -1.18 0.00 0.00 59.36 58.26 1kfi h GLU 465 Cb 0.12 -0.22 -0.04 0.00 -0.16 0.00 0.00 28.75 28.45 1kfi h GLU 465 CO -0.15 0.81 0.49 1.25 -1.18 0.00 0.00 179.01 180.23 1kfi h HIS 466 N 1.10 0.90 -0.42 0.92 2.76 0.30 -1.45 115.15 119.26 1kfi h HIS 466 Ca 0.28 0.02 0.08 0.00 -2.20 0.00 0.00 60.37 58.55 1kfi h HIS 466 Cb 0.02 -0.30 -0.02 0.00 1.55 0.00 0.00 27.41 28.65 1kfi h HIS 466 CO 0.00 0.54 0.29 -0.07 -1.30 0.00 0.00 177.93 177.39 1kfi h LEU 467 N 0.94 0.20 -0.84 0.26 3.38 0.01 -1.04 115.31 118.22 1kfi h LEU 467 Ca 0.29 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 58.15 1kfi h LEU 467 Cb -0.01 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1kfi h LEU 467 CO -0.08 0.13 -0.36 0.50 0.09 0.00 0.00 178.44 178.73 1kfi h LYS 468 N 0.23 0.44 0.00 1.13 3.64 -1.18 -2.03 116.57 118.79 1kfi h LYS 468 Ca 0.19 -0.20 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1kfi h LYS 468 Cb 0.46 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.27 1kfi h LYS 468 CO -0.04 0.74 0.00 0.25 -2.27 0.00 0.00 179.45 178.13 1kfi n THR 469 N -4.06 0.00 -0.04 1.00 -2.24 -0.40 -2.29 114.28 106.26 1kfi n THR 469 Ca -0.01 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.77 1kfi n THR 469 Cb 0.47 -0.14 0.00 0.00 -2.10 0.00 0.00 70.33 68.56 1kfi n THR 469 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1kfi n LYS 470 N -0.50 0.55 0.06 -0.78 4.76 -0.77 -4.77 118.16 116.72 1kfi n LYS 470 Ca 0.00 -0.38 -0.03 0.00 -2.87 0.00 0.00 58.31 55.03 1kfi n LYS 470 Cb 0.00 -0.87 -0.02 0.00 -1.84 0.00 0.00 35.03 32.30 1kfi n LYS 470 CO 0.00 0.00 0.00 0.74 -1.37 0.00 0.00 177.40 176.77 1kfi h PHE 471 N 0.00 -0.24 -0.91 2.13 0.05 -1.45 -0.84 116.94 115.69 1kfi h PHE 471 Ca 0.00 -0.00 0.17 0.00 3.82 0.00 0.00 57.97 61.96 1kfi h PHE 471 Cb 0.02 0.09 -0.17 0.00 2.00 0.00 0.00 35.95 37.89 1kfi h PHE 471 CO 0.00 -0.12 -0.26 1.96 -0.18 0.00 0.00 178.31 179.71 1kfi h GLN 472 N -0.19 -0.01 -0.18 1.51 4.20 -1.87 0.85 115.11 119.42 1kfi h GLN 472 Ca -0.01 0.00 0.05 0.00 0.06 0.00 0.00 58.65 58.75 1kfi h GLN 472 Cb 0.16 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 27.88 1kfi h GLN 472 CO 0.00 -0.01 -0.19 -0.92 -0.67 0.00 0.00 178.83 177.04 1kfi h TYR 473 N -0.01 -0.50 -0.20 2.96 3.20 -1.82 -0.94 116.97 119.66 1kfi h TYR 473 Ca 0.42 0.03 0.04 0.00 3.14 0.00 0.00 58.73 62.36 1kfi h TYR 473 Cb 0.65 0.25 -0.04 0.00 1.54 0.00 0.00 36.73 39.13 1kfi h TYR 473 CO -0.73 -0.27 -0.08 0.35 -1.64 0.00 0.00 178.16 175.79 1kfi h PHE 474 N -0.22 -0.18 -0.60 -3.82 3.57 0.64 -2.49 116.94 113.83 1kfi h PHE 474 Ca 0.12 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.61 1kfi h PHE 474 Cb 0.39 0.11 -0.03 0.00 2.79 0.00 0.00 35.95 39.22 1kfi h PHE 474 CO -0.33 -0.13 0.25 0.93 -2.23 0.00 0.00 178.31 176.81 1kfi h GLU 475 N -0.05 0.87 0.00 1.11 5.08 -1.13 -2.32 114.58 118.15 1kfi h GLU 475 Ca 0.11 -0.13 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1kfi h GLU 475 Cb 0.21 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.30 1kfi h GLU 475 CO -0.24 0.70 0.00 1.04 -1.00 0.00 0.00 179.01 179.52 1kfi n GLN 476 N -4.33 0.45 0.08 2.33 6.02 -0.38 -2.70 117.38 118.85 1kfi n GLN 476 Ca 0.05 0.05 -0.09 0.00 -0.01 0.00 0.00 57.00 57.00 1kfi n GLN 476 Cb 0.16 -1.50 -0.01 0.00 1.02 0.00 0.00 30.24 29.91 1kfi n GLN 476 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 1kfi h LEU 477 N 0.00 0.29 -6.67 1.08 3.38 -1.04 -3.44 115.31 108.91 1kfi h LEU 477 Ca 0.00 -0.23 0.10 0.00 0.09 0.00 0.00 57.88 57.84 1kfi h LEU 477 Cb 0.16 -0.09 -0.21 0.00 0.09 0.00 0.00 40.66 40.62 1kfi h LEU 477 CO 0.00 1.03 -0.10 -0.75 0.09 0.00 0.00 178.44 178.71 1kfi s LYS 478 N -3.22 0.52 0.03 1.13 2.47 -1.10 -5.07 119.74 114.50 1kfi s LYS 478 Ca -0.03 1.21 -0.04 0.00 -1.56 0.00 0.00 55.97 55.56 1kfi s LYS 478 Cb 0.10 0.72 0.02 0.00 -1.46 0.00 0.00 37.83 37.21 1kfi s LYS 478 CO 0.83 -0.28 0.25 0.94 0.16 0.00 0.00 175.35 177.26 1kfi n GLN 479 N 5.38 -0.05 0.30 4.03 7.27 -1.25 0.10 117.38 133.16 1kfi n GLN 479 Ca -0.09 0.25 0.18 0.00 0.07 0.00 0.00 57.00 57.41 1kfi n GLN 479 Cb 0.50 -0.37 0.89 0.00 2.41 0.00 0.00 30.24 33.67 1kfi n GLN 479 CO 0.00 0.00 0.00 0.78 0.07 0.00 0.00 177.06 177.91 1kfi h GLY 480 N 0.00 0.00 -3.92 1.69 0.00 -1.98 -3.46 103.07 95.40 1kfi h GLY 480 Ca 0.05 0.00 -0.57 0.00 0.00 0.00 0.00 47.33 46.81 1kfi h GLY 480 CO -0.16 0.00 0.46 0.70 0.00 0.00 0.00 176.54 177.54 1kfi n ASN 481 N -3.22 2.50 -3.87 0.19 3.02 0.11 -3.66 115.26 110.34 1kfi n ASN 481 Ca -0.01 1.15 -0.16 0.00 -0.03 0.00 0.00 54.58 55.53 1kfi n ASN 481 Cb 0.21 -1.48 -0.15 0.00 -0.61 0.00 0.00 39.78 37.75 1kfi n ASN 481 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 1kfi s LYS 482 N -2.03 0.30 -0.01 3.52 2.20 -0.07 -4.51 119.74 119.13 1kfi s LYS 482 Ca 0.59 -0.02 0.02 0.00 -0.36 0.00 0.00 55.97 56.20 1kfi s LYS 482 Cb -0.54 -0.38 -0.00 0.00 -1.51 0.00 0.00 37.83 35.39 1kfi s LYS 482 CO 0.60 -0.04 -0.08 0.00 -0.36 0.00 0.00 175.35 175.47 1kfi s ALA 483 N 0.51 0.69 0.12 3.13 0.00 -1.26 -0.88 121.76 124.08 1kfi s ALA 483 Ca -0.05 -0.30 -0.24 0.00 0.00 0.00 0.00 51.96 51.37 1kfi s ALA 483 Cb -0.08 -0.23 0.08 0.00 0.00 0.00 0.00 23.12 22.90 1kfi s ALA 483 CO -0.01 0.14 1.12 0.16 0.00 0.00 0.00 175.76 177.16 1kfi s ASP 484 N 0.02 -0.00 -0.13 0.00 -4.77 -0.70 -4.94 116.67 106.15 1kfi s ASP 484 Ca 0.00 -0.51 -0.10 0.00 -3.30 0.00 0.00 52.55 48.64 1kfi s ASP 484 Cb -0.06 0.39 -0.05 0.00 -1.09 0.00 0.00 42.92 42.11 1kfi s ASP 484 CO -0.00 -0.76 0.20 -0.63 0.70 0.00 0.00 175.17 174.68 1kfi s ILE 485 N -2.18 5.38 -0.55 2.11 1.01 -1.26 -1.12 121.20 124.59 1kfi s ILE 485 Ca 0.23 0.35 -0.28 0.00 0.00 0.00 0.00 60.65 60.96 1kfi s ILE 485 Cb -0.02 -3.50 0.03 0.00 0.01 0.00 0.00 42.46 38.98 1kfi s ILE 485 CO 0.03 0.53 1.16 -0.47 0.00 0.00 0.00 174.94 176.19 1kfi s TYR 486 N -0.45 2.67 -0.27 3.97 5.04 0.37 -4.94 117.35 123.73 1kfi s TYR 486 Ca 0.15 0.45 -0.05 0.00 -2.44 0.00 0.00 57.07 55.18 1kfi s TYR 486 Cb -0.13 -4.46 0.01 0.00 0.35 0.00 0.00 41.96 37.74 1kfi s TYR 486 CO 0.04 -1.50 0.02 -0.51 -1.34 0.00 0.00 175.55 172.26 1kfi s ASP 487 N 2.83 4.75 -0.04 4.32 1.01 -1.26 -0.82 116.67 127.46 1kfi s ASP 487 Ca 0.43 -0.75 -0.18 0.00 0.71 0.00 0.00 52.55 52.76 1kfi s ASP 487 Cb -0.08 -1.78 -0.05 0.00 1.01 0.00 0.00 42.92 42.02 1kfi s ASP 487 CO 0.26 -0.15 0.50 -0.47 0.21 0.00 0.00 175.17 175.53 1kfi s TYR 488 N 1.43 3.64 -0.24 4.23 5.04 -0.32 -4.93 117.35 126.19 1kfi s TYR 488 Ca 0.02 1.04 0.02 0.00 -2.44 0.00 0.00 57.07 55.71 1kfi s TYR 488 Cb -0.17 -2.50 0.05 0.00 0.35 0.00 0.00 41.96 39.69 1kfi s TYR 488 CO -0.01 0.37 -0.12 0.08 -1.34 0.00 0.00 175.55 174.54 1kfi s VAL 489 N -0.17 2.05 0.07 3.14 1.01 -1.26 0.20 120.40 125.44 1kfi s VAL 489 Ca 0.27 -1.45 -0.33 0.00 0.00 0.00 0.00 61.98 60.47 1kfi s VAL 489 Cb -0.17 -2.13 -0.12 0.00 0.00 0.00 0.00 36.38 33.96 1kfi s VAL 489 CO 0.14 0.06 1.80 -0.67 0.00 0.00 0.00 175.10 176.43 1kfi n ASP 490 N 4.50 3.65 0.29 3.32 -0.08 0.19 -4.87 116.55 123.55 1kfi n ASP 490 Ca -0.15 1.00 0.17 0.00 -1.51 0.00 0.00 54.79 54.30 1kfi n ASP 490 Cb 0.44 -1.47 0.84 0.00 2.34 0.00 0.00 41.12 43.27 1kfi n ASP 490 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1kfi h PRO 491 N 8.23 0.00 0.00 -0.67 0.11 -1.94 0.17 132.00 137.90 1kfi h PRO 491 Ca -0.47 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 65.50 1kfi h PRO 491 Cb 1.25 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.33 1kfi h PRO 491 CO 0.93 0.06 -1.29 0.28 -0.21 0.00 0.00 178.00 177.77 1kfi n VAL 492 N -3.34 1.49 -0.79 3.15 0.31 -1.26 -4.66 118.33 113.23 1kfi n VAL 492 Ca -0.01 0.01 0.08 0.00 -0.01 0.00 0.00 64.34 64.40 1kfi n VAL 492 Cb 0.22 -2.20 0.26 0.00 -0.91 0.00 0.00 33.84 31.20 1kfi n VAL 492 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 1kfi n ASP 493 N -4.44 3.89 0.00 4.52 3.85 -1.25 -4.95 116.55 118.17 1kfi n ASP 493 Ca -0.25 -2.76 0.00 0.00 -0.71 0.00 0.00 54.79 51.07 1kfi n ASP 493 Cb 0.57 -0.49 0.00 0.00 -1.35 0.00 0.00 41.12 39.85 1kfi n ASP 493 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1kfi n GLN 494 N -0.10 -1.30 -1.59 0.11 3.00 0.58 -4.86 117.38 113.23 1kfi n GLN 494 Ca 0.20 0.20 -0.48 0.00 -0.01 0.00 0.00 57.00 56.91 1kfi n GLN 494 Cb 0.82 -3.72 -0.04 0.00 0.00 0.00 0.00 30.24 27.30 1kfi n GLN 494 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 1kfi n SER 495 N 0.35 1.55 -4.68 1.08 2.88 -1.26 -4.13 113.62 109.41 1kfi n SER 495 Ca 0.00 1.14 -0.35 0.00 -1.33 0.00 0.00 58.87 58.33 1kfi n SER 495 Cb 0.20 -1.25 -0.09 0.00 -0.75 0.00 0.00 64.21 62.32 1kfi n SER 495 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 1kfi s VAL 496 N -0.22 4.72 -0.34 2.46 1.01 -1.26 0.56 120.40 127.33 1kfi s VAL 496 Ca 0.72 -0.07 -0.01 0.00 0.00 0.00 0.00 61.98 62.62 1kfi s VAL 496 Cb -0.81 -3.07 0.11 0.00 0.00 0.00 0.00 36.38 32.61 1kfi s VAL 496 CO 0.52 0.53 0.15 -0.55 0.00 0.00 0.00 175.10 175.75 1kfi s SER 497 N -0.25 3.72 0.63 3.32 0.15 0.13 -5.00 113.70 116.41 1kfi s SER 497 Ca 0.08 -1.86 -0.08 0.00 0.70 0.00 0.00 55.95 54.79 1kfi s SER 497 Cb -0.12 -0.74 0.01 0.00 -1.71 0.00 0.00 66.02 63.46 1kfi s SER 497 CO 0.02 -0.37 0.97 -0.54 1.20 0.00 0.00 173.24 174.51 1kfi s LYS 498 N 1.37 2.85 -1.17 5.44 1.02 -1.26 -1.18 119.74 126.81 1kfi s LYS 498 Ca 0.12 0.12 -0.05 0.00 0.02 0.00 0.00 55.97 56.18 1kfi s LYS 498 Cb -0.19 -2.19 -0.02 0.00 -0.52 0.00 0.00 37.83 34.91 1kfi s LYS 498 CO -0.18 -0.84 0.85 0.09 -0.92 0.00 0.00 175.35 174.35 1kfi n ASN 499 N -2.74 -3.85 -2.09 2.83 3.02 -1.20 -4.92 115.26 106.31 1kfi n ASN 499 Ca 0.05 -0.77 -0.11 0.00 -0.03 0.00 0.00 54.58 53.73 1kfi n ASN 499 Cb 0.58 -4.57 0.28 0.00 -0.61 0.00 0.00 39.78 35.46 1kfi n ASN 499 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1kfi n GLN 500 N -3.88 3.41 0.00 3.52 1.13 -0.00 -4.98 117.38 116.57 1kfi n GLN 500 Ca -0.19 -3.08 0.00 0.00 -1.94 0.00 0.00 57.00 51.79 1kfi n GLN 500 Cb 0.64 -2.22 0.00 0.00 0.11 0.00 0.00 30.24 28.77 1kfi n GLN 500 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1kfi n GLY 501 N -0.38 3.46 3.41 1.08 0.00 -1.26 -4.81 105.19 106.68 1kfi n GLY 501 Ca 0.46 -1.89 -0.35 0.00 0.00 0.00 0.00 46.02 44.24 1kfi n GLY 501 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1kfi s VAL 502 N -2.77 3.76 -0.14 1.61 1.01 0.65 -0.48 120.40 124.04 1kfi s VAL 502 Ca 0.00 -0.38 -0.02 0.00 0.00 0.00 0.00 61.98 61.59 1kfi s VAL 502 Cb 0.00 -2.70 -0.02 0.00 0.00 0.00 0.00 36.38 33.66 1kfi s VAL 502 CO 0.00 0.43 -0.09 -0.13 0.00 0.00 0.00 175.10 175.31 1kfi s ARG 503 N 1.12 3.51 -0.51 2.72 0.52 -0.28 -0.57 118.95 125.46 1kfi s ARG 503 Ca 0.02 -0.61 0.03 0.00 -0.52 0.00 0.00 55.73 54.65 1kfi s ARG 503 Cb -0.14 -2.76 0.13 0.00 0.52 0.00 0.00 34.95 32.69 1kfi s ARG 503 CO 0.01 0.22 0.25 -0.06 0.02 0.00 0.00 175.30 175.73 1kfi s PHE 504 N 0.38 3.28 -0.22 -0.53 0.40 0.37 -1.72 117.98 119.93 1kfi s PHE 504 Ca -0.08 -3.11 -0.06 0.00 -0.60 0.00 0.00 56.93 53.09 1kfi s PHE 504 Cb -0.15 -2.87 -0.02 0.00 0.51 0.00 0.00 43.02 40.48 1kfi s PHE 504 CO 0.04 -0.78 0.02 0.54 0.70 0.00 0.00 175.22 175.74 1kfi s VAL 505 N -0.11 4.00 0.70 -0.44 0.11 -0.05 -0.37 120.40 124.24 1kfi s VAL 505 Ca 0.16 -0.29 -0.12 0.00 -2.93 0.00 0.00 61.98 58.80 1kfi s VAL 505 Cb -0.25 -2.84 0.02 0.00 -1.53 0.00 0.00 36.38 31.79 1kfi s VAL 505 CO -0.01 0.39 1.09 -0.36 -3.33 0.00 0.00 175.10 172.87 1kfi s PHE 506 N 1.32 2.75 0.46 1.54 0.40 0.28 -0.90 117.98 123.82 1kfi s PHE 506 Ca 0.04 1.52 0.15 0.00 -0.60 0.00 0.00 56.93 58.04 1kfi s PHE 506 Cb -0.15 -3.04 1.09 0.00 0.51 0.00 0.00 43.02 41.44 1kfi s PHE 506 CO 0.01 -1.57 2.02 0.78 0.70 0.00 0.00 175.22 177.17 1kfi h GLY 507 N -0.54 0.40 1.55 4.36 0.00 -1.88 0.49 103.07 107.45 1kfi h GLY 507 Ca -0.45 -0.12 0.00 0.00 0.00 0.00 0.00 47.33 46.76 1kfi h GLY 507 CO 0.54 0.09 0.00 2.09 0.00 0.00 0.00 176.54 179.26 1kfi n ASP 508 N -4.47 0.00 0.00 0.19 5.68 -1.26 -4.91 116.55 111.79 1kfi n ASP 508 Ca 0.07 -0.13 0.00 0.00 -0.50 0.00 0.00 54.79 54.23 1kfi n ASP 508 Cb 0.31 -0.27 0.00 0.00 -1.14 0.00 0.00 41.12 40.02 1kfi n ASP 508 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1kfi n GLY 509 N 1.01 3.00 3.69 6.12 0.00 0.16 -4.94 105.19 114.24 1kfi n GLY 509 Ca 0.13 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.79 1kfi n GLY 509 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1kfi n SER 510 N 0.00 1.52 -3.90 1.61 7.64 -1.26 -4.68 113.62 114.55 1kfi n SER 510 Ca 0.00 0.78 -0.11 0.00 1.01 0.00 0.00 58.87 60.55 1kfi n SER 510 Cb 0.00 -1.50 -0.11 0.00 -1.01 0.00 0.00 64.21 61.59 1kfi n SER 510 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1kfi s ARG 511 N -3.35 0.38 -0.24 1.43 0.52 -0.22 -0.56 118.95 116.92 1kfi s ARG 511 Ca 0.80 -0.38 0.01 0.00 -0.52 0.00 0.00 55.73 55.63 1kfi s ARG 511 Cb -0.37 0.15 0.06 0.00 0.52 0.00 0.00 34.95 35.31 1kfi s ARG 511 CO 0.44 -0.08 -0.04 0.42 0.02 0.00 0.00 175.30 176.05 1kfi s ILE 512 N -1.20 1.46 0.01 1.52 1.01 0.50 -1.86 121.20 122.64 1kfi s ILE 512 Ca -0.13 -1.21 0.05 0.00 0.00 0.00 0.00 60.65 59.36 1kfi s ILE 512 Cb -0.07 -1.76 -0.03 0.00 0.01 0.00 0.00 42.46 40.61 1kfi s ILE 512 CO 0.01 -0.14 -0.13 -0.63 0.00 0.00 0.00 174.94 174.05 1kfi s ILE 513 N 1.42 3.16 -0.04 2.92 1.01 -0.41 -0.48 121.20 128.78 1kfi s ILE 513 Ca -0.05 -0.93 0.04 0.00 0.00 0.00 0.00 60.65 59.71 1kfi s ILE 513 Cb -0.19 -2.33 0.00 0.00 0.01 0.00 0.00 42.46 39.96 1kfi s ILE 513 CO -0.07 0.42 -0.15 -0.36 0.00 0.00 0.00 174.94 174.78 1kfi s PHE 514 N -0.91 1.57 0.01 3.97 0.08 0.26 -0.56 117.98 122.40 1kfi s PHE 514 Ca 0.15 -0.47 -0.08 0.00 0.12 0.00 0.00 56.93 56.65 1kfi s PHE 514 Cb -0.11 -1.08 0.00 0.00 -0.57 0.00 0.00 43.02 41.27 1kfi s PHE 514 CO 0.05 -0.18 0.16 1.03 -0.10 0.00 0.00 175.22 176.18 1kfi s ARG 515 N 0.16 0.54 -0.20 0.44 0.52 -0.64 -0.25 118.95 119.51 1kfi s ARG 515 Ca -0.06 -0.44 -0.09 0.00 -0.52 0.00 0.00 55.73 54.62 1kfi s ARG 515 Cb -0.12 0.22 -0.05 0.00 0.52 0.00 0.00 34.95 35.53 1kfi s ARG 515 CO 0.02 -0.13 0.11 -0.51 0.02 0.00 0.00 175.30 174.81 1kfi s LEU 516 N -1.54 4.08 0.32 2.53 1.02 -1.26 -1.00 118.68 122.82 1kfi s LEU 516 Ca -0.13 0.17 -0.29 0.00 0.02 0.00 0.00 54.13 53.90 1kfi s LEU 516 Cb -0.06 -2.05 -0.11 0.00 0.02 0.00 0.00 46.19 43.99 1kfi s LEU 516 CO 0.01 0.16 1.44 -0.55 0.02 0.00 0.00 176.35 177.43 1kfi s SER 517 N 0.48 6.55 -0.30 2.29 0.15 0.10 -4.90 113.70 118.06 1kfi s SER 517 Ca 0.07 2.84 0.09 0.00 0.70 0.00 0.00 55.95 59.65 1kfi s SER 517 Cb -0.12 -2.65 0.55 0.00 -1.71 0.00 0.00 66.02 62.10 1kfi s SER 517 CO -0.00 -0.74 1.55 0.61 1.20 0.00 0.00 173.24 175.85 1kfi n GLY 518 N 1.25 4.64 2.73 9.45 0.00 -1.26 -4.47 105.19 117.51 1kfi n GLY 518 Ca 0.03 -1.16 -0.05 0.00 0.00 0.00 0.00 46.02 44.84 1kfi n GLY 518 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1kfi n THR 519 N -0.98 0.78 -3.24 2.61 -1.04 -1.26 0.14 114.28 111.30 1kfi n THR 519 Ca 0.36 -2.47 0.00 0.00 -2.04 0.00 0.00 64.05 59.90 1kfi n THR 519 Cb 1.13 0.98 0.00 0.00 -1.82 0.00 0.00 70.33 70.62 1kfi n THR 519 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1kfi n GLY 520 N -0.53 3.81 3.56 3.41 0.00 -1.26 -5.06 105.19 109.12 1kfi n GLY 520 Ca 0.03 -2.13 -0.13 0.00 0.00 0.00 0.00 46.02 43.79 1kfi n GLY 520 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1kfi s SER 521 N -0.66 -0.71 0.00 1.61 0.15 -1.26 -4.98 113.70 107.85 1kfi s SER 521 Ca 0.00 1.33 0.00 0.00 0.70 0.00 0.00 55.95 57.98 1kfi s SER 521 Cb 0.00 1.32 0.00 0.00 -1.71 0.00 0.00 66.02 65.63 1kfi s SER 521 CO 0.00 -0.23 0.00 0.52 1.20 0.00 0.00 173.24 174.73 1kfi n VAL 522 N 3.05 0.00 -4.02 4.45 0.31 -1.26 -4.78 118.33 116.08 1kfi n VAL 522 Ca -0.15 0.00 -0.01 0.00 -0.01 0.00 0.00 64.34 64.17 1kfi n VAL 522 Cb 0.56 0.00 -0.00 0.00 -0.91 0.00 0.00 33.84 33.49 1kfi n VAL 522 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1kfi n GLY 523 N 0.00 4.14 3.92 2.92 0.00 -1.26 -4.94 105.19 109.97 1kfi n GLY 523 Ca 0.00 -2.09 -0.20 0.00 0.00 0.00 0.00 46.02 43.72 1kfi n GLY 523 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1kfi s ALA 524 N -2.02 3.98 -0.06 4.61 0.00 -0.67 -4.83 121.76 122.76 1kfi s ALA 524 Ca 0.00 -1.48 -0.01 0.00 0.00 0.00 0.00 51.96 50.47 1kfi s ALA 524 Cb 0.00 -1.47 0.03 0.00 0.00 0.00 0.00 23.12 21.68 1kfi s ALA 524 CO 0.00 0.06 0.01 0.99 0.00 0.00 0.00 175.76 176.82 1kfi s THR 525 N -2.18 0.30 -0.18 0.00 2.01 -1.26 0.56 115.64 114.88 1kfi s THR 525 Ca 0.40 0.15 -0.10 0.00 0.31 0.00 0.00 61.69 62.46 1kfi s THR 525 Cb -0.08 -0.46 -0.05 0.00 0.01 0.00 0.00 72.50 71.93 1kfi s THR 525 CO 0.28 0.24 0.15 -0.63 -0.69 0.00 0.00 174.62 173.97 1kfi s ILE 526 N 1.87 5.41 -0.11 1.82 1.01 -0.42 0.00 121.20 130.79 1kfi s ILE 526 Ca 0.03 0.24 0.02 0.00 0.00 0.00 0.00 60.65 60.94 1kfi s ILE 526 Cb -0.12 -3.48 0.01 0.00 0.01 0.00 0.00 42.46 38.88 1kfi s ILE 526 CO -0.04 0.46 -0.18 -0.13 0.00 0.00 0.00 174.94 175.05 1kfi s ARG 527 N 0.16 2.49 -0.11 2.79 0.52 -0.17 -0.21 118.95 124.41 1kfi s ARG 527 Ca 0.10 -0.67 -0.00 0.00 -0.52 0.00 0.00 55.73 54.64 1kfi s ARG 527 Cb -0.11 -2.02 -0.02 0.00 0.52 0.00 0.00 34.95 33.31 1kfi s ARG 527 CO -0.00 0.01 -0.10 0.42 0.02 0.00 0.00 175.30 175.65 1kfi s ILE 528 N 0.76 3.40 -0.13 1.52 1.01 0.45 -1.62 121.20 126.59 1kfi s ILE 528 Ca -0.11 -0.56 -0.01 0.00 0.00 0.00 0.00 60.65 59.97 1kfi s ILE 528 Cb -0.16 -2.42 -0.02 0.00 0.01 0.00 0.00 42.46 39.87 1kfi s ILE 528 CO 0.01 0.54 -0.09 -0.31 0.00 0.00 0.00 174.94 175.09 1kfi s TYR 529 N -0.04 2.90 -0.09 3.97 2.02 0.27 -0.40 117.35 125.98 1kfi s TYR 529 Ca -0.01 -0.43 0.04 0.00 -0.37 0.00 0.00 57.07 56.30 1kfi s TYR 529 Cb -0.14 -1.86 -0.00 0.00 -0.40 0.00 0.00 41.96 39.56 1kfi s TYR 529 CO 0.03 -0.07 -0.24 -0.06 -1.57 0.00 0.00 175.55 173.64 1kfi s PHE 530 N 0.19 2.53 -0.09 2.71 0.08 0.62 -1.29 117.98 122.74 1kfi s PHE 530 Ca -0.05 -1.00 -0.05 0.00 0.12 0.00 0.00 56.93 55.95 1kfi s PHE 530 Cb -0.15 -1.69 0.04 0.00 -0.57 0.00 0.00 43.02 40.66 1kfi s PHE 530 CO 0.04 -0.39 0.21 -2.00 -0.10 0.00 0.00 175.22 172.99 1kfi s GLU 531 N 0.27 0.19 -0.10 0.44 2.12 -0.78 -0.54 118.70 120.29 1kfi s GLU 531 Ca -0.17 0.44 -0.03 0.00 0.36 0.00 0.00 54.97 55.58 1kfi s GLU 531 Cb -0.17 -0.09 0.04 0.00 0.26 0.00 0.00 34.13 34.17 1kfi s GLU 531 CO 0.08 -0.14 0.05 -1.14 -0.54 0.00 0.00 175.26 173.58 1kfi s GLN 532 N 1.01 0.17 0.17 4.30 2.00 -0.61 -1.06 119.66 125.64 1kfi s GLN 532 Ca -0.07 0.11 -0.19 0.00 -2.00 0.00 0.00 55.36 53.21 1kfi s GLN 532 Cb -0.09 -1.15 -0.08 0.00 0.80 0.00 0.00 33.01 32.50 1kfi s GLN 532 CO -0.06 -0.46 0.65 0.12 -0.50 0.00 0.00 175.29 175.04 1kfi s PHE 533 N 2.09 3.69 -0.05 1.67 5.36 -1.26 -1.69 117.98 127.79 1kfi s PHE 533 Ca 0.04 1.30 0.00 0.00 -0.96 0.00 0.00 56.93 57.31 1kfi s PHE 533 Cb -0.14 -2.54 0.02 0.00 -0.34 0.00 0.00 43.02 40.03 1kfi s PHE 533 CO -0.06 0.43 -0.02 -1.21 -1.46 0.00 0.00 175.22 172.90 1kfi s GLU 534 N -1.73 0.60 0.02 10.12 0.41 -0.30 -4.98 118.70 122.84 1kfi s GLU 534 Ca 0.38 0.01 -0.05 0.00 -0.41 0.00 0.00 54.97 54.90 1kfi s GLU 534 Cb -0.17 -0.75 -0.29 0.00 -1.78 0.00 0.00 34.13 31.14 1kfi s GLU 534 CO 0.21 -0.15 0.93 0.37 -0.49 0.00 0.00 175.26 176.13 1kfi h GLN 535 N 7.47 0.28 0.00 1.61 5.75 -1.93 -0.38 115.11 127.92 1kfi h GLN 535 Ca -0.35 -0.48 -0.21 0.00 -0.15 0.00 0.00 58.65 57.45 1kfi h GLN 535 Cb 1.14 0.18 -0.03 0.00 1.07 0.00 0.00 27.48 29.84 1kfi h GLN 535 CO 0.42 1.17 -1.72 1.04 -2.65 0.00 0.00 178.83 177.10 1kfi n GLN 536 N -3.50 0.28 -1.69 1.69 3.00 -1.26 -4.52 117.38 111.38 1kfi n GLN 536 Ca -0.15 0.11 -0.37 0.00 -0.01 0.00 0.00 57.00 56.58 1kfi n GLN 536 Cb 1.04 -1.01 -0.05 0.00 0.00 0.00 0.00 30.24 30.22 1kfi n GLN 536 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.06 178.10 1kfi n GLN 537 N -3.45 1.82 -0.91 -1.09 6.02 -1.26 -4.69 117.38 113.82 1kfi n GLN 537 Ca -0.25 -2.29 -0.07 0.00 -0.01 0.00 0.00 57.00 54.39 1kfi n GLN 537 Cb 0.69 -3.31 0.26 0.00 1.02 0.00 0.00 30.24 28.89 1kfi n GLN 537 CO 0.00 0.00 0.00 0.44 -1.01 0.00 0.00 177.06 176.49 1kfi n ILE 538 N 6.65 2.64 -1.62 5.09 -5.35 -1.26 -4.33 119.36 121.19 1kfi n ILE 538 Ca 0.48 -1.42 0.05 0.00 -0.27 0.00 0.00 62.75 61.58 1kfi n ILE 538 Cb 0.43 -0.43 0.07 0.00 -1.74 0.00 0.00 39.64 37.98 1kfi n ILE 538 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1kfi n GLN 539 N -0.17 0.62 -2.07 6.28 6.02 -1.26 -5.00 117.38 121.80 1kfi n GLN 539 Ca 0.37 -1.84 -0.29 0.00 -0.01 0.00 0.00 57.00 55.23 1kfi n GLN 539 Cb 1.29 -0.95 0.03 0.00 1.02 0.00 0.00 30.24 31.63 1kfi n GLN 539 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 177.06 175.04 1kfi s HIS 540 N -1.38 3.36 -0.14 1.08 3.76 -1.26 -5.02 115.29 115.70 1kfi s HIS 540 Ca 0.17 0.96 -0.23 0.00 -0.15 0.00 0.00 55.06 55.81 1kfi s HIS 540 Cb 0.16 -2.89 -0.03 0.00 1.11 0.00 0.00 32.58 30.93 1kfi s HIS 540 CO -0.00 -0.97 0.72 -2.00 -0.85 0.00 0.00 174.74 171.65 1kfi s GLU 541 N -5.20 4.33 0.26 1.40 2.12 -1.26 -4.95 118.70 115.40 1kfi s GLU 541 Ca 0.56 0.85 -0.03 0.00 0.36 0.00 0.00 54.97 56.72 1kfi s GLU 541 Cb -0.11 -3.52 0.54 0.00 0.26 0.00 0.00 34.13 31.30 1kfi s GLU 541 CO 0.50 -0.14 1.69 1.79 -0.54 0.00 0.00 175.26 178.55 1kfi h THR 542 N 5.01 0.50 -0.88 -1.70 1.35 -1.96 0.23 112.91 115.46 1kfi h THR 542 Ca -0.35 -0.10 0.10 0.00 -0.55 0.00 0.00 66.41 65.51 1kfi h THR 542 Cb 1.16 0.16 -0.08 0.00 -1.73 0.00 0.00 68.15 67.67 1kfi h THR 542 CO 0.79 0.06 0.52 0.00 -0.25 0.00 0.00 175.52 176.63 1kfi h ALA 543 N 1.64 1.28 -0.42 6.62 0.00 -1.95 0.35 119.26 126.78 1kfi h ALA 543 Ca 0.46 0.03 -0.08 0.00 0.00 0.00 0.00 54.91 55.32 1kfi h ALA 543 Cb 0.81 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 1kfi h ALA 543 CO -0.52 0.13 -0.04 1.15 0.00 0.00 0.00 179.25 179.96 1kfi h THR 544 N 0.84 1.27 0.00 0.00 2.02 -1.37 -2.16 112.91 113.50 1kfi h THR 544 Ca 0.43 -1.10 -0.06 0.00 0.77 0.00 0.00 66.41 66.45 1kfi h THR 544 Cb 0.41 1.13 -0.01 0.00 -1.74 0.00 0.00 68.15 67.95 1kfi h THR 544 CO -0.26 0.37 -0.28 0.00 0.37 0.00 0.00 175.52 175.72 1kfi h ALA 545 N 0.88 1.04 -0.02 6.16 0.00 -0.67 -3.11 119.26 123.54 1kfi h ALA 545 Ca 0.11 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1kfi h ALA 545 Cb 0.54 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1kfi h ALA 545 CO 0.03 0.35 -0.35 1.28 0.00 0.00 0.00 179.25 180.56 1kfi n LEU 546 N -3.49 1.95 -0.27 0.00 4.77 0.03 -4.62 117.00 115.37 1kfi n LEU 546 Ca -0.00 -0.69 0.00 0.00 -0.03 0.00 0.00 56.01 55.29 1kfi n LEU 546 Cb 0.44 -0.02 0.07 0.00 -2.33 0.00 0.00 43.42 41.58 1kfi n LEU 546 CO 0.35 0.35 0.67 0.00 -1.33 0.00 0.00 177.39 177.43 1kfi h ALA 547 N 3.99 0.36 -0.11 -1.18 0.00 -1.32 0.94 119.26 121.94 1kfi h ALA 547 Ca 0.00 0.27 -0.02 0.00 0.00 0.00 0.00 54.91 55.17 1kfi h ALA 547 Cb 0.73 0.70 -0.00 0.00 0.00 0.00 0.00 17.79 19.21 1kfi h ALA 547 CO 0.00 -0.49 0.00 -0.91 0.00 0.00 0.00 179.25 177.85 1kfi h ASN 548 N -0.04 0.19 -0.27 0.00 4.21 -1.84 -0.92 115.58 116.91 1kfi h ASN 548 Ca 0.35 -0.31 -0.04 0.00 1.21 0.00 0.00 56.30 57.51 1kfi h ASN 548 Cb 0.58 -0.05 -0.02 0.00 -1.12 0.00 0.00 38.32 37.71 1kfi h ASN 548 CO -0.81 0.45 0.06 -0.29 -1.29 0.00 0.00 177.43 175.55 1kfi h ILE 549 N -0.08 1.18 -0.27 2.81 2.10 -1.73 -1.75 117.51 119.76 1kfi h ILE 549 Ca 0.03 -0.65 -0.11 0.00 1.08 0.00 0.00 64.86 65.21 1kfi h ILE 549 Cb 0.35 0.84 -0.00 0.00 -1.09 0.00 0.00 36.82 36.92 1kfi h ILE 549 CO 0.01 0.23 -0.26 0.40 -1.08 0.00 0.00 178.15 177.44 1kfi h ILE 550 N 0.52 1.31 -0.22 2.19 2.04 -0.72 -1.78 117.51 120.86 1kfi h ILE 550 Ca 0.12 -1.43 0.03 0.00 1.00 0.00 0.00 64.86 64.59 1kfi h ILE 550 Cb 0.24 1.61 -0.03 0.00 -0.74 0.00 0.00 36.82 37.89 1kfi h ILE 550 CO -0.00 0.45 0.01 0.50 0.00 0.00 0.00 178.15 179.11 1kfi h LYS 551 N 0.39 0.07 -0.60 2.37 3.64 -0.76 -1.45 116.57 120.24 1kfi h LYS 551 Ca 0.04 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.41 1kfi h LYS 551 Cb 0.83 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.60 1kfi h LYS 551 CO 0.07 0.05 0.33 1.25 -2.27 0.00 0.00 179.45 178.87 1kfi h LEU 552 N 0.08 0.75 -1.05 5.20 5.85 -1.29 -1.74 115.31 123.11 1kfi h LEU 552 Ca 0.10 -0.09 0.02 0.00 0.84 0.00 0.00 57.88 58.75 1kfi h LEU 552 Cb 0.12 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 40.91 1kfi h LEU 552 CO -0.17 0.62 0.64 1.23 -0.34 0.00 0.00 178.44 180.43 1kfi h GLY 553 N 0.81 1.38 2.00 3.75 0.00 -0.93 -0.85 103.07 109.22 1kfi h GLY 553 Ca 0.21 -0.50 -0.04 0.00 0.00 0.00 0.00 47.33 47.00 1kfi h GLY 553 CO -0.03 0.47 -0.19 1.41 0.00 0.00 0.00 176.54 178.19 1kfi h LEU 554 N 1.28 0.00 0.17 3.11 3.38 -0.97 -2.48 115.31 119.79 1kfi h LEU 554 Ca 0.37 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.33 1kfi h LEU 554 Cb -0.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.66 1kfi h LEU 554 CO -0.09 0.19 -0.08 -0.33 0.09 0.00 0.00 178.44 178.22 1kfi h GLU 555 N 0.00 -0.21 0.00 1.13 5.08 -0.29 -2.20 114.58 118.08 1kfi h GLU 555 Ca -0.00 0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.36 1kfi h GLU 555 Cb 0.79 0.05 -0.00 0.00 0.50 0.00 0.00 28.75 30.08 1kfi h GLU 555 CO 0.03 -0.14 -0.04 -0.84 -1.00 0.00 0.00 179.01 177.01 1kfi h ILE 556 N -0.66 0.84 0.02 3.13 3.07 -1.34 -2.08 117.51 120.48 1kfi h ILE 556 Ca -0.02 -0.16 -0.24 0.00 1.55 0.00 0.00 64.86 65.98 1kfi h ILE 556 Cb 0.17 1.09 -0.03 0.00 -0.27 0.00 0.00 36.82 37.78 1kfi h ILE 556 CO 0.04 0.04 -1.24 0.77 -1.05 0.00 0.00 178.15 176.71 1kfi h SER 557 N 0.00 0.05 -6.78 2.16 4.64 -1.57 -3.44 113.55 108.61 1kfi h SER 557 Ca -0.00 -0.07 -0.56 0.00 -0.47 0.00 0.00 61.79 60.70 1kfi h SER 557 Cb 0.09 -0.02 -0.17 0.00 -0.31 0.00 0.00 62.40 61.99 1kfi h SER 557 CO 0.01 1.05 -0.89 -0.67 -0.87 0.00 0.00 176.83 175.46 1kfi n ASP 558 N -3.29 -1.03 0.26 4.97 2.03 -0.78 -4.80 116.55 113.91 1kfi n ASP 558 Ca -0.06 -1.10 0.10 0.00 0.52 0.00 0.00 54.79 54.25 1kfi n ASP 558 Cb 0.98 -2.47 0.72 0.00 -0.72 0.00 0.00 41.12 39.63 1kfi n ASP 558 CO 0.00 0.00 0.00 -0.29 -1.92 0.00 0.00 177.20 174.99 1kfi h ILE 559 N -1.63 0.86 -0.15 5.18 2.10 -1.88 -2.71 117.51 119.29 1kfi h ILE 559 Ca -0.62 0.00 -0.08 0.00 1.08 0.00 0.00 64.86 65.24 1kfi h ILE 559 Cb 1.38 0.99 -0.01 0.00 -1.09 0.00 0.00 36.82 38.10 1kfi h ILE 559 CO 0.72 0.00 -0.26 0.00 -1.08 0.00 0.00 178.15 177.53 1kfi h ALA 560 N 1.99 1.28 0.00 0.18 0.00 -1.88 -1.22 119.26 119.62 1kfi h ALA 560 Ca 0.01 -0.31 -0.08 0.00 0.00 0.00 0.00 54.91 54.52 1kfi h ALA 560 Cb 0.02 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1kfi h ALA 560 CO -0.00 0.48 -0.48 1.96 0.00 0.00 0.00 179.25 181.21 1kfi h GLN 561 N 0.24 0.00 0.06 0.00 4.20 -1.79 0.74 115.11 118.57 1kfi h GLN 561 Ca 0.04 0.00 -0.31 0.00 0.06 0.00 0.00 58.65 58.44 1kfi h GLN 561 Cb 0.60 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.35 1kfi h GLN 561 CO 0.04 0.37 -1.73 0.74 -0.67 0.00 0.00 178.83 177.58 1kfi h PHE 562 N 0.00 0.23 0.00 2.96 0.04 -1.54 -3.39 116.94 115.25 1kfi h PHE 562 Ca -0.02 -0.17 -0.10 0.00 2.80 0.00 0.00 57.97 60.48 1kfi h PHE 562 Cb 1.31 -0.01 -0.02 0.00 2.20 0.00 0.00 35.95 39.43 1kfi h PHE 562 CO 0.00 1.31 -1.98 0.25 -0.60 0.00 0.00 178.31 177.29 1kfi n THR 563 N -3.27 0.38 -0.87 -1.55 -2.24 -0.48 -4.53 114.28 101.73 1kfi n THR 563 Ca -0.20 -0.54 0.00 0.00 -2.27 0.00 0.00 64.05 61.04 1kfi n THR 563 Cb 1.04 -0.12 0.00 0.00 -2.10 0.00 0.00 70.33 69.15 1kfi n THR 563 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1kfi n GLY 564 N 1.57 0.53 3.49 3.38 0.00 0.25 -4.68 105.19 109.74 1kfi n GLY 564 Ca -0.12 -0.30 -0.36 0.00 0.00 0.00 0.00 46.02 45.24 1kfi n GLY 564 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1kfi s ARG 565 N -0.64 3.74 0.00 1.61 1.81 -1.23 -4.96 118.95 119.28 1kfi s ARG 565 Ca 0.00 -0.44 0.28 0.00 -1.72 0.00 0.00 55.73 53.85 1kfi s ARG 565 Cb 0.00 -3.35 1.13 0.00 -0.45 0.00 0.00 34.95 32.28 1kfi s ARG 565 CO 0.00 -0.12 1.83 0.09 -0.68 0.00 0.00 175.30 176.41 1kfi n ASN 566 N 4.75 0.22 -3.78 0.23 5.03 -1.26 -3.96 115.26 116.49 1kfi n ASN 566 Ca -0.16 -0.03 -0.10 0.00 0.87 0.00 0.00 54.58 55.17 1kfi n ASN 566 Cb 0.52 -0.21 -0.06 0.00 -1.02 0.00 0.00 39.78 39.01 1kfi n ASN 566 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 1kfi s GLU 567 N -2.80 1.02 0.65 3.52 0.41 -1.26 -5.04 118.70 115.21 1kfi s GLU 567 Ca 0.20 -0.89 -0.11 0.00 -0.41 0.00 0.00 54.97 53.75 1kfi s GLU 567 Cb 0.19 0.41 -0.02 0.00 -1.78 0.00 0.00 34.13 32.93 1kfi s GLU 567 CO 0.54 -0.38 1.05 -1.25 -0.49 0.00 0.00 175.26 174.73 1kfi s PRO 568 N -3.86 3.31 -0.01 0.39 0.04 -1.26 -4.97 135.00 128.65 1kfi s PRO 568 Ca 0.06 0.78 -0.24 0.00 0.04 0.00 0.00 61.00 61.64 1kfi s PRO 568 Cb 0.03 -2.05 -0.19 0.00 0.04 0.00 0.00 34.50 32.34 1kfi s PRO 568 CO -0.09 -0.79 1.27 1.15 0.04 0.00 0.00 177.00 178.59 1kfi h THR 569 N -0.48 1.39 -4.13 1.26 2.02 0.48 -3.45 112.91 109.99 1kfi h THR 569 Ca -0.44 -1.24 -0.44 0.00 0.77 0.00 0.00 66.41 65.06 1kfi h THR 569 Cb 1.20 2.13 -0.29 0.00 -1.74 0.00 0.00 68.15 69.45 1kfi h THR 569 CO 0.61 0.34 -0.80 -0.69 0.37 0.00 0.00 175.52 175.34 1kfi s VAL 570 N -4.19 0.93 -0.12 3.16 1.01 -0.78 -4.99 120.40 115.42 1kfi s VAL 570 Ca -0.15 -0.50 0.02 0.00 0.00 0.00 0.00 61.98 61.35 1kfi s VAL 570 Cb 0.03 -0.77 0.01 0.00 0.00 0.00 0.00 36.38 35.64 1kfi s VAL 570 CO 0.70 0.26 -0.18 -0.63 0.00 0.00 0.00 175.10 175.25 1kfi s ILE 571 N -0.28 1.71 0.00 2.22 1.01 -1.26 -1.12 121.20 123.49 1kfi s ILE 571 Ca 0.05 -0.78 0.00 0.00 0.00 0.00 0.00 60.65 59.92 1kfi s ILE 571 Cb -0.05 -1.54 0.00 0.00 0.01 0.00 0.00 42.46 40.89 1kfi s ILE 571 CO -0.00 0.48 0.16 0.35 0.00 0.00 0.00 174.94 175.92