#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k6i n GLN 4 N 0.00 -1.92 -1.84 -1.09 1.13 -1.26 -4.92 117.38 107.47 1k6i n GLN 4 Ca 0.00 1.75 -0.42 0.00 -1.94 0.00 0.00 57.00 56.40 1k6i n GLN 4 Cb 0.00 -3.12 -0.02 0.00 0.11 0.00 0.00 30.24 27.21 1k6i n GLN 4 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 1k6i s LYS 5 N -0.82 4.17 0.54 -1.09 -0.14 -1.26 -4.97 119.74 116.17 1k6i s LYS 5 Ca -0.05 2.50 -0.17 0.00 -1.36 0.00 0.00 55.97 56.89 1k6i s LYS 5 Cb 0.00 -3.06 -0.07 0.00 -1.68 0.00 0.00 37.83 33.03 1k6i s LYS 5 CO 0.39 -0.59 1.01 0.15 -0.76 0.00 0.00 175.35 175.55 1k6i s LYS 6 N -0.12 3.74 0.10 1.68 1.02 -1.26 -4.64 119.74 120.26 1k6i s LYS 6 Ca 0.64 1.08 -0.30 0.00 0.02 0.00 0.00 55.97 57.41 1k6i s LYS 6 Cb -0.46 -2.10 -0.06 0.00 -0.52 0.00 0.00 37.83 34.69 1k6i s LYS 6 CO 0.43 -0.45 0.99 0.99 -0.92 0.00 0.00 175.35 176.39 1k6i s THR 7 N -2.50 4.46 -0.14 2.17 2.01 -1.26 -4.18 115.64 116.20 1k6i s THR 7 Ca 0.61 2.00 -0.02 0.00 0.31 0.00 0.00 61.69 64.59 1k6i s THR 7 Cb -0.12 -4.28 -0.02 0.00 0.01 0.00 0.00 72.50 68.08 1k6i s THR 7 CO 0.31 0.29 -0.07 -0.63 -0.69 0.00 0.00 174.62 173.83 1k6i s ILE 8 N 0.12 3.59 -0.13 1.82 1.01 -0.53 -1.18 121.20 125.90 1k6i s ILE 8 Ca 0.48 -0.47 -0.09 0.00 0.00 0.00 0.00 60.65 60.57 1k6i s ILE 8 Cb -0.24 -2.55 -0.04 0.00 0.01 0.00 0.00 42.46 39.64 1k6i s ILE 8 CO 0.30 0.51 0.17 0.00 0.00 0.00 0.00 174.94 175.92 1k6i s ALA 9 N 0.28 3.80 0.03 9.38 0.00 0.44 -1.04 121.76 134.66 1k6i s ALA 9 Ca -0.06 -0.61 -0.04 0.00 0.00 0.00 0.00 51.96 51.26 1k6i s ALA 9 Cb -0.15 -2.08 -0.02 0.00 0.00 0.00 0.00 23.12 20.88 1k6i s ALA 9 CO 0.04 0.46 0.05 0.08 0.00 0.00 0.00 175.76 176.39 1k6i s VAL 10 N -0.58 0.13 0.45 0.00 1.01 -0.06 -1.61 120.40 119.74 1k6i s VAL 10 Ca 0.14 -1.07 0.05 0.00 0.00 0.00 0.00 61.98 61.09 1k6i s VAL 10 Cb -0.12 -0.73 -0.06 0.00 0.00 0.00 0.00 36.38 35.47 1k6i s VAL 10 CO 0.03 -0.59 0.01 0.68 0.00 0.00 0.00 175.10 175.23 1k6i s VAL 11 N -2.28 1.71 -1.52 2.92 -7.23 -1.25 -0.83 120.40 111.91 1k6i s VAL 11 Ca -0.08 -1.99 -0.07 0.00 -1.81 0.00 0.00 61.98 58.03 1k6i s VAL 11 Cb -0.03 -2.70 0.06 0.00 0.56 0.00 0.00 36.38 34.26 1k6i s VAL 11 CO -0.03 0.00 0.55 -3.20 -0.31 0.00 0.00 175.10 172.11 1k6i n ASN 12 N -1.08 -1.50 -0.33 4.85 4.05 -1.11 -4.70 115.26 115.44 1k6i n ASN 12 Ca -0.10 -1.01 0.30 0.00 0.45 0.00 0.00 54.58 54.22 1k6i n ASN 12 Cb 0.67 -2.93 0.64 0.00 1.23 0.00 0.00 39.78 39.39 1k6i n ASN 12 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1k6i h ALA 13 N 0.87 2.71 -0.00 5.20 0.00 -1.54 0.84 119.26 127.34 1k6i h ALA 13 Ca -0.62 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.31 1k6i h ALA 13 Cb 1.38 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.24 1k6i h ALA 13 CO 0.68 -1.10 -0.13 0.25 0.00 0.00 0.00 179.25 178.95 1k6i n THR 14 N -4.41 0.00 -1.50 0.00 -2.24 -1.26 -2.38 114.28 102.49 1k6i n THR 14 Ca 0.26 -0.06 -0.32 0.00 -2.27 0.00 0.00 64.05 61.67 1k6i n THR 14 Cb 1.10 -0.07 0.07 0.00 -2.10 0.00 0.00 70.33 69.32 1k6i n THR 14 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1k6i s GLY 15 N -2.54 1.89 0.19 3.38 0.00 0.29 -4.76 107.32 105.77 1k6i s GLY 15 Ca 0.27 0.38 -0.12 0.00 0.00 0.00 0.00 44.72 45.24 1k6i s GLY 15 CO 0.49 0.73 1.71 3.21 0.00 0.00 0.00 173.10 179.24 1k6i h ARG 16 N -0.58 0.23 -0.02 2.90 3.08 -1.89 -0.05 114.38 118.04 1k6i h ARG 16 Ca -0.45 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 59.58 1k6i h ARG 16 Cb 1.24 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 31.23 1k6i h ARG 16 CO 0.53 0.15 0.01 1.96 -1.07 0.00 0.00 179.97 181.55 1k6i h GLN 17 N 0.24 0.04 -0.14 0.04 4.20 -1.92 -2.43 115.11 115.13 1k6i h GLN 17 Ca 0.26 -0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.95 1k6i h GLN 17 Cb 0.36 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.12 1k6i h GLN 17 CO -0.34 0.23 0.04 0.00 -0.67 0.00 0.00 178.83 178.09 1k6i h ALA 18 N 0.81 0.19 -0.88 3.87 0.00 -1.78 -2.52 119.26 118.95 1k6i h ALA 18 Ca 0.01 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 54.80 1k6i h ALA 18 Cb 0.21 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.90 1k6i h ALA 18 CO -0.00 -0.18 0.58 0.00 0.00 0.00 0.00 179.25 179.65 1k6i h ALA 19 N 0.85 1.40 -0.18 0.00 0.00 -0.62 0.12 119.26 120.84 1k6i h ALA 19 Ca 0.05 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1k6i h ALA 19 Cb 0.24 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1k6i h ALA 19 CO -0.00 0.54 0.07 1.03 0.00 0.00 0.00 179.25 180.88 1k6i h SER 20 N 1.15 0.25 -0.31 0.00 0.87 -1.34 -2.10 113.55 112.07 1k6i h SER 20 Ca 0.33 -0.18 -0.01 0.00 -1.23 0.00 0.00 61.79 60.71 1k6i h SER 20 Cb -0.07 -0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 61.81 1k6i h SER 20 CO -0.08 0.36 0.15 0.25 -0.53 0.00 0.00 176.83 176.98 1k6i h LEU 21 N 0.12 0.40 -0.27 2.23 5.85 -1.00 -3.03 115.31 119.61 1k6i h LEU 21 Ca 0.06 -0.11 0.05 0.00 0.84 0.00 0.00 57.88 58.72 1k6i h LEU 21 Cb 0.19 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 41.07 1k6i h LEU 21 CO -0.00 0.40 -0.07 0.40 -0.34 0.00 0.00 178.44 178.82 1k6i h ILE 22 N 0.37 0.72 0.13 4.05 2.04 -0.84 0.38 117.51 124.35 1k6i h ILE 22 Ca 0.11 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.98 1k6i h ILE 22 Cb 0.10 0.72 -0.03 0.00 -0.74 0.00 0.00 36.82 36.87 1k6i h ILE 22 CO -0.01 0.00 -0.22 0.03 0.00 0.00 0.00 178.15 177.94 1k6i h ARG 23 N -0.01 -0.41 -0.36 2.37 3.08 -1.35 -0.90 114.38 116.80 1k6i h ARG 23 Ca 0.13 0.03 -0.16 0.00 0.07 0.00 0.00 59.98 60.05 1k6i h ARG 23 Cb 0.21 0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.34 1k6i h ARG 23 CO -0.28 -0.27 -0.41 -0.39 -1.07 0.00 0.00 179.97 177.54 1k6i h VAL 24 N -0.42 1.27 -0.34 2.04 -1.51 -1.41 -2.30 116.25 113.58 1k6i h VAL 24 Ca 0.02 -1.59 0.01 0.00 -1.23 0.00 0.00 66.70 63.92 1k6i h VAL 24 Cb 0.44 1.43 -0.02 0.00 -2.13 0.00 0.00 31.29 31.01 1k6i h VAL 24 CO -0.12 0.53 0.20 0.00 -1.23 0.00 0.00 177.57 176.95 1k6i h ALA 25 N 0.80 0.43 -0.70 5.19 0.00 -0.83 -2.10 119.26 122.05 1k6i h ALA 25 Ca 0.05 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 1k6i h ALA 25 Cb 1.00 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.66 1k6i h ALA 25 CO 0.10 -0.15 0.16 0.00 0.00 0.00 0.00 179.25 179.36 1k6i h ALA 26 N 1.15 0.92 0.00 0.00 0.00 -1.15 0.15 119.26 120.33 1k6i h ALA 26 Ca 0.13 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 1k6i h ALA 26 Cb -0.00 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.52 1k6i h ALA 26 CO -0.06 0.65 -0.08 0.00 0.00 0.00 0.00 179.25 179.76 1k6i h ALA 27 N 1.08 1.72 -0.47 0.00 0.00 -0.98 -1.91 119.26 118.69 1k6i h ALA 27 Ca 0.22 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1k6i h ALA 27 Cb 0.39 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1k6i h ALA 27 CO 0.00 0.10 0.00 1.33 0.00 0.00 0.00 179.25 180.69 1k6i n VAL 28 N -4.23 0.62 0.00 0.00 0.24 -0.83 -4.94 118.33 109.19 1k6i n VAL 28 Ca -0.03 -0.71 0.00 0.00 -2.04 0.00 0.00 64.34 61.56 1k6i n VAL 28 Cb 0.16 0.56 0.00 0.00 -1.47 0.00 0.00 33.84 33.09 1k6i n VAL 28 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1k6i n GLY 29 N 1.41 0.73 3.77 7.63 0.00 -0.72 -4.93 105.19 113.08 1k6i n GLY 29 Ca 0.19 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.83 1k6i n GLY 29 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1k6i s HIS 30 N -2.00 3.69 0.08 1.61 4.02 0.01 -4.59 115.29 118.12 1k6i s HIS 30 Ca 0.00 1.79 -0.15 0.00 1.02 0.00 0.00 55.06 57.72 1k6i s HIS 30 Cb 0.00 -3.00 -0.06 0.00 -1.02 0.00 0.00 32.58 28.49 1k6i s HIS 30 CO 0.00 0.07 0.50 -1.01 1.02 0.00 0.00 174.74 175.32 1k6i s HIS 31 N -1.48 3.68 -0.04 1.40 0.09 -1.26 -4.08 115.29 113.60 1k6i s HIS 31 Ca 0.49 1.06 0.04 0.00 -0.00 0.00 0.00 55.06 56.65 1k6i s HIS 31 Cb -0.22 -2.35 -0.00 0.00 -0.00 0.00 0.00 32.58 30.00 1k6i s HIS 31 CO 0.28 0.53 -0.17 0.08 -0.00 0.00 0.00 174.74 175.46 1k6i s VAL 32 N -1.28 1.39 -0.28 -0.90 1.01 0.59 -1.45 120.40 119.48 1k6i s VAL 32 Ca 0.32 -0.70 -0.03 0.00 0.00 0.00 0.00 61.98 61.57 1k6i s VAL 32 Cb -0.16 -1.19 0.03 0.00 0.00 0.00 0.00 36.38 35.05 1k6i s VAL 32 CO 0.18 0.40 -0.01 -0.13 0.00 0.00 0.00 175.10 175.54 1k6i s ARG 33 N 0.00 2.74 -0.07 2.72 0.52 -0.20 -0.76 118.95 123.91 1k6i s ARG 33 Ca -0.03 -1.06 0.03 0.00 -0.52 0.00 0.00 55.73 54.16 1k6i s ARG 33 Cb -0.11 -3.14 0.01 0.00 0.52 0.00 0.00 34.95 32.23 1k6i s ARG 33 CO 0.02 -0.49 -0.15 0.00 0.02 0.00 0.00 175.30 174.69 1k6i s ALA 34 N 1.34 1.48 0.15 2.13 0.00 -0.06 -0.89 121.76 125.91 1k6i s ALA 34 Ca -0.01 -0.57 -0.21 0.00 0.00 0.00 0.00 51.96 51.16 1k6i s ALA 34 Cb -0.18 -0.60 -0.08 0.00 0.00 0.00 0.00 23.12 22.27 1k6i s ALA 34 CO -0.02 0.18 0.68 -1.14 0.00 0.00 0.00 175.76 175.46 1k6i s GLN 35 N 0.48 4.33 0.02 0.00 -0.44 -0.01 -0.90 119.66 123.14 1k6i s GLN 35 Ca -0.13 0.91 0.01 0.00 -2.50 0.00 0.00 55.36 53.65 1k6i s GLN 35 Cb -0.15 -3.14 -0.02 0.00 -1.64 0.00 0.00 33.01 28.06 1k6i s GLN 35 CO 0.04 0.55 -0.05 0.14 0.50 0.00 0.00 175.29 176.47 1k6i s VAL 36 N -1.25 0.37 0.36 1.34 -7.23 -0.94 -1.44 120.40 111.62 1k6i s VAL 36 Ca 0.35 -0.74 0.14 0.00 -1.81 0.00 0.00 61.98 59.92 1k6i s VAL 36 Cb -0.20 -0.42 0.10 0.00 0.56 0.00 0.00 36.38 36.42 1k6i s VAL 36 CO 0.22 -0.25 1.83 0.45 -0.31 0.00 0.00 175.10 177.05 1k6i h HIS 37 N 5.05 0.00 -2.34 2.82 3.86 -1.88 -1.13 115.15 121.53 1k6i h HIS 37 Ca -0.32 0.00 -0.08 0.00 -1.16 0.00 0.00 60.37 58.81 1k6i h HIS 37 Cb 1.20 0.00 -0.20 0.00 1.06 0.00 0.00 27.41 29.48 1k6i h HIS 37 CO 0.57 0.36 0.03 -1.54 0.86 0.00 0.00 177.93 178.21 1k6i s SER 38 N -6.88 -0.51 0.22 2.45 1.04 -1.26 -3.57 113.70 105.18 1k6i s SER 38 Ca -0.03 0.56 0.25 0.00 0.48 0.00 0.00 55.95 57.22 1k6i s SER 38 Cb 0.14 0.52 0.87 0.00 0.10 0.00 0.00 66.02 67.66 1k6i s SER 38 CO 0.72 -0.53 1.76 0.18 0.98 0.00 0.00 173.24 176.35 1k6i n LEU 39 N 1.16 0.74 -4.82 2.42 4.77 -1.26 -4.82 117.00 115.20 1k6i n LEU 39 Ca -0.19 0.60 -0.32 0.00 -0.03 0.00 0.00 56.01 56.06 1k6i n LEU 39 Cb 0.57 -0.40 -0.00 0.00 -2.33 0.00 0.00 43.42 41.25 1k6i n LEU 39 CO 0.22 -0.29 0.70 -1.59 -1.33 0.00 0.00 177.39 175.11 1k6i s LYS 40 N -3.16 3.51 0.00 3.23 -2.85 -1.26 -3.75 119.74 115.46 1k6i s LYS 40 Ca 0.09 1.09 0.00 0.00 -1.00 0.00 0.00 55.97 56.15 1k6i s LYS 40 Cb 0.12 -2.07 0.00 0.00 -2.06 0.00 0.00 37.83 33.82 1k6i s LYS 40 CO 0.53 -0.64 0.00 0.41 0.10 0.00 0.00 175.35 175.75 1k6i n GLY 41 N -1.32 3.67 0.23 0.59 0.00 -1.26 -4.61 105.19 102.49 1k6i n GLY 41 Ca 0.08 -1.52 -0.04 0.00 0.00 0.00 0.00 46.02 44.54 1k6i n GLY 41 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1k6i h LEU 42 N 0.00 -0.59 -0.16 0.99 5.85 -1.99 0.55 115.31 119.97 1k6i h LEU 42 Ca 0.00 0.16 -0.09 0.00 0.84 0.00 0.00 57.88 58.78 1k6i h LEU 42 Cb 0.00 0.35 -0.00 0.00 0.37 0.00 0.00 40.66 41.38 1k6i h LEU 42 CO 0.00 -0.20 -0.26 0.40 -0.34 0.00 0.00 178.44 178.04 1k6i h ILE 43 N -0.06 1.35 -0.27 4.05 2.04 -1.96 -0.25 117.51 122.41 1k6i h ILE 43 Ca 0.22 -1.49 0.03 0.00 1.00 0.00 0.00 64.86 64.62 1k6i h ILE 43 Cb 0.41 1.93 -0.03 0.00 -0.74 0.00 0.00 36.82 38.39 1k6i h ILE 43 CO -0.51 0.45 0.10 0.00 0.00 0.00 0.00 178.15 178.19 1k6i h ALA 44 N 0.58 0.31 -0.98 1.87 0.00 -1.75 0.50 119.26 119.80 1k6i h ALA 44 Ca 0.01 0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.96 1k6i h ALA 44 Cb 0.84 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.58 1k6i h ALA 44 CO 0.06 -0.30 0.65 0.93 0.00 0.00 0.00 179.25 180.58 1k6i h GLU 45 N 0.23 1.28 -0.30 0.00 5.08 -0.89 0.10 114.58 120.09 1k6i h GLU 45 Ca 0.12 -0.08 -0.02 0.00 -1.00 0.00 0.00 59.36 58.38 1k6i h GLU 45 Cb 0.07 -0.29 -0.01 0.00 0.50 0.00 0.00 28.75 29.02 1k6i h GLU 45 CO -0.11 0.85 0.12 1.49 -1.00 0.00 0.00 179.01 180.36 1k6i h GLU 46 N 1.32 0.44 -0.39 2.33 4.81 -0.13 -2.91 114.58 120.04 1k6i h GLU 46 Ca 0.36 -0.08 -0.11 0.00 -0.13 0.00 0.00 59.36 59.41 1k6i h GLU 46 Cb -0.14 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.15 1k6i h GLU 46 CO -0.08 0.45 -0.19 -0.07 -0.73 0.00 0.00 179.01 178.39 1k6i h LEU 47 N 0.33 0.76 -1.21 1.64 3.38 0.66 -2.90 115.31 117.97 1k6i h LEU 47 Ca 0.10 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.81 1k6i h LEU 47 Cb 0.17 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.72 1k6i h LEU 47 CO -0.01 0.95 0.00 0.06 0.09 0.00 0.00 178.44 179.53 1k6i h GLN 48 N 0.67 0.00 0.00 1.13 3.07 -0.76 -2.56 115.11 116.66 1k6i h GLN 48 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.84 1k6i h GLN 48 Cb 0.69 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.25 1k6i h GLN 48 CO 0.05 0.00 0.00 0.00 0.09 0.00 0.00 178.83 178.97 1k6i n ALA 49 N -2.06 2.37 -2.60 0.06 0.00 -1.10 -4.65 120.51 112.53 1k6i n ALA 49 Ca 0.01 -0.14 -0.42 0.00 0.00 0.00 0.00 53.44 52.90 1k6i n ALA 49 Cb 0.33 -1.44 -0.06 0.00 0.00 0.00 0.00 19.45 18.28 1k6i n ALA 49 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1k6i s ILE 50 N -2.46 4.86 0.23 0.00 1.01 -0.96 -4.97 121.20 118.90 1k6i s ILE 50 Ca 0.29 0.97 -0.09 0.00 0.00 0.00 0.00 60.65 61.81 1k6i s ILE 50 Cb 0.18 -4.08 0.24 0.00 0.01 0.00 0.00 42.46 38.81 1k6i s ILE 50 CO 0.39 -0.22 1.65 -0.65 0.00 0.00 0.00 174.94 176.11 1k6i h PRO 51 N 8.20 0.10 0.00 2.79 0.11 -1.88 -1.39 132.00 139.93 1k6i h PRO 51 Ca -0.26 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.85 1k6i h PRO 51 Cb 1.11 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1k6i h PRO 51 CO 0.84 0.06 0.00 0.09 -0.21 0.00 0.00 178.00 178.79 1k6i n ASN 52 N -5.32 0.00 -4.73 -2.05 5.03 -1.26 -4.74 115.26 102.18 1k6i n ASN 52 Ca 0.11 0.11 -0.35 0.00 0.87 0.00 0.00 54.58 55.31 1k6i n ASN 52 Cb 0.40 -0.28 -0.09 0.00 -1.02 0.00 0.00 39.78 38.80 1k6i n ASN 52 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1k6i s VAL 53 N -2.56 4.62 -0.08 2.41 1.01 -0.52 -0.30 120.40 124.98 1k6i s VAL 53 Ca 0.11 -0.15 0.02 0.00 0.00 0.00 0.00 61.98 61.96 1k6i s VAL 53 Cb 0.08 -2.97 0.01 0.00 0.00 0.00 0.00 36.38 33.50 1k6i s VAL 53 CO 0.18 0.60 -0.12 -0.89 0.00 0.00 0.00 175.10 174.86 1k6i s THR 54 N -0.93 1.20 0.01 3.92 2.01 0.06 -4.84 115.64 117.07 1k6i s THR 54 Ca 0.14 -0.49 -0.02 0.00 0.31 0.00 0.00 61.69 61.63 1k6i s THR 54 Cb -0.12 -1.11 -0.04 0.00 0.01 0.00 0.00 72.50 71.24 1k6i s THR 54 CO 0.03 0.38 0.20 -0.76 -0.69 0.00 0.00 174.62 173.78 1k6i s LEU 55 N 0.85 4.37 -0.27 4.42 1.02 -1.26 -0.88 118.68 126.92 1k6i s LEU 55 Ca -0.11 0.35 -0.01 0.00 0.02 0.00 0.00 54.13 54.39 1k6i s LEU 55 Cb -0.15 -2.72 0.08 0.00 0.02 0.00 0.00 46.19 43.43 1k6i s LEU 55 CO 0.01 0.24 0.06 -0.36 0.02 0.00 0.00 176.35 176.32 1k6i s PHE 56 N -1.37 1.81 0.24 0.29 0.08 -0.08 -4.92 117.98 114.03 1k6i s PHE 56 Ca 0.29 -1.63 -0.24 0.00 0.12 0.00 0.00 56.93 55.47 1k6i s PHE 56 Cb -0.13 -1.62 -0.09 0.00 -0.57 0.00 0.00 43.02 40.61 1k6i s PHE 56 CO 0.21 -0.81 0.82 1.14 -0.10 0.00 0.00 175.22 176.48 1k6i s GLN 57 N 1.59 4.48 0.00 0.44 0.00 -1.26 -2.22 119.66 122.69 1k6i s GLN 57 Ca 0.05 1.13 0.00 0.00 -0.00 0.00 0.00 55.36 56.54 1k6i s GLN 57 Cb -0.18 -2.99 0.00 0.00 0.00 0.00 0.00 33.01 29.84 1k6i s GLN 57 CO -0.17 0.42 0.00 0.41 0.00 0.00 0.00 175.29 175.95 1k6i n GLY 58 N 0.97 2.32 3.87 2.60 0.00 -0.43 -4.95 105.19 109.58 1k6i n GLY 58 Ca -0.02 -1.49 -0.30 0.00 0.00 0.00 0.00 46.02 44.20 1k6i n GLY 58 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1k6i s PRO 59 N -1.91 3.74 -0.11 1.61 0.04 -1.26 -4.07 135.00 133.04 1k6i s PRO 59 Ca 0.00 0.56 0.14 0.00 0.04 0.00 0.00 61.00 61.74 1k6i s PRO 59 Cb 0.00 -2.29 -0.24 0.00 0.04 0.00 0.00 34.50 32.02 1k6i s PRO 59 CO 0.00 -0.20 0.40 1.28 0.04 0.00 0.00 177.00 178.52 1k6i n LEU 60 N -1.78 0.64 -4.68 -3.56 4.77 -1.26 -4.64 117.00 106.48 1k6i n LEU 60 Ca 0.03 0.24 -0.49 0.00 -0.03 0.00 0.00 56.01 55.76 1k6i n LEU 60 Cb 0.54 0.23 -0.05 0.00 -2.33 0.00 0.00 43.42 41.82 1k6i n LEU 60 CO 0.50 0.46 1.39 -0.11 -1.33 0.00 0.00 177.39 178.30 1k6i n LEU 61 N -2.95 3.15 -4.16 2.23 7.94 -1.26 -2.43 117.00 119.51 1k6i n LEU 61 Ca -0.24 1.01 -0.38 0.00 -1.11 0.00 0.00 56.01 55.29 1k6i n LEU 61 Cb 1.09 -1.34 -0.03 0.00 0.53 0.00 0.00 43.42 43.67 1k6i n LEU 61 CO 0.44 -0.20 -0.30 0.59 -1.11 0.00 0.00 177.39 176.81 1k6i n ASN 62 N 5.70 -1.74 -2.91 1.96 3.02 -1.26 -4.89 115.26 115.15 1k6i n ASN 62 Ca 0.22 -1.27 -0.12 0.00 -0.03 0.00 0.00 54.58 53.38 1k6i n ASN 62 Cb 0.26 -1.77 0.03 0.00 -0.61 0.00 0.00 39.78 37.69 1k6i n ASN 62 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1k6i n ASN 63 N -2.54 -0.40 -0.18 6.41 2.85 -1.02 -4.96 115.26 115.43 1k6i n ASN 63 Ca -0.22 -3.12 0.07 0.00 -0.11 0.00 0.00 54.58 51.21 1k6i n ASN 63 Cb 0.63 0.40 0.37 0.00 1.24 0.00 0.00 39.78 42.42 1k6i n ASN 63 CO 0.00 0.00 0.00 0.58 -2.11 0.00 0.00 177.26 175.73 1k6i h VAL 64 N 2.06 0.99 -0.83 3.44 2.07 -1.90 -2.03 116.25 120.04 1k6i h VAL 64 Ca -0.04 -0.24 0.15 0.00 0.82 0.00 0.00 66.70 67.39 1k6i h VAL 64 Cb 1.08 0.22 -0.09 0.00 -1.52 0.00 0.00 31.29 30.98 1k6i h VAL 64 CO 0.32 0.13 0.41 -0.65 0.02 0.00 0.00 177.57 177.79 1k6i h PRO 65 N 0.71 0.56 -0.58 1.57 0.11 -1.97 0.16 132.00 132.56 1k6i h PRO 65 Ca 0.32 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 66.36 1k6i h PRO 65 Cb 0.32 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 31.28 1k6i h PRO 65 CO -0.11 0.37 0.21 1.25 -0.21 0.00 0.00 178.00 179.51 1k6i h LEU 66 N 0.58 0.78 -0.55 2.35 6.46 -1.73 -0.95 115.31 122.26 1k6i h LEU 66 Ca 0.46 -0.11 -0.09 0.00 -0.12 0.00 0.00 57.88 58.02 1k6i h LEU 66 Cb 0.66 -0.20 -0.02 0.00 -0.73 0.00 0.00 40.66 40.37 1k6i h LEU 66 CO -0.38 0.72 0.00 0.24 -0.62 0.00 0.00 178.44 178.40 1k6i h MET 67 N 0.84 0.96 -0.66 1.25 2.86 -0.76 0.29 114.93 119.71 1k6i h MET 67 Ca 0.20 -0.31 -0.08 0.00 -2.06 0.00 0.00 59.70 57.45 1k6i h MET 67 Cb 0.20 -0.09 -0.03 0.00 0.06 0.00 0.00 31.60 31.75 1k6i h MET 67 CO -0.01 0.97 0.10 -0.44 1.06 0.00 0.00 176.91 178.59 1k6i h ASP 68 N 0.84 1.06 -0.15 1.22 3.32 -0.28 -2.32 116.42 120.11 1k6i h ASP 68 Ca 0.15 -0.27 -0.01 0.00 0.02 0.00 0.00 57.03 56.93 1k6i h ASP 68 Cb 0.54 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.80 1k6i h ASP 68 CO 0.03 1.06 0.06 0.74 -1.72 0.00 0.00 179.24 179.40 1k6i h THR 69 N 1.02 1.15 -0.45 0.35 2.02 -0.94 -2.78 112.91 113.28 1k6i h THR 69 Ca 0.20 -0.43 0.08 0.00 0.77 0.00 0.00 66.41 67.03 1k6i h THR 69 Cb 0.45 1.17 -0.07 0.00 -1.74 0.00 0.00 68.15 67.96 1k6i h THR 69 CO 0.01 0.14 0.01 0.25 0.37 0.00 0.00 175.52 176.30 1k6i h LEU 70 N 0.09 -0.17 -0.08 2.58 5.85 -0.73 -2.68 115.31 120.17 1k6i h LEU 70 Ca 0.05 0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.87 1k6i h LEU 70 Cb 0.16 0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.37 1k6i h LEU 70 CO -0.00 -0.05 0.00 0.49 -0.34 0.00 0.00 178.44 178.53 1k6i n PHE 71 N -5.20 0.30 -1.75 1.25 3.72 -0.89 -4.73 117.46 110.16 1k6i n PHE 71 Ca 0.04 0.10 -0.42 0.00 -0.05 0.00 0.00 57.45 57.11 1k6i n PHE 71 Cb 0.24 -0.66 -0.03 0.00 -0.94 0.00 0.00 39.48 38.09 1k6i n PHE 71 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 176.76 174.71 1k6i s GLU 72 N -3.06 3.86 0.00 -1.08 2.12 -1.01 -1.44 118.70 118.08 1k6i s GLU 72 Ca 0.10 2.30 0.00 0.00 0.36 0.00 0.00 54.97 57.73 1k6i s GLU 72 Cb 0.14 -4.18 0.00 0.00 0.26 0.00 0.00 34.13 30.36 1k6i s GLU 72 CO 0.47 -1.26 0.00 0.41 -0.54 0.00 0.00 175.26 174.33 1k6i n GLY 73 N 4.80 0.96 3.84 -1.50 0.00 -1.26 -5.04 105.19 106.99 1k6i n GLY 73 Ca 0.22 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.90 1k6i n GLY 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k6i s ALA 74 N -3.40 3.38 -0.02 4.61 0.00 -0.52 -4.70 121.76 121.11 1k6i s ALA 74 Ca 0.00 0.06 0.07 0.00 0.00 0.00 0.00 51.96 52.09 1k6i s ALA 74 Cb 0.00 -2.75 -0.11 0.00 0.00 0.00 0.00 23.12 20.26 1k6i s ALA 74 CO 0.00 0.35 0.13 0.72 0.00 0.00 0.00 175.76 176.96 1k6i n HIS 75 N 0.10 0.00 -4.11 0.00 -0.00 -0.32 -3.52 115.22 107.37 1k6i n HIS 75 Ca 0.01 0.00 -0.14 0.00 -0.00 0.00 0.00 57.72 57.59 1k6i n HIS 75 Cb 0.52 -0.20 -0.11 0.00 -0.00 0.00 0.00 29.99 30.20 1k6i n HIS 75 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 1k6i s LEU 76 N -3.70 2.30 -0.00 2.41 1.43 -0.83 0.66 118.68 120.95 1k6i s LEU 76 Ca -0.03 -0.64 -0.00 0.00 -1.03 0.00 0.00 54.13 52.43 1k6i s LEU 76 Cb 0.04 -0.26 0.00 0.00 0.03 0.00 0.00 46.19 46.01 1k6i s LEU 76 CO 0.30 -0.21 0.01 0.00 0.23 0.00 0.00 176.35 176.68 1k6i s ALA 77 N -1.70 -0.03 -0.19 4.21 0.00 -0.62 -0.42 121.76 123.02 1k6i s ALA 77 Ca -0.04 0.02 0.00 0.00 0.00 0.00 0.00 51.96 51.94 1k6i s ALA 77 Cb -0.08 -0.02 0.05 0.00 0.00 0.00 0.00 23.12 23.07 1k6i s ALA 77 CO 0.00 -0.01 -0.06 0.12 0.00 0.00 0.00 175.76 175.81 1k6i s PHE 78 N -0.03 2.01 -0.12 0.00 2.19 -0.63 -0.26 117.98 121.13 1k6i s PHE 78 Ca -0.00 -1.34 0.02 0.00 0.33 0.00 0.00 56.93 55.93 1k6i s PHE 78 Cb -0.00 -1.45 -0.01 0.00 -1.31 0.00 0.00 43.02 40.25 1k6i s PHE 78 CO -0.00 -0.68 -0.18 0.42 1.83 0.00 0.00 175.22 176.61 1k6i s ILE 79 N 1.53 2.57 -0.08 3.12 -1.09 0.13 -3.97 121.20 123.42 1k6i s ILE 79 Ca -0.01 -0.83 -0.01 0.00 -2.23 0.00 0.00 60.65 57.57 1k6i s ILE 79 Cb -0.16 -2.05 0.03 0.00 -1.58 0.00 0.00 42.46 38.70 1k6i s ILE 79 CO -0.08 0.54 0.00 0.21 -1.23 0.00 0.00 174.94 174.39 1k6i s ASN 80 N 0.44 1.64 0.42 3.58 2.47 -1.26 -0.42 114.94 121.81 1k6i s ASN 80 Ca -0.13 -0.12 0.08 0.00 0.42 0.00 0.00 52.86 53.11 1k6i s ASN 80 Cb -0.17 -0.44 -0.02 0.00 -1.45 0.00 0.00 41.25 39.18 1k6i s ASN 80 CO 0.06 -0.20 0.39 0.42 -3.72 0.00 0.00 177.10 174.04 1k6i s THR 81 N 1.97 2.61 0.18 -5.21 -4.23 -1.26 -4.56 115.64 105.15 1k6i s THR 81 Ca 0.05 -1.34 0.04 0.00 -1.18 0.00 0.00 61.69 59.26 1k6i s THR 81 Cb -0.12 -2.96 -0.05 0.00 1.34 0.00 0.00 72.50 70.71 1k6i s THR 81 CO -0.05 0.00 -0.07 0.42 -0.54 0.00 0.00 174.62 174.38 1k6i s THR 82 N -2.49 1.15 -1.98 3.99 -4.23 -1.26 -5.05 115.64 105.78 1k6i s THR 82 Ca 0.48 -2.06 0.25 0.00 -1.18 0.00 0.00 61.69 59.18 1k6i s THR 82 Cb -0.03 -2.05 0.17 0.00 1.34 0.00 0.00 72.50 71.92 1k6i s THR 82 CO 0.28 -0.57 1.37 -1.54 -0.54 0.00 0.00 174.62 173.61 1k6i n SER 83 N -0.29 1.56 -0.01 3.99 3.41 -1.26 -4.49 113.62 116.53 1k6i n SER 83 Ca -0.08 -1.24 -0.00 0.00 -0.26 0.00 0.00 58.87 57.29 1k6i n SER 83 Cb 0.62 0.26 -0.00 0.00 -0.26 0.00 0.00 64.21 64.83 1k6i n SER 83 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 1k6i h GLN 84 N 1.95 -0.00 0.00 4.33 1.08 -2.01 0.82 115.11 121.28 1k6i h GLN 84 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1k6i h GLN 84 Cb 0.63 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.06 1k6i h GLN 84 CO 0.00 -0.00 0.00 0.00 -0.95 0.00 0.00 178.83 177.88 1k6i n ALA 85 N -2.99 2.13 -0.51 3.87 0.00 -1.26 -4.98 120.51 116.77 1k6i n ALA 85 Ca 0.00 -0.10 0.07 0.00 0.00 0.00 0.00 53.44 53.41 1k6i n ALA 85 Cb 0.01 -1.26 -0.02 0.00 0.00 0.00 0.00 19.45 18.17 1k6i n ALA 85 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1k6i n GLY 86 N 0.06 -2.11 2.40 0.00 0.00 0.28 -4.92 105.19 100.91 1k6i n GLY 86 Ca 0.12 -1.36 -0.15 0.00 0.00 0.00 0.00 46.02 44.62 1k6i n GLY 86 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1k6i n ASP 87 N -3.02 -4.63 -0.25 1.61 8.00 -1.26 -4.92 116.55 112.07 1k6i n ASP 87 Ca -0.01 -0.08 -0.05 0.00 0.71 0.00 0.00 54.79 55.36 1k6i n ASP 87 Cb 0.24 -3.68 0.05 0.00 -0.02 0.00 0.00 41.12 37.71 1k6i n ASP 87 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 1k6i h GLU 88 N -0.33 0.95 -0.26 -1.24 4.81 -1.87 0.08 114.58 116.72 1k6i h GLU 88 Ca -0.36 -0.08 -0.01 0.00 -0.13 0.00 0.00 59.36 58.78 1k6i h GLU 88 Cb 1.26 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 30.43 1k6i h GLU 88 CO 0.42 0.67 0.12 0.82 -0.73 0.00 0.00 179.01 180.30 1k6i h ILE 89 N 0.96 1.15 -0.13 2.32 2.04 -1.91 -0.28 117.51 121.66 1k6i h ILE 89 Ca 0.25 -0.44 0.02 0.00 1.00 0.00 0.00 64.86 65.70 1k6i h ILE 89 Cb -0.05 0.96 -0.02 0.00 -0.74 0.00 0.00 36.82 36.97 1k6i h ILE 89 CO -0.05 0.15 -0.01 0.00 0.00 0.00 0.00 178.15 178.24 1k6i h ALA 90 N 0.98 0.10 -0.65 1.87 0.00 -1.88 -1.52 119.26 118.17 1k6i h ALA 90 Ca 0.09 0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.06 1k6i h ALA 90 Cb 0.13 0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.95 1k6i h ALA 90 CO -0.01 -0.46 0.41 0.82 0.00 0.00 0.00 179.25 180.01 1k6i h ILE 91 N 0.03 1.11 -0.74 0.00 2.04 -0.86 -0.79 117.51 118.30 1k6i h ILE 91 Ca 0.06 -0.28 -0.02 0.00 1.00 0.00 0.00 64.86 65.62 1k6i h ILE 91 Cb 0.08 0.22 -0.03 0.00 -0.74 0.00 0.00 36.82 36.34 1k6i h ILE 91 CO -0.11 0.15 0.37 1.23 0.00 0.00 0.00 178.15 179.79 1k6i h GLY 92 N 0.82 1.11 1.05 5.37 0.00 -0.59 -0.65 103.07 110.19 1k6i h GLY 92 Ca 0.25 -0.52 -0.17 0.00 0.00 0.00 0.00 47.33 46.90 1k6i h GLY 92 CO -0.09 0.50 -0.50 0.50 0.00 0.00 0.00 176.54 176.95 1k6i h LYS 93 N 1.04 0.76 -0.93 4.80 1.57 -0.91 -2.32 116.57 120.57 1k6i h LYS 93 Ca 0.26 -0.50 -0.01 0.00 -1.87 0.00 0.00 60.65 58.53 1k6i h LYS 93 Cb 0.07 0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.40 1k6i h LYS 93 CO -0.04 1.12 0.55 -0.44 -0.57 0.00 0.00 179.45 180.07 1k6i h ASP 94 N 0.49 1.13 -0.45 0.86 3.45 -0.80 0.19 116.42 121.29 1k6i h ASP 94 Ca 0.00 -0.08 -0.11 0.00 0.43 0.00 0.00 57.03 57.28 1k6i h ASP 94 Cb 1.11 -0.29 -0.01 0.00 -0.56 0.00 0.00 39.33 39.58 1k6i h ASP 94 CO 0.11 0.88 -0.13 -0.07 -1.57 0.00 0.00 179.24 178.46 1k6i h LEU 95 N 1.29 0.91 -0.46 1.55 3.38 -1.10 0.19 115.31 121.07 1k6i h LEU 95 Ca 0.33 -0.37 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 1k6i h LEU 95 Cb -0.03 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.45 1k6i h LEU 95 CO -0.06 1.07 0.12 0.00 0.09 0.00 0.00 178.44 179.66 1k6i h ALA 96 N 0.87 0.61 -0.52 1.53 0.00 -1.09 -0.28 119.26 120.38 1k6i h ALA 96 Ca 0.11 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 1k6i h ALA 96 Cb 0.69 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1k6i h ALA 96 CO 0.05 0.29 0.15 -0.44 0.00 0.00 0.00 179.25 179.29 1k6i h ASP 97 N 0.62 0.76 -0.94 0.00 3.32 -0.80 -1.63 116.42 117.75 1k6i h ASP 97 Ca 0.15 -0.22 0.00 0.00 0.02 0.00 0.00 57.03 56.98 1k6i h ASP 97 Cb 0.31 -0.20 -0.05 0.00 0.22 0.00 0.00 39.33 39.61 1k6i h ASP 97 CO -0.00 0.78 0.60 0.00 -1.72 0.00 0.00 179.24 178.90 1k6i h ALA 98 N 1.01 1.29 -0.56 3.45 0.00 -0.28 -0.49 119.26 123.69 1k6i h ALA 98 Ca 0.16 -0.08 -0.11 0.00 0.00 0.00 0.00 54.91 54.89 1k6i h ALA 98 Cb 0.30 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1k6i h ALA 98 CO -0.00 0.64 -0.08 0.00 0.00 0.00 0.00 179.25 179.81 1k6i h ALA 99 N 1.38 0.80 -0.08 0.00 0.00 -0.73 -1.26 119.26 119.38 1k6i h ALA 99 Ca 0.34 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1k6i h ALA 99 Cb -0.12 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.47 1k6i h ALA 99 CO -0.07 0.67 0.03 -0.22 0.00 0.00 0.00 179.25 179.66 1k6i h LYS 100 N 0.92 0.13 -0.92 0.00 1.63 -0.84 -2.99 116.57 114.50 1k6i h LYS 100 Ca 0.15 -0.03 0.06 0.00 -0.85 0.00 0.00 60.65 59.99 1k6i h LYS 100 Cb 0.64 -0.02 -0.06 0.00 -0.60 0.00 0.00 32.23 32.19 1k6i h LYS 100 CO 0.04 0.28 0.60 -0.09 -3.45 0.00 0.00 179.45 176.83 1k6i h ARG 101 N -0.04 1.02 -0.01 1.90 2.43 -0.95 -0.67 114.38 118.05 1k6i h ARG 101 Ca 0.03 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1k6i h ARG 101 Cb 0.20 -0.23 -0.00 0.00 -0.42 0.00 0.00 29.97 29.52 1k6i h ARG 101 CO -0.00 0.68 0.02 0.00 -1.51 0.00 0.00 179.97 179.16 1k6i h ALA 102 N 1.50 1.43 0.00 2.80 0.00 -1.08 -3.45 119.26 120.46 1k6i h ALA 102 Ca 0.40 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.31 1k6i h ALA 102 Cb 0.19 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1k6i h ALA 102 CO -0.15 -0.03 0.00 0.41 0.00 0.00 0.00 179.25 179.48 1k6i n GLY 103 N -1.28 1.39 0.00 0.00 0.00 -0.26 -4.70 105.19 100.34 1k6i n GLY 103 Ca -0.03 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.11 1k6i n GLY 103 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1k6i n THR 104 N -1.25 0.00 -2.51 2.61 -2.24 -1.26 -4.87 114.28 104.76 1k6i n THR 104 Ca 0.00 -0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.35 1k6i n THR 104 Cb 0.00 0.28 -0.02 0.00 -2.10 0.00 0.00 70.33 68.49 1k6i n THR 104 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1k6i s ILE 105 N -3.00 4.31 -0.16 2.28 -1.09 -1.23 -4.07 121.20 118.24 1k6i s ILE 105 Ca 0.11 1.51 0.22 0.00 -2.23 0.00 0.00 60.65 60.26 1k6i s ILE 105 Cb 0.17 -4.25 -0.12 0.00 -1.58 0.00 0.00 42.46 36.69 1k6i s ILE 105 CO 0.71 -0.43 0.84 0.00 -1.23 0.00 0.00 174.94 174.83 1k6i n GLN 106 N 7.04 0.62 -3.66 2.79 6.02 0.21 -4.84 117.38 125.56 1k6i n GLN 106 Ca 0.13 0.02 -0.08 0.00 -0.01 0.00 0.00 57.00 57.07 1k6i n GLN 106 Cb 0.47 -1.73 -0.09 0.00 1.02 0.00 0.00 30.24 29.91 1k6i n GLN 106 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 1k6i s HIS 107 N -3.39 -0.83 -0.26 1.08 5.04 -1.23 -4.25 115.29 111.45 1k6i s HIS 107 Ca -0.03 1.59 0.00 0.00 -1.54 0.00 0.00 55.06 55.08 1k6i s HIS 107 Cb 0.11 0.36 0.04 0.00 0.04 0.00 0.00 32.58 33.13 1k6i s HIS 107 CO 0.83 -0.48 -0.08 -0.47 -2.34 0.00 0.00 174.74 172.20 1k6i s TYR 108 N 2.42 3.17 -0.26 3.88 6.14 0.04 -1.59 117.35 131.14 1k6i s TYR 108 Ca -0.04 -1.93 -0.11 0.00 0.64 0.00 0.00 57.07 55.63 1k6i s TYR 108 Cb -0.11 -2.01 -0.05 0.00 0.42 0.00 0.00 41.96 40.21 1k6i s TYR 108 CO -0.14 -0.81 0.20 0.42 0.64 0.00 0.00 175.55 175.87 1k6i s ILE 109 N 1.22 5.31 -0.10 3.14 1.01 0.64 -1.35 121.20 131.07 1k6i s ILE 109 Ca -0.04 0.23 0.01 0.00 0.00 0.00 0.00 60.65 60.84 1k6i s ILE 109 Cb -0.18 -3.54 -0.02 0.00 0.01 0.00 0.00 42.46 38.72 1k6i s ILE 109 CO -0.05 0.27 -0.12 -0.47 0.00 0.00 0.00 174.94 174.57 1k6i s TYR 110 N 1.56 2.81 -0.68 3.97 5.04 0.02 0.23 117.35 130.29 1k6i s TYR 110 Ca 0.08 -0.42 -0.24 0.00 -2.44 0.00 0.00 57.07 54.05 1k6i s TYR 110 Cb -0.15 -1.78 0.06 0.00 0.35 0.00 0.00 41.96 40.44 1k6i s TYR 110 CO 0.09 -0.04 1.06 0.45 -1.34 0.00 0.00 175.55 175.76 1k6i s SER 111 N -0.05 6.17 0.42 4.32 0.15 0.43 -1.75 113.70 123.39 1k6i s SER 111 Ca -0.02 -0.83 0.08 0.00 0.70 0.00 0.00 55.95 55.87 1k6i s SER 111 Cb -0.14 -2.46 0.01 0.00 -1.71 0.00 0.00 66.02 61.72 1k6i s SER 111 CO 0.04 -1.56 0.54 -0.55 1.20 0.00 0.00 173.24 172.91 1k6i s SER 112 N 3.69 5.58 0.07 5.45 0.15 -0.17 -4.71 113.70 123.77 1k6i s SER 112 Ca 0.26 -0.46 -0.05 0.00 0.70 0.00 0.00 55.95 56.40 1k6i s SER 112 Cb -0.14 -0.66 -0.02 0.00 -1.71 0.00 0.00 66.02 63.49 1k6i s SER 112 CO 0.12 -0.74 0.08 -0.04 1.20 0.00 0.00 173.24 173.86 1k6i s MET 113 N -4.32 0.73 0.74 5.44 -1.94 -1.26 -4.25 119.30 114.45 1k6i s MET 113 Ca 0.54 -1.09 -0.11 0.00 -1.71 0.00 0.00 55.69 53.32 1k6i s MET 113 Cb -0.09 0.28 0.04 0.00 2.01 0.00 0.00 34.83 37.06 1k6i s MET 113 CO 0.32 -0.19 1.08 -2.14 -0.01 0.00 0.00 175.02 174.08 1k6i s PRO 114 N -3.89 2.52 -0.52 2.03 0.02 -1.26 -3.52 135.00 130.38 1k6i s PRO 114 Ca 0.06 0.98 0.00 0.00 0.02 0.00 0.00 61.00 62.06 1k6i s PRO 114 Cb 0.06 -1.94 0.14 0.00 0.02 0.00 0.00 34.50 32.78 1k6i s PRO 114 CO -0.11 -1.40 0.30 0.34 -0.33 0.00 0.00 177.00 175.80 1k6i s ASP 115 N -3.65 4.88 0.48 2.53 -1.08 -1.26 -2.63 116.67 115.93 1k6i s ASP 115 Ca 0.60 -2.69 0.19 0.00 -0.52 0.00 0.00 52.55 50.12 1k6i s ASP 115 Cb -0.15 -1.75 1.20 0.00 -1.46 0.00 0.00 42.92 40.75 1k6i s ASP 115 CO 0.55 -0.35 1.99 0.45 0.52 0.00 0.00 175.17 178.34 1k6i h HIS 116 N 7.08 0.23 0.00 -5.34 3.86 -1.92 -1.86 115.15 117.20 1k6i h HIS 116 Ca -0.06 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.16 1k6i h HIS 116 Cb 0.96 -0.07 0.00 0.00 1.06 0.00 0.00 27.41 29.35 1k6i h HIS 116 CO 0.59 0.10 0.00 -1.13 0.86 0.00 0.00 177.93 178.36 1k6i n SER 117 N -4.44 0.00 0.01 2.45 3.41 -1.24 -1.07 113.62 112.74 1k6i n SER 117 Ca 0.09 0.20 0.12 0.00 -0.26 0.00 0.00 58.87 59.02 1k6i n SER 117 Cb 0.46 -0.30 0.22 0.00 -0.26 0.00 0.00 64.21 64.33 1k6i n SER 117 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1k6i n LEU 118 N -1.30 0.54 -0.13 1.04 4.77 -0.70 -4.25 117.00 116.98 1k6i n LEU 118 Ca 0.03 0.01 0.01 0.00 -0.03 0.00 0.00 56.01 56.04 1k6i n LEU 118 Cb 0.06 -0.23 0.02 0.00 -2.33 0.00 0.00 43.42 40.95 1k6i n LEU 118 CO 0.06 0.10 0.41 -1.22 -1.33 0.00 0.00 177.39 175.40 1k6i n TYR 119 N -1.61 0.05 -0.85 -1.77 4.01 -0.23 -5.10 117.16 111.67 1k6i n TYR 119 Ca 0.05 -0.24 0.00 0.00 -0.16 0.00 0.00 57.90 57.55 1k6i n TYR 119 Cb 0.35 -0.02 0.00 0.00 -0.31 0.00 0.00 39.34 39.36 1k6i n TYR 119 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1k6i n GLY 120 N -0.04 -1.75 2.38 2.72 0.00 -1.22 -4.98 105.19 102.30 1k6i n GLY 120 Ca 0.02 -1.11 -0.27 0.00 0.00 0.00 0.00 46.02 44.66 1k6i n GLY 120 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1k6i n PRO 121 N -0.33 2.69 -4.28 1.61 -0.04 -1.26 -4.65 135.00 128.74 1k6i n PRO 121 Ca 0.00 -1.65 -0.20 0.00 -0.04 0.00 0.00 63.50 61.62 1k6i n PRO 121 Cb 0.00 -2.49 -0.11 0.00 -0.04 0.00 0.00 33.50 30.86 1k6i n PRO 121 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 1k6i s TRP 122 N 2.48 1.58 0.56 0.54 0.51 -1.26 -5.10 118.94 118.25 1k6i s TRP 122 Ca 0.55 -0.51 -0.07 0.00 -2.12 0.00 0.00 56.10 53.95 1k6i s TRP 122 Cb 0.17 -0.81 -0.02 0.00 -0.81 0.00 0.00 33.47 31.99 1k6i s TRP 122 CO -0.04 0.22 0.89 -1.25 -0.51 0.00 0.00 176.95 176.26 1k6i s PRO 123 N -2.67 3.29 0.05 4.98 0.04 -1.26 -3.60 135.00 135.83 1k6i s PRO 123 Ca 0.11 0.25 -0.25 0.00 0.04 0.00 0.00 61.00 61.15 1k6i s PRO 123 Cb -0.06 -2.26 -0.06 0.00 0.04 0.00 0.00 34.50 32.17 1k6i s PRO 123 CO 0.04 -0.50 0.78 0.00 0.04 0.00 0.00 177.00 177.36 1k6i s ALA 124 N -2.95 3.36 -0.23 8.56 0.00 -1.26 -3.84 121.76 125.40 1k6i s ALA 124 Ca 0.52 0.31 -0.29 0.00 0.00 0.00 0.00 51.96 52.49 1k6i s ALA 124 Cb -0.11 -3.02 -0.01 0.00 0.00 0.00 0.00 23.12 19.99 1k6i s ALA 124 CO 0.47 0.06 1.30 0.08 0.00 0.00 0.00 175.76 177.67 1k6i s VAL 125 N -0.06 4.18 0.33 0.00 1.01 -1.26 -4.91 120.40 119.68 1k6i s VAL 125 Ca 0.39 1.38 0.07 0.00 0.00 0.00 0.00 61.98 63.83 1k6i s VAL 125 Cb -0.21 -4.05 0.39 0.00 0.00 0.00 0.00 36.38 32.52 1k6i s VAL 125 CO 0.24 -0.30 1.58 -0.65 0.00 0.00 0.00 175.10 175.97 1k6i h PRO 126 N 8.84 0.01 -0.15 2.72 0.11 -1.89 -0.56 132.00 141.08 1k6i h PRO 126 Ca -0.27 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 1k6i h PRO 126 Cb 1.10 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.21 1k6i h PRO 126 CO 1.00 0.01 0.00 -1.33 -0.21 0.00 0.00 178.00 177.47 1k6i n MET 127 N -5.42 1.83 -0.03 1.05 2.81 -1.26 -4.40 117.12 111.71 1k6i n MET 127 Ca 0.28 -1.24 -0.08 0.00 -1.81 0.00 0.00 57.70 54.85 1k6i n MET 127 Cb 0.91 -1.43 -0.03 0.00 -0.71 0.00 0.00 33.22 31.97 1k6i n MET 127 CO 0.00 0.00 0.00 0.91 1.51 0.00 0.00 175.97 178.39 1k6i n TRP 128 N 0.47 0.00 -0.29 2.03 8.01 -0.28 -4.74 117.44 122.64 1k6i n TRP 128 Ca 0.17 0.00 0.11 0.00 -1.31 0.00 0.00 57.50 56.47 1k6i n TRP 128 Cb 0.38 -0.31 0.25 0.00 -2.01 0.00 0.00 31.31 29.62 1k6i n TRP 128 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1k6i h ALA 129 N -0.43 1.10 -1.00 6.99 0.00 -1.14 -0.31 119.26 124.47 1k6i h ALA 129 Ca -0.13 0.25 0.22 0.00 0.00 0.00 0.00 54.91 55.25 1k6i h ALA 129 Cb 0.79 0.41 -0.11 0.00 0.00 0.00 0.00 17.79 18.88 1k6i h ALA 129 CO -0.08 -0.48 0.62 -1.35 0.00 0.00 0.00 179.25 177.96 1k6i h PRO 130 N 0.13 0.61 -0.78 0.00 0.11 -1.84 -0.42 132.00 129.81 1k6i h PRO 130 Ca 0.52 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.58 1k6i h PRO 130 Cb 1.02 -0.14 -0.04 0.00 0.11 0.00 0.00 31.00 31.96 1k6i h PRO 130 CO -0.71 0.40 0.43 0.87 -0.21 0.00 0.00 178.00 178.77 1k6i h LYS 131 N 0.63 1.09 -0.51 1.05 1.57 -1.34 -2.01 116.57 117.05 1k6i h LYS 131 Ca 0.59 -0.12 -0.04 0.00 -1.87 0.00 0.00 60.65 59.21 1k6i h LYS 131 Cb 1.11 -0.22 -0.02 0.00 0.08 0.00 0.00 32.23 33.18 1k6i h LYS 131 CO -0.38 0.80 0.17 0.35 -0.57 0.00 0.00 179.45 179.82 1k6i h PHE 132 N 1.09 0.75 -0.29 -1.35 3.57 -1.10 0.11 116.94 119.72 1k6i h PHE 132 Ca 0.28 -0.05 -0.00 0.00 3.53 0.00 0.00 57.97 61.72 1k6i h PHE 132 Cb 0.03 -0.23 -0.01 0.00 2.79 0.00 0.00 35.95 38.53 1k6i h PHE 132 CO 0.01 0.61 0.16 1.15 -2.23 0.00 0.00 178.31 178.01 1k6i h THR 133 N 0.73 1.12 -0.67 4.41 2.02 -1.21 -0.91 112.91 118.41 1k6i h THR 133 Ca 0.17 -0.32 -0.02 0.00 0.77 0.00 0.00 66.41 67.02 1k6i h THR 133 Cb 0.20 0.80 -0.03 0.00 -1.74 0.00 0.00 68.15 67.38 1k6i h THR 133 CO -0.01 0.12 0.35 0.58 0.37 0.00 0.00 175.52 176.93 1k6i h VAL 134 N 0.36 1.21 -0.38 3.16 2.07 -1.01 -1.98 116.25 119.68 1k6i h VAL 134 Ca 0.10 -0.54 0.03 0.00 0.82 0.00 0.00 66.70 67.11 1k6i h VAL 134 Cb 0.05 0.32 -0.03 0.00 -1.52 0.00 0.00 31.29 30.11 1k6i h VAL 134 CO -0.02 0.23 0.19 -0.08 0.02 0.00 0.00 177.57 177.92 1k6i h GLU 135 N 0.94 0.38 -0.80 1.57 4.81 -0.04 -0.67 114.58 120.77 1k6i h GLU 135 Ca 0.24 -0.02 0.02 0.00 -0.13 0.00 0.00 59.36 59.47 1k6i h GLU 135 Cb 0.05 -0.08 -0.04 0.00 0.63 0.00 0.00 28.75 29.30 1k6i h GLU 135 CO -0.04 0.25 0.52 -0.91 -0.73 0.00 0.00 179.01 178.10 1k6i h ASN 136 N 0.39 0.87 0.02 1.04 -0.26 -0.52 -1.77 115.58 115.34 1k6i h ASN 136 Ca 0.16 -0.01 -0.00 0.00 -0.56 0.00 0.00 56.30 55.89 1k6i h ASN 136 Cb 0.07 -0.20 0.00 0.00 -1.06 0.00 0.00 38.32 37.13 1k6i h ASN 136 CO -0.11 0.61 -0.01 0.22 -1.06 0.00 0.00 177.43 177.08 1k6i h TYR 137 N 1.02 -0.02 -0.76 1.19 5.03 -0.81 -2.94 116.97 119.69 1k6i h TYR 137 Ca 0.31 -0.00 0.07 0.00 2.58 0.00 0.00 58.73 61.69 1k6i h TYR 137 Cb -0.04 0.01 -0.05 0.00 1.55 0.00 0.00 36.73 38.20 1k6i h TYR 137 CO -0.02 0.13 0.50 0.28 -1.32 0.00 0.00 178.16 177.72 1k6i h VAL 138 N -0.16 1.01 -0.14 1.81 2.07 -0.87 -1.52 116.25 118.45 1k6i h VAL 138 Ca -0.00 -0.27 0.04 0.00 0.82 0.00 0.00 66.70 67.29 1k6i h VAL 138 Cb 0.16 0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 30.09 1k6i h VAL 138 CO 0.00 0.14 0.10 0.03 0.02 0.00 0.00 177.57 177.86 1k6i h ARG 139 N 0.77 0.00 0.00 1.57 3.08 -1.14 -1.78 114.38 116.88 1k6i h ARG 139 Ca 0.33 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.38 1k6i h ARG 139 Cb 0.30 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.35 1k6i h ARG 139 CO -0.12 0.00 0.00 1.04 -1.07 0.00 0.00 179.97 179.82 1k6i n GLN 140 N -4.48 0.23 -2.82 0.04 3.00 -0.57 -4.86 117.38 107.92 1k6i n GLN 140 Ca 0.00 0.19 -0.35 0.00 -0.01 0.00 0.00 57.00 56.83 1k6i n GLN 140 Cb 0.22 -1.77 -0.07 0.00 0.00 0.00 0.00 30.24 28.63 1k6i n GLN 140 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 1k6i s LEU 141 N -4.35 4.19 0.00 1.08 1.43 -0.67 -4.92 118.68 115.44 1k6i s LEU 141 Ca 0.11 1.74 -0.03 0.00 -1.03 0.00 0.00 54.13 54.92 1k6i s LEU 141 Cb 0.13 -4.18 -0.14 0.00 0.03 0.00 0.00 46.19 42.03 1k6i s LEU 141 CO 0.59 -0.17 2.76 0.61 0.23 0.00 0.00 176.35 180.37 1k6i n GLY 142 N 0.11 2.66 3.03 -3.19 0.00 -1.26 -4.75 105.19 101.78 1k6i n GLY 142 Ca 0.04 -0.65 -0.24 0.00 0.00 0.00 0.00 46.02 45.17 1k6i n GLY 142 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1k6i s LEU 143 N 0.00 1.65 0.19 0.99 2.96 -1.26 -5.10 118.68 118.11 1k6i s LEU 143 Ca 0.36 -0.29 -0.32 0.00 -0.22 0.00 0.00 54.13 53.66 1k6i s LEU 143 Cb 0.17 -0.82 -0.12 0.00 0.50 0.00 0.00 46.19 45.93 1k6i s LEU 143 CO 0.00 0.04 1.76 -2.84 -1.32 0.00 0.00 176.35 173.99 1k6i s PRO 144 N 0.63 4.12 0.05 0.98 0.02 -1.26 -4.90 135.00 134.64 1k6i s PRO 144 Ca -0.14 2.62 0.02 0.00 0.02 0.00 0.00 61.00 63.52 1k6i s PRO 144 Cb -0.15 -3.22 -0.03 0.00 0.02 0.00 0.00 34.50 31.12 1k6i s PRO 144 CO 0.04 -0.79 -0.08 -1.54 -0.33 0.00 0.00 177.00 174.30 1k6i s SER 145 N 1.63 0.90 0.01 2.53 1.04 -1.26 -0.78 113.70 117.77 1k6i s SER 145 Ca 0.77 -0.58 0.01 0.00 0.48 0.00 0.00 55.95 56.63 1k6i s SER 145 Cb -0.49 0.04 -0.01 0.00 0.10 0.00 0.00 66.02 65.66 1k6i s SER 145 CO 0.33 -0.21 -0.03 -0.89 0.98 0.00 0.00 173.24 173.42 1k6i s THR 146 N -1.50 0.20 -0.16 2.02 2.01 -0.45 0.07 115.64 117.82 1k6i s THR 146 Ca -0.09 -0.36 0.00 0.00 0.31 0.00 0.00 61.69 61.56 1k6i s THR 146 Cb -0.09 -0.22 0.00 0.00 0.01 0.00 0.00 72.50 72.20 1k6i s THR 146 CO 0.00 -0.11 -0.16 -0.36 -0.69 0.00 0.00 174.62 173.30 1k6i s PHE 147 N -0.47 2.78 -0.10 4.92 0.08 0.04 -0.80 117.98 124.43 1k6i s PHE 147 Ca -0.04 -1.19 -0.02 0.00 0.12 0.00 0.00 56.93 55.80 1k6i s PHE 147 Cb -0.04 -1.90 -0.03 0.00 -0.57 0.00 0.00 43.02 40.48 1k6i s PHE 147 CO -0.00 -0.56 0.00 0.14 -0.10 0.00 0.00 175.22 174.70 1k6i s VAL 148 N 0.97 4.33 -0.34 -0.44 -7.23 -0.72 -0.23 120.40 116.74 1k6i s VAL 148 Ca -0.03 -0.23 -0.05 0.00 -1.81 0.00 0.00 61.98 59.86 1k6i s VAL 148 Cb -0.15 -2.84 0.05 0.00 0.56 0.00 0.00 36.38 34.01 1k6i s VAL 148 CO -0.03 0.59 0.10 -0.31 -0.31 0.00 0.00 175.10 175.14 1k6i s TYR 149 N -0.71 3.29 0.14 2.82 2.02 0.54 -1.00 117.35 124.46 1k6i s TYR 149 Ca 0.11 -1.61 -0.30 0.00 -0.37 0.00 0.00 57.07 54.90 1k6i s TYR 149 Cb -0.12 -2.36 -0.07 0.00 -0.40 0.00 0.00 41.96 39.02 1k6i s TYR 149 CO 0.02 -0.77 1.09 0.00 -1.57 0.00 0.00 175.55 174.31 1k6i s ALA 150 N 1.35 3.34 0.93 3.71 0.00 -1.26 0.57 121.76 130.41 1k6i s ALA 150 Ca -0.01 0.77 -0.15 0.00 0.00 0.00 0.00 51.96 52.57 1k6i s ALA 150 Cb -0.20 -3.35 0.17 0.00 0.00 0.00 0.00 23.12 19.74 1k6i s ALA 150 CO 0.01 -0.21 1.26 0.20 0.00 0.00 0.00 175.76 177.02 1k6i s GLY 151 N 0.11 1.70 0.24 0.00 0.00 -0.56 -4.92 107.32 103.90 1k6i s GLY 151 Ca 0.50 -0.99 -0.31 0.00 0.00 0.00 0.00 44.72 43.92 1k6i s GLY 151 CO 0.33 -0.31 1.57 -0.42 0.00 0.00 0.00 173.10 174.27 1k6i s ILE 152 N -3.71 2.34 0.07 0.90 1.01 0.46 -4.49 121.20 117.77 1k6i s ILE 152 Ca 0.70 0.27 -0.31 0.00 0.00 0.00 0.00 60.65 61.31 1k6i s ILE 152 Cb -0.07 -3.17 -0.06 0.00 0.01 0.00 0.00 42.46 39.17 1k6i s ILE 152 CO 0.52 0.03 1.23 -0.31 0.00 0.00 0.00 174.94 176.41 1k6i s TYR 153 N 0.42 3.41 0.22 3.97 2.02 -1.26 0.41 117.35 126.54 1k6i s TYR 153 Ca 0.65 1.25 -0.08 0.00 -0.37 0.00 0.00 57.07 58.53 1k6i s TYR 153 Cb -0.46 -3.46 0.30 0.00 -0.40 0.00 0.00 41.96 37.95 1k6i s TYR 153 CO 0.41 -1.44 1.79 -0.91 -1.57 0.00 0.00 175.55 173.83 1k6i h ASN 154 N 6.81 0.48 0.00 2.29 2.35 -0.95 -2.02 115.58 124.55 1k6i h ASN 154 Ca -0.42 0.05 0.00 0.00 -0.55 0.00 0.00 56.30 55.39 1k6i h ASN 154 Cb 1.21 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 39.55 1k6i h ASN 154 CO 0.82 0.29 0.00 -0.46 -1.65 0.00 0.00 177.43 176.43 1k6i n ASN 155 N -4.84 0.84 0.18 5.81 6.94 -1.26 -2.49 115.26 120.44 1k6i n ASN 155 Ca 0.10 -1.84 0.04 0.00 -0.02 0.00 0.00 54.58 52.86 1k6i n ASN 155 Cb 0.24 -0.42 0.29 0.00 -2.36 0.00 0.00 39.78 37.53 1k6i n ASN 155 CO 0.00 0.00 0.00 0.78 -1.03 0.00 0.00 177.26 177.01 1k6i h ASN 156 N 0.07 0.00 -2.80 0.53 2.35 -1.73 -3.44 115.58 110.56 1k6i h ASN 156 Ca 0.00 0.00 -0.52 0.00 -0.55 0.00 0.00 56.30 55.23 1k6i h ASN 156 Cb 0.42 0.00 0.04 0.00 0.05 0.00 0.00 38.32 38.83 1k6i h ASN 156 CO 0.00 0.43 0.90 -0.36 -1.65 0.00 0.00 177.43 176.75 1k6i s PHE 157 N -3.60 3.01 0.08 1.19 0.08 -1.04 -4.79 117.98 112.92 1k6i s PHE 157 Ca -0.00 0.59 -0.21 0.00 0.12 0.00 0.00 56.93 57.43 1k6i s PHE 157 Cb 0.11 -3.94 0.05 0.00 -0.57 0.00 0.00 43.02 38.67 1k6i s PHE 157 CO 0.70 -3.51 0.50 -0.08 -0.10 0.00 0.00 175.22 172.74 1k6i s THR 158 N 1.25 0.03 -1.64 0.64 -1.32 -1.13 -4.97 115.64 108.51 1k6i s THR 158 Ca 0.71 -0.28 0.25 0.00 -1.21 0.00 0.00 61.69 61.16 1k6i s THR 158 Cb -0.44 -1.02 0.14 0.00 -1.51 0.00 0.00 72.50 69.67 1k6i s THR 158 CO 0.31 -0.16 1.41 -1.54 -2.21 0.00 0.00 174.62 172.44 1k6i n SER 159 N 0.14 1.13 -4.75 8.08 3.41 -1.26 -0.35 113.62 120.01 1k6i n SER 159 Ca -0.18 -0.91 -0.36 0.00 -0.26 0.00 0.00 58.87 57.16 1k6i n SER 159 Cb 0.62 0.27 0.04 0.00 -0.26 0.00 0.00 64.21 64.88 1k6i n SER 159 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1k6i s LEU 160 N -2.61 3.64 -0.02 1.04 1.43 -1.26 -4.71 118.68 116.19 1k6i s LEU 160 Ca 0.20 2.39 -0.03 0.00 -1.03 0.00 0.00 54.13 55.66 1k6i s LEU 160 Cb 0.19 -4.60 -0.15 0.00 0.03 0.00 0.00 46.19 41.66 1k6i s LEU 160 CO 0.58 -1.64 2.27 -0.81 0.23 0.00 0.00 176.35 176.98 1k6i n PRO 161 N -1.66 1.16 -3.75 1.29 -0.04 -1.26 -4.78 135.00 125.96 1k6i n PRO 161 Ca 0.14 -0.59 -0.36 0.00 -0.04 0.00 0.00 63.50 62.65 1k6i n PRO 161 Cb 0.50 -1.80 -0.06 0.00 -0.04 0.00 0.00 33.50 32.10 1k6i n PRO 161 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1k6i s TYR 162 N 1.90 3.62 0.56 0.54 2.02 -1.26 -4.07 117.35 120.67 1k6i s TYR 162 Ca 0.38 0.65 -0.18 0.00 -0.37 0.00 0.00 57.07 57.55 1k6i s TYR 162 Cb 0.18 -2.04 -0.09 0.00 -0.40 0.00 0.00 41.96 39.62 1k6i s TYR 162 CO -0.00 0.67 0.57 -2.30 -1.57 0.00 0.00 175.55 172.91 1k6i n PRO 163 N 1.60 0.55 0.00 -1.71 -0.02 -1.26 -3.76 135.00 130.40 1k6i n PRO 163 Ca -0.15 0.22 0.00 0.00 -2.02 0.00 0.00 63.50 61.54 1k6i n PRO 163 Cb 0.54 -1.73 0.00 0.00 -0.02 0.00 0.00 33.50 32.28 1k6i n PRO 163 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 1k6i n LEU 164 N 0.43 0.00 -2.12 2.45 7.94 -1.26 -4.46 117.00 119.98 1k6i n LEU 164 Ca 0.12 0.00 -0.26 0.00 -1.11 0.00 0.00 56.01 54.76 1k6i n LEU 164 Cb 0.47 0.00 0.02 0.00 0.53 0.00 0.00 43.42 44.44 1k6i n LEU 164 CO 0.51 0.00 0.32 0.49 -1.11 0.00 0.00 177.39 177.60 1k6i n PHE 165 N 0.00 2.89 -3.10 1.96 3.72 -1.26 -4.71 117.46 116.96 1k6i n PHE 165 Ca 0.00 -2.42 -0.39 0.00 -0.05 0.00 0.00 57.45 54.59 1k6i n PHE 165 Cb 0.00 -0.42 -0.05 0.00 -0.94 0.00 0.00 39.48 38.07 1k6i n PHE 165 CO 0.00 0.00 0.00 -1.14 -0.05 0.00 0.00 176.76 175.57 1k6i s GLN 166 N -3.62 4.41 -1.07 -1.08 0.74 -1.25 -2.84 119.66 114.96 1k6i s GLN 166 Ca 0.52 0.82 -0.07 0.00 0.05 0.00 0.00 55.36 56.68 1k6i s GLN 166 Cb 0.42 -3.42 0.27 0.00 1.10 0.00 0.00 33.01 31.37 1k6i s GLN 166 CO -0.00 0.14 1.06 -0.12 -0.55 0.00 0.00 175.29 175.81 1k6i n MET 167 N 3.54 3.37 -1.90 1.67 0.00 0.52 -4.18 117.12 120.15 1k6i n MET 167 Ca -0.03 -4.47 -0.42 0.00 -0.00 0.00 0.00 57.70 52.78 1k6i n MET 167 Cb 0.51 -2.52 -0.03 0.00 0.00 0.00 0.00 33.22 31.19 1k6i n MET 167 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 175.97 173.97 1k6i s GLU 168 N -1.37 4.19 -0.23 2.12 2.12 -0.33 -4.11 118.70 121.08 1k6i s GLU 168 Ca 0.30 2.37 -0.25 0.00 0.36 0.00 0.00 54.97 57.75 1k6i s GLU 168 Cb -0.09 -3.58 -0.00 0.00 0.26 0.00 0.00 34.13 30.72 1k6i s GLU 168 CO -0.08 -0.74 0.86 -1.17 -0.54 0.00 0.00 175.26 173.58 1k6i s LEU 169 N 2.59 4.10 0.44 2.70 2.96 -1.26 -0.74 118.68 129.46 1k6i s LEU 169 Ca 0.75 1.11 -0.03 0.00 -0.22 0.00 0.00 54.13 55.74 1k6i s LEU 169 Cb -0.41 -3.25 -0.03 0.00 0.50 0.00 0.00 46.19 43.00 1k6i s LEU 169 CO 0.33 -0.52 0.70 -0.04 -1.32 0.00 0.00 176.35 175.49 1k6i s MET 170 N 2.80 3.45 0.54 1.98 -1.94 0.82 -4.97 119.30 121.99 1k6i s MET 170 Ca 0.37 -0.05 0.30 0.00 -1.71 0.00 0.00 55.69 54.61 1k6i s MET 170 Cb -0.15 -2.48 1.47 0.00 2.01 0.00 0.00 34.83 35.67 1k6i s MET 170 CO 0.08 -0.11 1.90 -1.35 -0.01 0.00 0.00 175.02 175.52 1k6i h PRO 171 N 0.40 0.00 -0.28 2.03 0.11 -1.97 -0.68 132.00 131.61 1k6i h PRO 171 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1k6i h PRO 171 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1k6i h PRO 171 CO 0.61 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 178.00 1k6i n ASP 172 N -4.19 1.71 0.00 -2.05 5.75 -1.26 -4.91 116.55 111.60 1k6i n ASP 172 Ca 0.16 -1.90 0.00 0.00 -0.01 0.00 0.00 54.79 53.04 1k6i n ASP 172 Cb 0.88 -0.18 0.00 0.00 -1.03 0.00 0.00 41.12 40.79 1k6i n ASP 172 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1k6i n GLY 173 N 1.06 0.84 3.94 6.12 0.00 -0.26 -5.04 105.19 111.83 1k6i n GLY 173 Ca 0.13 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.90 1k6i n GLY 173 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1k6i s THR 174 N -3.33 4.46 0.04 2.61 -4.23 -1.26 -4.80 115.64 109.12 1k6i s THR 174 Ca 0.00 -0.27 0.08 0.00 -1.18 0.00 0.00 61.69 60.32 1k6i s THR 174 Cb 0.00 -3.67 -0.03 0.00 1.34 0.00 0.00 72.50 70.15 1k6i s THR 174 CO 0.00 -0.53 -0.23 -0.36 -0.54 0.00 0.00 174.62 172.96 1k6i s PHE 175 N -2.58 2.41 -0.03 3.99 0.08 -0.53 -0.13 117.98 121.19 1k6i s PHE 175 Ca 0.46 -0.36 0.01 0.00 0.12 0.00 0.00 56.93 57.17 1k6i s PHE 175 Cb -0.10 -1.42 0.02 0.00 -0.57 0.00 0.00 43.02 40.95 1k6i s PHE 175 CO 0.40 0.16 -0.03 -1.21 -0.10 0.00 0.00 175.22 174.45 1k6i s GLU 176 N -1.27 0.57 -0.25 0.44 2.02 0.08 -1.76 118.70 118.53 1k6i s GLU 176 Ca 0.13 -0.04 -0.06 0.00 0.02 0.00 0.00 54.97 55.02 1k6i s GLU 176 Cb -0.10 -0.64 -0.01 0.00 0.10 0.00 0.00 34.13 33.47 1k6i s GLU 176 CO 0.03 -0.08 0.03 -0.46 0.02 0.00 0.00 175.26 174.80 1k6i s TRP 177 N 0.84 3.05 -0.19 1.61 -0.00 -0.79 -1.19 118.94 122.26 1k6i s TRP 177 Ca -0.10 -0.72 -0.05 0.00 -0.00 0.00 0.00 56.10 55.23 1k6i s TRP 177 Cb -0.13 -2.19 -0.03 0.00 -0.00 0.00 0.00 33.47 31.12 1k6i s TRP 177 CO -0.01 -0.47 0.00 -1.01 -0.00 0.00 0.00 176.95 175.47 1k6i s HIS 178 N 1.54 3.06 0.17 5.86 3.76 -1.26 -0.85 115.29 127.56 1k6i s HIS 178 Ca 0.05 -0.38 -0.19 0.00 -0.15 0.00 0.00 55.06 54.39 1k6i s HIS 178 Cb -0.15 -2.07 0.04 0.00 1.11 0.00 0.00 32.58 31.52 1k6i s HIS 178 CO 0.01 -0.18 0.52 0.00 -0.85 0.00 0.00 174.74 174.25 1k6i s ALA 179 N 0.86 -1.19 -1.09 -1.40 0.00 -1.02 -4.75 121.76 113.17 1k6i s ALA 179 Ca 0.01 0.08 0.27 0.00 0.00 0.00 0.00 51.96 52.32 1k6i s ALA 179 Cb -0.14 0.82 1.21 0.00 0.00 0.00 0.00 23.12 25.01 1k6i s ALA 179 CO 0.02 -0.76 1.89 -2.30 0.00 0.00 0.00 175.76 174.61 1k6i n PRO 180 N -0.33 0.08 -1.74 0.00 -0.02 -1.09 -0.52 135.00 131.39 1k6i n PRO 180 Ca -0.14 0.03 -0.42 0.00 -2.02 0.00 0.00 63.50 60.95 1k6i n PRO 180 Cb 0.64 -1.50 -0.02 0.00 -0.02 0.00 0.00 33.50 32.60 1k6i n PRO 180 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1k6i n PHE 181 N -1.46 2.83 -1.72 6.00 3.72 -1.26 -3.91 117.46 121.66 1k6i n PHE 181 Ca 0.08 0.27 -0.43 0.00 -0.05 0.00 0.00 57.45 57.33 1k6i n PHE 181 Cb 0.30 -2.59 -0.02 0.00 -0.94 0.00 0.00 39.48 36.23 1k6i n PHE 181 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1k6i n ASP 182 N 2.08 3.62 -0.08 4.37 -0.08 -1.26 -4.77 116.55 120.42 1k6i n ASP 182 Ca 0.08 1.13 0.26 0.00 -1.51 0.00 0.00 54.79 54.76 1k6i n ASP 182 Cb 0.37 -1.55 0.71 0.00 2.34 0.00 0.00 41.12 42.99 1k6i n ASP 182 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1k6i h PRO 183 N 4.93 0.00 -0.00 -0.67 0.11 -1.95 -3.16 132.00 131.26 1k6i h PRO 183 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1k6i h PRO 183 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1k6i h PRO 183 CO 0.81 0.00 -0.12 -0.25 -0.21 0.00 0.00 178.00 178.22 1k6i n ASP 184 N -3.95 0.58 -4.68 -2.05 8.00 -1.26 -2.38 116.55 110.81 1k6i n ASP 184 Ca 0.15 -0.79 -0.43 0.00 0.71 0.00 0.00 54.79 54.43 1k6i n ASP 184 Cb 0.89 0.67 -0.02 0.00 -0.02 0.00 0.00 41.12 42.63 1k6i n ASP 184 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1k6i s ILE 185 N -1.04 4.65 0.32 0.53 1.01 -1.19 -4.71 121.20 120.77 1k6i s ILE 185 Ca 0.03 1.95 -0.29 0.00 0.00 0.00 0.00 60.65 62.33 1k6i s ILE 185 Cb 0.03 -4.25 -0.10 0.00 0.01 0.00 0.00 42.46 38.15 1k6i s ILE 185 CO 0.13 -0.04 1.37 -2.16 0.00 0.00 0.00 174.94 174.24 1k6i s PRO 186 N 2.35 4.29 0.22 2.79 0.04 -1.26 -4.27 135.00 139.17 1k6i s PRO 186 Ca 0.49 2.30 0.09 0.00 0.04 0.00 0.00 61.00 63.92 1k6i s PRO 186 Cb -0.19 -3.07 -0.04 0.00 0.04 0.00 0.00 34.50 31.24 1k6i s PRO 186 CO 0.16 -0.31 -0.07 -0.51 0.04 0.00 0.00 177.00 176.31 1k6i s LEU 187 N -1.45 3.01 -0.16 -3.56 1.43 0.97 -4.79 118.68 114.13 1k6i s LEU 187 Ca 0.52 -0.66 -0.22 0.00 -1.03 0.00 0.00 54.13 52.75 1k6i s LEU 187 Cb -0.41 -1.61 -0.03 0.00 0.03 0.00 0.00 46.19 44.17 1k6i s LEU 187 CO 0.52 0.06 0.69 -2.16 0.23 0.00 0.00 176.35 175.68 1k6i s PRO 188 N -3.22 4.29 0.34 1.29 0.04 -1.26 -1.09 135.00 135.40 1k6i s PRO 188 Ca 0.28 0.76 0.08 0.00 0.04 0.00 0.00 61.00 62.16 1k6i s PRO 188 Cb -0.07 -3.54 -0.04 0.00 0.04 0.00 0.00 34.50 30.89 1k6i s PRO 188 CO 0.17 -0.17 0.21 -1.58 0.04 0.00 0.00 177.00 175.67 1k6i s TRP 189 N 1.65 2.79 -0.23 0.56 0.52 -0.67 -0.40 118.94 123.16 1k6i s TRP 189 Ca 0.33 -0.35 -0.13 0.00 0.02 0.00 0.00 56.10 55.97 1k6i s TRP 189 Cb -0.16 -1.72 0.07 0.00 -1.15 0.00 0.00 33.47 30.51 1k6i s TRP 189 CO 0.13 0.26 0.56 -1.17 0.02 0.00 0.00 176.95 176.75 1k6i s LEU 190 N -3.91 -0.59 -0.94 2.99 0.20 0.16 -3.03 118.68 113.56 1k6i s LEU 190 Ca 0.39 1.24 -0.18 0.00 0.69 0.00 0.00 54.13 56.28 1k6i s LEU 190 Cb -0.04 1.92 0.14 0.00 -0.43 0.00 0.00 46.19 47.78 1k6i s LEU 190 CO 0.24 -0.22 1.11 -0.62 -0.29 0.00 0.00 176.35 176.58 1k6i s ASP 191 N 1.63 6.68 0.12 3.68 -1.08 -1.26 -0.21 116.67 126.23 1k6i s ASP 191 Ca -0.09 -2.19 -0.27 0.00 -0.52 0.00 0.00 52.55 49.48 1k6i s ASP 191 Cb -0.07 -2.38 -0.07 0.00 -1.46 0.00 0.00 42.92 38.94 1k6i s ASP 191 CO -0.17 -0.99 1.62 0.00 0.52 0.00 0.00 175.17 176.16 1k6i h ALA 192 N 8.60 -0.47 -0.40 3.66 0.00 -1.94 0.30 119.26 129.00 1k6i h ALA 192 Ca 0.16 -0.03 0.08 0.00 0.00 0.00 0.00 54.91 55.12 1k6i h ALA 192 Cb 1.01 0.52 -0.09 0.00 0.00 0.00 0.00 17.79 19.23 1k6i h ALA 192 CO 1.08 -0.83 -0.37 1.49 0.00 0.00 0.00 179.25 180.63 1k6i h GLU 193 N -0.49 -0.27 0.02 0.00 4.81 -1.90 -2.65 114.58 114.10 1k6i h GLU 193 Ca 0.05 0.02 -0.28 0.00 -0.13 0.00 0.00 59.36 59.01 1k6i h GLU 193 Cb 0.55 0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.95 1k6i h GLU 193 CO -0.22 -0.18 -1.59 0.45 -0.73 0.00 0.00 179.01 176.74 1k6i h HIS 194 N -0.28 0.07 0.00 0.92 3.86 -1.96 -3.43 115.15 114.33 1k6i h HIS 194 Ca 0.16 -0.05 0.00 0.00 -1.16 0.00 0.00 60.37 59.32 1k6i h HIS 194 Cb 0.56 -0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.03 1k6i h HIS 194 CO -0.57 1.08 -1.53 -0.25 0.86 0.00 0.00 177.93 177.52 1k6i n ASP 195 N -3.16 1.71 0.04 2.45 8.00 0.09 -4.49 116.55 121.19 1k6i n ASP 195 Ca -0.15 -0.08 -0.13 0.00 0.71 0.00 0.00 54.79 55.14 1k6i n ASP 195 Cb 1.03 1.57 -0.08 0.00 -0.02 0.00 0.00 41.12 43.62 1k6i n ASP 195 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 1k6i h VAL 196 N 0.00 1.10 -0.05 2.53 2.07 -1.53 -2.98 116.25 117.39 1k6i h VAL 196 Ca 0.00 -0.52 0.04 0.00 0.82 0.00 0.00 66.70 67.04 1k6i h VAL 196 Cb 0.60 1.44 -0.06 0.00 -1.52 0.00 0.00 31.29 31.75 1k6i h VAL 196 CO 0.00 0.13 -0.40 1.23 0.02 0.00 0.00 177.57 178.55 1k6i h GLY 197 N -0.31 -0.69 0.90 2.17 0.00 -1.76 -1.57 103.07 101.81 1k6i h GLY 197 Ca -0.01 0.48 0.05 0.00 0.00 0.00 0.00 47.33 47.85 1k6i h GLY 197 CO 0.01 -0.24 0.62 -2.55 0.00 0.00 0.00 176.54 174.38 1k6i h PRO 198 N -0.52 1.12 -0.06 4.80 0.11 -1.79 -1.76 132.00 133.90 1k6i h PRO 198 Ca 0.06 -0.07 -0.01 0.00 0.11 0.00 0.00 66.00 66.10 1k6i h PRO 198 Cb 0.62 -0.25 -0.00 0.00 0.11 0.00 0.00 31.00 31.48 1k6i h PRO 198 CO -0.33 0.74 0.01 0.00 -0.21 0.00 0.00 178.00 178.20 1k6i h ALA 199 N 1.46 0.08 -0.90 -0.75 0.00 -1.31 -2.17 119.26 115.68 1k6i h ALA 199 Ca 0.39 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 1k6i h ALA 199 Cb 0.08 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.80 1k6i h ALA 199 CO -0.13 -0.27 0.51 -0.07 0.00 0.00 0.00 179.25 179.28 1k6i h LEU 200 N -0.15 1.12 -1.30 0.00 3.38 -1.14 -2.19 115.31 115.02 1k6i h LEU 200 Ca 0.02 -0.09 -0.04 0.00 0.09 0.00 0.00 57.88 57.85 1k6i h LEU 200 Cb 0.29 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 1k6i h LEU 200 CO 0.00 0.89 0.02 -0.07 0.09 0.00 0.00 178.44 179.36 1k6i h LEU 201 N 1.26 0.45 -0.67 1.67 3.38 -1.22 -2.03 115.31 118.15 1k6i h LEU 201 Ca 0.32 -0.08 -0.14 0.00 0.09 0.00 0.00 57.88 58.08 1k6i h LEU 201 Cb 0.01 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1k6i h LEU 201 CO -0.05 0.51 -0.44 -0.61 0.09 0.00 0.00 178.44 177.94 1k6i h GLN 202 N 0.47 0.51 -0.51 1.13 5.75 -0.81 0.13 115.11 121.79 1k6i h GLN 202 Ca 0.11 -0.27 0.01 0.00 -0.15 0.00 0.00 58.65 58.34 1k6i h GLN 202 Cb 0.28 0.01 -0.03 0.00 1.07 0.00 0.00 27.48 28.82 1k6i h GLN 202 CO 0.01 0.85 0.34 0.82 -2.65 0.00 0.00 178.83 178.20 1k6i h ILE 203 N 0.42 1.13 -0.67 2.39 2.04 -0.83 0.15 117.51 122.13 1k6i h ILE 203 Ca 0.03 -0.24 -0.07 0.00 1.00 0.00 0.00 64.86 65.59 1k6i h ILE 203 Cb 0.94 0.38 -0.03 0.00 -0.74 0.00 0.00 36.82 37.37 1k6i h ILE 203 CO 0.08 0.13 0.15 -0.26 0.00 0.00 0.00 178.15 178.24 1k6i h PHE 204 N 0.69 1.13 -0.57 1.37 0.05 -1.05 -1.97 116.94 116.58 1k6i h PHE 204 Ca 0.19 -0.14 -0.07 0.00 3.82 0.00 0.00 57.97 61.77 1k6i h PHE 204 Cb -0.08 -0.32 -0.02 0.00 2.00 0.00 0.00 35.95 37.53 1k6i h PHE 204 CO -0.04 0.93 0.09 0.87 -0.18 0.00 0.00 178.31 179.99 1k6i h LYS 205 N 1.02 0.94 -0.71 1.51 1.57 -0.35 -2.86 116.57 117.69 1k6i h LYS 205 Ca 0.21 -0.25 -0.03 0.00 -1.87 0.00 0.00 60.65 58.71 1k6i h LYS 205 Cb 0.38 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.55 1k6i h LYS 205 CO 0.00 0.90 0.34 -0.44 -0.57 0.00 0.00 179.45 179.68 1k6i h ASP 206 N 0.84 0.93 -5.00 0.86 3.45 -0.55 -3.49 116.42 113.46 1k6i h ASP 206 Ca 0.17 -0.14 0.00 0.00 0.43 0.00 0.00 57.03 57.50 1k6i h ASP 206 Cb 0.41 -0.24 0.00 0.00 -0.56 0.00 0.00 39.33 38.94 1k6i h ASP 206 CO 0.01 0.81 0.00 0.61 -1.57 0.00 0.00 179.24 179.10 1k6i n GLY 207 N -0.96 1.65 0.19 2.75 0.00 -0.76 -4.63 105.19 103.43 1k6i n GLY 207 Ca 0.06 -1.99 0.00 0.00 0.00 0.00 0.00 46.02 44.09 1k6i n GLY 207 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1k6i h PRO 208 N 0.00 0.11 -0.42 1.61 0.13 -1.86 -2.74 132.00 128.83 1k6i h PRO 208 Ca 0.00 -0.05 -0.07 0.00 -0.87 0.00 0.00 66.00 65.01 1k6i h PRO 208 Cb 0.00 -0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.11 1k6i h PRO 208 CO 0.00 0.49 -0.04 1.96 -0.23 0.00 0.00 178.00 180.19 1k6i h GLN 209 N 0.09 0.70 0.10 0.86 4.20 -1.96 0.35 115.11 119.44 1k6i h GLN 209 Ca 0.01 -0.19 -0.29 0.00 0.06 0.00 0.00 58.65 58.24 1k6i h GLN 209 Cb 0.75 -0.08 0.02 0.00 0.30 0.00 0.00 27.48 28.47 1k6i h GLN 209 CO 0.06 0.74 -1.19 -0.22 -0.67 0.00 0.00 178.83 177.54 1k6i h LYS 210 N 0.65 0.58 -0.09 1.46 3.64 -1.80 -3.38 116.57 117.63 1k6i h LYS 210 Ca 0.13 -0.75 0.00 0.00 -1.27 0.00 0.00 60.65 58.76 1k6i h LYS 210 Cb 0.46 0.24 0.00 0.00 -0.41 0.00 0.00 32.23 32.52 1k6i h LYS 210 CO 0.02 1.33 0.00 0.91 -2.27 0.00 0.00 179.45 179.44 1k6i n TRP 211 N -3.77 0.09 -1.70 1.91 7.02 -1.04 -4.92 117.44 115.03 1k6i n TRP 211 Ca -0.12 -0.08 -0.43 0.00 -1.02 0.00 0.00 57.50 55.86 1k6i n TRP 211 Cb 0.96 -0.00 -0.03 0.00 -2.42 0.00 0.00 31.31 29.82 1k6i n TRP 211 CO 0.00 0.00 0.00 -1.71 -2.02 0.00 0.00 177.69 173.96 1k6i n ASN 212 N 0.81 3.96 0.00 -0.99 5.15 0.12 -1.61 115.26 122.71 1k6i n ASN 212 Ca 0.09 1.03 0.00 0.00 -0.60 0.00 0.00 54.58 55.10 1k6i n ASN 212 Cb 0.38 -1.55 0.00 0.00 -0.53 0.00 0.00 39.78 38.08 1k6i n ASN 212 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1k6i n GLY 213 N 4.07 2.22 3.83 8.20 0.00 0.11 -4.95 105.19 118.67 1k6i n GLY 213 Ca 0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 1k6i n GLY 213 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1k6i s HIS 214 N -2.65 3.33 -0.14 1.61 3.76 -0.64 -4.89 115.29 115.67 1k6i s HIS 214 Ca 0.00 1.48 -0.00 0.00 -0.15 0.00 0.00 55.06 56.39 1k6i s HIS 214 Cb 0.00 -2.85 -0.01 0.00 1.11 0.00 0.00 32.58 30.83 1k6i s HIS 214 CO 0.00 -0.55 -0.13 1.03 -0.85 0.00 0.00 174.74 174.25 1k6i s ARG 215 N -4.02 3.37 -0.09 1.40 0.52 -1.26 -0.78 118.95 118.09 1k6i s ARG 215 Ca 0.60 -0.69 0.03 0.00 -0.52 0.00 0.00 55.73 55.16 1k6i s ARG 215 Cb -0.11 -2.66 0.01 0.00 0.52 0.00 0.00 34.95 32.70 1k6i s ARG 215 CO 0.32 0.17 -0.20 0.42 0.02 0.00 0.00 175.30 176.03 1k6i s ILE 216 N 0.46 1.75 -0.37 1.52 1.01 0.68 -4.97 121.20 121.28 1k6i s ILE 216 Ca -0.09 -0.83 -0.25 0.00 0.00 0.00 0.00 60.65 59.47 1k6i s ILE 216 Cb -0.16 -1.54 0.01 0.00 0.01 0.00 0.00 42.46 40.79 1k6i s ILE 216 CO 0.05 0.49 0.88 0.00 0.00 0.00 0.00 174.94 176.36 1k6i s ALA 217 N 0.50 3.42 -1.26 9.38 0.00 -1.26 -0.34 121.76 132.19 1k6i s ALA 217 Ca -0.16 -0.51 -0.16 0.00 0.00 0.00 0.00 51.96 51.13 1k6i s ALA 217 Cb -0.17 -3.48 0.12 0.00 0.00 0.00 0.00 23.12 19.58 1k6i s ALA 217 CO 0.06 -1.56 1.62 1.28 0.00 0.00 0.00 175.76 177.17 1k6i n LEU 218 N 6.65 5.15 -3.74 0.00 4.77 0.19 -4.35 117.00 125.67 1k6i n LEU 218 Ca 0.06 -4.18 -0.12 0.00 -0.03 0.00 0.00 56.01 51.74 1k6i n LEU 218 Cb 0.48 -1.68 -0.11 0.00 -2.33 0.00 0.00 43.42 39.78 1k6i n LEU 218 CO 0.57 0.45 -0.00 0.28 -1.33 0.00 0.00 177.39 177.35 1k6i s THR 219 N 2.95 -0.01 -0.86 -5.08 -1.32 -1.26 -1.50 115.64 108.56 1k6i s THR 219 Ca 0.49 0.04 0.09 0.00 -1.21 0.00 0.00 61.69 61.09 1k6i s THR 219 Cb 0.01 -0.48 0.01 0.00 -1.51 0.00 0.00 72.50 70.53 1k6i s THR 219 CO 0.04 0.02 0.62 0.49 -2.21 0.00 0.00 174.62 173.57 1k6i n PHE 220 N 3.32 0.00 -3.63 9.09 3.72 -1.17 -4.53 117.46 124.27 1k6i n PHE 220 Ca -0.17 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.12 1k6i n PHE 220 Cb 0.57 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 39.04 1k6i n PHE 220 CO 0.00 0.00 0.00 -1.83 -0.05 0.00 0.00 176.76 174.88 1k6i s GLU 221 N -1.22 0.67 -0.11 -1.08 -1.05 -1.26 -4.96 118.70 109.70 1k6i s GLU 221 Ca 0.08 0.75 -0.01 0.00 -0.15 0.00 0.00 54.97 55.63 1k6i s GLU 221 Cb 0.07 0.32 -0.03 0.00 -0.44 0.00 0.00 34.13 34.06 1k6i s GLU 221 CO 0.22 -0.09 -0.05 0.95 0.95 0.00 0.00 175.26 177.24 1k6i s THR 222 N 0.21 3.87 -0.10 1.83 -4.23 -1.26 -1.67 115.64 114.30 1k6i s THR 222 Ca 0.01 -0.39 -0.07 0.00 -1.18 0.00 0.00 61.69 60.06 1k6i s THR 222 Cb -0.05 -2.64 0.03 0.00 1.34 0.00 0.00 72.50 71.19 1k6i s THR 222 CO -0.02 0.56 0.24 -0.76 -0.54 0.00 0.00 174.62 174.09 1k6i s LEU 223 N -0.34 0.82 0.72 4.79 1.43 -0.25 -4.83 118.68 121.02 1k6i s LEU 223 Ca 0.05 0.50 -0.11 0.00 -1.03 0.00 0.00 54.13 53.54 1k6i s LEU 223 Cb -0.12 0.78 0.02 0.00 0.03 0.00 0.00 46.19 46.90 1k6i s LEU 223 CO 0.02 -0.12 1.08 -0.94 0.23 0.00 0.00 176.35 176.63 1k6i s SER 224 N 0.58 5.25 0.31 2.29 1.04 -1.26 -0.02 113.70 121.88 1k6i s SER 224 Ca -0.04 1.34 0.04 0.00 0.48 0.00 0.00 55.95 57.77 1k6i s SER 224 Cb -0.05 -2.18 0.64 0.00 0.10 0.00 0.00 66.02 64.53 1k6i s SER 224 CO -0.03 -1.49 1.85 -0.65 0.98 0.00 0.00 173.24 173.90 1k6i h PRO 225 N -0.75 0.87 -0.81 4.02 0.11 -1.74 0.82 132.00 134.51 1k6i h PRO 225 Ca -0.45 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 65.58 1k6i h PRO 225 Cb 1.24 -0.20 -0.04 0.00 0.11 0.00 0.00 31.00 32.11 1k6i h PRO 225 CO 0.60 0.58 0.41 0.28 -0.21 0.00 0.00 178.00 179.66 1k6i h VAL 226 N 0.90 1.25 -0.01 3.15 2.07 -1.80 -1.07 116.25 120.74 1k6i h VAL 226 Ca 0.47 -0.66 -0.13 0.00 0.82 0.00 0.00 66.70 67.20 1k6i h VAL 226 Cb 0.55 0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 1k6i h VAL 226 CO -0.24 0.29 -0.62 1.56 0.02 0.00 0.00 177.57 178.58 1k6i h GLN 227 N 1.15 0.02 0.09 1.57 4.20 -1.18 -2.63 115.11 118.33 1k6i h GLN 227 Ca 0.28 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.97 1k6i h GLN 227 Cb 0.08 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.86 1k6i h GLN 227 CO -0.04 0.63 -0.04 0.28 -0.67 0.00 0.00 178.83 178.99 1k6i h VAL 228 N 0.02 1.12 -0.71 -0.54 2.07 -0.54 -2.43 116.25 115.24 1k6i h VAL 228 Ca -0.01 -0.83 0.06 0.00 0.82 0.00 0.00 66.70 66.75 1k6i h VAL 228 Cb 1.09 1.65 -0.04 0.00 -1.52 0.00 0.00 31.29 32.46 1k6i h VAL 228 CO 0.08 0.20 0.46 0.00 0.02 0.00 0.00 177.57 178.34 1k6i h ALA 230 N 1.62 1.05 -0.03 0.00 0.00 -1.39 0.72 119.26 121.23 1k6i h ALA 230 Ca 0.30 -0.23 -0.22 0.00 0.00 0.00 0.00 54.91 54.76 1k6i h ALA 230 Cb 0.25 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1k6i h ALA 230 CO -0.10 0.32 -0.90 0.00 0.00 0.00 0.00 179.25 178.57 1k6i h ALA 231 N 1.74 0.37 -0.15 0.00 0.00 -0.59 -1.71 119.26 118.92 1k6i h ALA 231 Ca -0.00 -0.68 -0.06 0.00 0.00 0.00 0.00 54.91 54.17 1k6i h ALA 231 Cb 0.74 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 1k6i h ALA 231 CO 0.03 0.78 -0.12 0.74 0.00 0.00 0.00 179.25 180.68 1k6i h PHE 232 N 0.28 0.42 -0.72 0.00 -1.00 -1.05 0.09 116.94 114.96 1k6i h PHE 232 Ca -0.07 -0.12 0.03 0.00 2.81 0.00 0.00 57.97 60.62 1k6i h PHE 232 Cb 1.53 -0.09 -0.05 0.00 3.61 0.00 0.00 35.95 40.95 1k6i h PHE 232 CO 0.06 0.72 0.45 1.03 -1.61 0.00 0.00 178.31 178.97 1k6i h SER 233 N 0.00 0.74 0.07 2.17 0.87 -0.87 0.41 113.55 116.94 1k6i h SER 233 Ca 0.03 0.00 -0.15 0.00 -1.23 0.00 0.00 61.79 60.44 1k6i h SER 233 Cb 0.64 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.43 1k6i h SER 233 CO 0.03 0.51 -0.52 -0.09 -0.53 0.00 0.00 176.83 176.23 1k6i h ARG 234 N 0.88 0.50 -0.03 2.24 2.43 -1.30 0.10 114.38 119.20 1k6i h ARG 234 Ca 0.29 -0.30 -0.24 0.00 -0.81 0.00 0.00 59.98 58.92 1k6i h ARG 234 Cb 0.03 0.03 0.01 0.00 -0.42 0.00 0.00 29.97 29.62 1k6i h ARG 234 CO -0.11 0.90 -0.95 0.00 -1.51 0.00 0.00 179.97 178.29 1k6i h ALA 235 N 1.04 0.25 -0.08 2.80 0.00 -0.26 -3.34 119.26 119.67 1k6i h ALA 235 Ca 0.01 -0.68 0.00 0.00 0.00 0.00 0.00 54.91 54.24 1k6i h ALA 235 Cb 1.05 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1k6i h ALA 235 CO 0.10 0.73 0.00 1.28 0.00 0.00 0.00 179.25 181.35 1k6i n LEU 236 N -3.84 2.70 -3.81 0.00 4.77 0.14 -4.60 117.00 112.37 1k6i n LEU 236 Ca -0.09 -1.09 -0.25 0.00 -0.03 0.00 0.00 56.01 54.56 1k6i n LEU 236 Cb 0.84 -0.04 0.02 0.00 -2.33 0.00 0.00 43.42 41.91 1k6i n LEU 236 CO 0.54 0.49 -0.04 0.59 -1.33 0.00 0.00 177.39 177.64 1k6i n ASN 237 N 1.11 -2.07 -4.01 -1.43 3.02 0.33 -4.98 115.26 107.23 1k6i n ASN 237 Ca 0.12 -0.84 -0.08 0.00 -0.03 0.00 0.00 54.58 53.75 1k6i n ASN 237 Cb 0.49 -3.83 -0.10 0.00 -0.61 0.00 0.00 39.78 35.72 1k6i n ASN 237 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1k6i s ARG 238 N -6.26 0.45 -0.05 3.52 0.52 -1.06 -5.06 118.95 111.01 1k6i s ARG 238 Ca 0.20 -0.85 -0.30 0.00 -0.52 0.00 0.00 55.73 54.26 1k6i s ARG 238 Cb -0.10 0.16 -0.04 0.00 0.52 0.00 0.00 34.95 35.49 1k6i s ARG 238 CO 0.83 -0.08 1.27 0.50 0.02 0.00 0.00 175.30 177.84 1k6i s ARG 239 N -2.49 4.32 -0.06 3.54 3.52 -1.26 -4.20 118.95 122.32 1k6i s ARG 239 Ca -0.06 1.76 0.00 0.00 -0.13 0.00 0.00 55.73 57.30 1k6i s ARG 239 Cb -0.02 -3.59 0.02 0.00 -1.56 0.00 0.00 34.95 29.80 1k6i s ARG 239 CO -0.05 -0.52 -0.03 0.08 -0.81 0.00 0.00 175.30 173.97 1k6i s VAL 240 N 2.43 0.53 0.06 7.11 1.01 -1.26 -1.45 120.40 128.84 1k6i s VAL 240 Ca 0.58 -0.06 0.04 0.00 0.00 0.00 0.00 61.98 62.54 1k6i s VAL 240 Cb -0.26 -0.60 -0.03 0.00 0.00 0.00 0.00 36.38 35.49 1k6i s VAL 240 CO 0.23 0.25 -0.12 0.42 0.00 0.00 0.00 175.10 175.88 1k6i s THR 241 N 1.31 0.89 -0.04 3.92 -4.23 -0.72 -4.56 115.64 112.21 1k6i s THR 241 Ca -0.05 -1.24 -0.11 0.00 -1.18 0.00 0.00 61.69 59.11 1k6i s THR 241 Cb -0.14 -0.91 -0.05 0.00 1.34 0.00 0.00 72.50 72.74 1k6i s THR 241 CO -0.02 -0.30 0.30 -0.47 -0.54 0.00 0.00 174.62 173.59 1k6i s TYR 242 N -1.37 3.67 -0.19 3.99 6.14 -1.26 -1.89 117.35 126.44 1k6i s TYR 242 Ca -0.05 0.79 -0.01 0.00 0.64 0.00 0.00 57.07 58.45 1k6i s TYR 242 Cb -0.10 -2.14 0.05 0.00 0.42 0.00 0.00 41.96 40.20 1k6i s TYR 242 CO 0.01 0.67 -0.04 0.08 0.64 0.00 0.00 175.55 176.92 1k6i s VAL 243 N -1.09 1.13 -0.02 3.14 1.01 -0.03 -4.95 120.40 119.59 1k6i s VAL 243 Ca 0.21 -0.79 -0.30 0.00 0.00 0.00 0.00 61.98 61.10 1k6i s VAL 243 Cb -0.15 -1.39 -0.05 0.00 0.00 0.00 0.00 36.38 34.79 1k6i s VAL 243 CO 0.10 0.00 1.45 -1.58 0.00 0.00 0.00 175.10 175.08 1k6i s GLN 244 N 1.60 4.25 -0.03 2.72 -0.44 -1.26 -2.44 119.66 124.06 1k6i s GLN 244 Ca -0.02 2.00 0.04 0.00 -2.50 0.00 0.00 55.36 54.89 1k6i s GLN 244 Cb -0.17 -3.67 -0.00 0.00 -1.64 0.00 0.00 33.01 27.53 1k6i s GLN 244 CO -0.07 -0.65 -0.15 0.08 0.50 0.00 0.00 175.29 175.00 1k6i s VAL 245 N 2.85 1.23 0.13 1.34 1.01 0.33 -4.91 120.40 122.37 1k6i s VAL 245 Ca 0.65 -0.62 -0.19 0.00 0.00 0.00 0.00 61.98 61.82 1k6i s VAL 245 Cb -0.31 -1.05 -0.05 0.00 0.00 0.00 0.00 36.38 34.97 1k6i s VAL 245 CO 0.26 0.36 1.75 -0.65 0.00 0.00 0.00 175.10 176.82 1k6i h PRO 246 N 6.14 0.18 -6.14 2.72 0.11 -1.91 -2.89 132.00 130.22 1k6i h PRO 246 Ca -0.34 -0.01 -0.68 0.00 0.11 0.00 0.00 66.00 65.08 1k6i h PRO 246 Cb 1.17 -0.04 -0.17 0.00 0.11 0.00 0.00 31.00 32.07 1k6i h PRO 246 CO 0.48 0.12 -0.67 0.15 -0.21 0.00 0.00 178.00 177.87 1k6i s LYS 247 N -6.18 2.77 0.18 1.05 1.02 -1.26 -4.77 119.74 112.56 1k6i s LYS 247 Ca -0.13 -0.56 -0.31 0.00 0.02 0.00 0.00 55.97 54.99 1k6i s LYS 247 Cb 0.09 -2.63 -0.10 0.00 -0.52 0.00 0.00 37.83 34.67 1k6i s LYS 247 CO 0.69 0.65 1.52 0.08 -0.92 0.00 0.00 175.35 177.38 1k6i s VAL 248 N -0.91 2.68 -0.37 3.17 1.01 -1.26 -4.84 120.40 119.88 1k6i s VAL 248 Ca 0.15 0.51 -0.29 0.00 0.00 0.00 0.00 61.98 62.34 1k6i s VAL 248 Cb -0.11 -3.32 0.01 0.00 0.00 0.00 0.00 36.38 32.96 1k6i s VAL 248 CO 0.04 0.05 1.26 -1.61 0.00 0.00 0.00 175.10 174.84 1k6i s GLU 249 N 0.75 3.81 -0.48 2.72 2.02 -1.26 -4.95 118.70 121.30 1k6i s GLU 249 Ca 0.67 0.99 -0.08 0.00 0.02 0.00 0.00 54.97 56.57 1k6i s GLU 249 Cb -0.43 -3.90 0.12 0.00 0.10 0.00 0.00 34.13 30.03 1k6i s GLU 249 CO 0.34 -1.26 0.34 0.42 0.02 0.00 0.00 175.26 175.13 1k6i s ILE 250 N 4.55 4.07 -2.60 -1.63 1.01 -1.26 -4.36 121.20 120.97 1k6i s ILE 250 Ca 0.54 -1.92 0.25 0.00 0.00 0.00 0.00 60.65 59.52 1k6i s ILE 250 Cb -0.13 -3.69 0.27 0.00 0.01 0.00 0.00 42.46 38.92 1k6i s ILE 250 CO 0.26 -0.78 1.40 0.29 0.00 0.00 0.00 174.94 176.12 1k6i n LYS 251 N 4.75 1.84 -4.23 2.79 5.02 -1.26 -4.94 118.16 122.13 1k6i n LYS 251 Ca -0.05 -1.38 -0.13 0.00 -2.02 0.00 0.00 58.31 54.72 1k6i n LYS 251 Cb 0.41 -1.47 -0.10 0.00 -0.02 0.00 0.00 35.03 33.85 1k6i n LYS 251 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1k6i s VAL 252 N -2.11 0.37 0.29 -0.18 -7.23 -1.26 -5.04 120.40 105.24 1k6i s VAL 252 Ca 0.29 -1.97 -0.29 0.00 -1.81 0.00 0.00 61.98 58.20 1k6i s VAL 252 Cb 0.20 -2.33 -0.09 0.00 0.56 0.00 0.00 36.38 34.71 1k6i s VAL 252 CO 0.37 -0.24 1.10 0.20 -0.31 0.00 0.00 175.10 176.22 1k6i s ASN 253 N -3.18 7.19 0.11 4.85 0.01 -1.26 -5.02 114.94 117.64 1k6i s ASN 253 Ca 0.31 2.26 0.01 0.00 -0.71 0.00 0.00 52.86 54.73 1k6i s ASN 253 Cb 0.07 -2.62 -0.04 0.00 0.41 0.00 0.00 41.25 39.06 1k6i s ASN 253 CO 0.08 -0.20 -0.04 0.27 -1.51 0.00 0.00 177.10 175.71 1k6i s ILE 254 N -1.21 0.58 0.63 0.60 -4.36 -1.26 -5.12 121.20 111.05 1k6i s ILE 254 Ca 0.46 -1.93 -0.18 0.00 -0.26 0.00 0.00 60.65 58.75 1k6i s ILE 254 Cb -0.31 -1.79 -0.02 0.00 1.25 0.00 0.00 42.46 41.60 1k6i s ILE 254 CO 0.40 -0.77 1.20 -2.84 0.24 0.00 0.00 174.94 173.17 1k6i s PRO 255 N -3.88 2.77 0.22 0.37 0.02 -1.26 -4.84 135.00 128.40 1k6i s PRO 255 Ca 0.15 1.77 -0.08 0.00 0.02 0.00 0.00 61.00 62.86 1k6i s PRO 255 Cb 0.06 -1.91 0.32 0.00 0.02 0.00 0.00 34.50 32.99 1k6i s PRO 255 CO -0.03 -1.35 1.74 0.28 -0.33 0.00 0.00 177.00 177.31 1k6i h VAL 256 N 0.55 0.73 -0.56 3.83 2.07 -2.01 -1.40 116.25 119.46 1k6i h VAL 256 Ca -0.50 -0.14 -0.01 0.00 0.82 0.00 0.00 66.70 66.87 1k6i h VAL 256 Cb 1.29 0.29 -0.03 0.00 -1.52 0.00 0.00 31.29 31.32 1k6i h VAL 256 CO 0.54 0.07 0.29 1.23 0.02 0.00 0.00 177.57 179.72 1k6i h GLY 257 N 0.41 0.82 1.26 2.17 0.00 -2.00 -2.21 103.07 103.52 1k6i h GLY 257 Ca 0.33 -0.36 -0.16 0.00 0.00 0.00 0.00 47.33 47.14 1k6i h GLY 257 CO -0.34 0.35 -0.44 -1.82 0.00 0.00 0.00 176.54 174.29 1k6i h TYR 258 N 0.78 0.97 -0.37 5.60 -0.00 -1.64 -1.94 116.97 120.36 1k6i h TYR 258 Ca 0.20 -0.31 0.01 0.00 -0.00 0.00 0.00 58.73 58.63 1k6i h TYR 258 Cb 0.04 -0.20 -0.02 0.00 -0.00 0.00 0.00 36.73 36.55 1k6i h TYR 258 CO 0.01 1.09 0.22 -0.09 -0.00 0.00 0.00 178.16 179.39 1k6i h ARG 259 N 0.64 0.44 -0.66 1.82 2.43 -1.00 -0.67 114.38 117.38 1k6i h ARG 259 Ca 0.04 -0.03 0.01 0.00 -0.81 0.00 0.00 59.98 59.19 1k6i h ARG 259 Cb 1.01 -0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 30.43 1k6i h ARG 259 CO 0.10 0.29 0.43 0.93 -1.51 0.00 0.00 179.97 180.21 1k6i h GLU 260 N 0.46 0.87 -0.00 0.20 5.08 -1.29 -0.39 114.58 119.50 1k6i h GLU 260 Ca 0.14 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1k6i h GLU 260 Cb -0.02 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 29.04 1k6i h GLU 260 CO -0.06 0.58 0.00 0.37 -1.00 0.00 0.00 179.01 178.91 1k6i h GLN 261 N 0.90 0.00 -0.74 2.33 5.75 -0.75 -2.09 115.11 120.51 1k6i h GLN 261 Ca 0.24 -0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.74 1k6i h GLN 261 Cb -0.10 -0.00 -0.04 0.00 1.07 0.00 0.00 27.48 28.42 1k6i h GLN 261 CO -0.05 0.14 0.44 -0.07 -2.65 0.00 0.00 178.83 176.64 1k6i h LEU 262 N -0.14 0.89 -1.07 -2.39 3.38 -0.25 -1.38 115.31 114.34 1k6i h LEU 262 Ca 0.00 -0.05 -0.09 0.00 0.09 0.00 0.00 57.88 57.82 1k6i h LEU 262 Cb 0.14 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 1k6i h LEU 262 CO -0.00 0.69 -0.39 -0.33 0.09 0.00 0.00 178.44 178.50 1k6i h GLU 263 N 1.02 0.14 -0.24 1.13 5.08 -0.98 -0.09 114.58 120.63 1k6i h GLU 263 Ca 0.27 -0.06 -0.14 0.00 -1.00 0.00 0.00 59.36 58.42 1k6i h GLU 263 Cb -0.03 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 1k6i h GLU 263 CO -0.05 0.51 -0.44 0.00 -1.00 0.00 0.00 179.01 178.03 1k6i h ALA 264 N 1.48 0.78 -0.47 3.43 0.00 -0.77 -2.66 119.26 121.06 1k6i h ALA 264 Ca 0.01 -0.46 -0.11 0.00 0.00 0.00 0.00 54.91 54.35 1k6i h ALA 264 Cb 0.75 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 1k6i h ALA 264 CO 0.06 0.66 -0.13 0.82 0.00 0.00 0.00 179.25 180.66 1k6i h ILE 265 N 0.49 1.27 -0.41 0.00 2.04 -0.50 -0.08 117.51 120.32 1k6i h ILE 265 Ca 0.03 -1.26 0.05 0.00 1.00 0.00 0.00 64.86 64.69 1k6i h ILE 265 Cb 0.96 1.12 -0.05 0.00 -0.74 0.00 0.00 36.82 38.11 1k6i h ILE 265 CO 0.09 0.43 0.13 -0.33 0.00 0.00 0.00 178.15 178.47 1k6i h GLU 266 N 0.76 0.27 0.03 2.37 5.08 -0.89 -1.05 114.58 121.15 1k6i h GLU 266 Ca 0.12 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.46 1k6i h GLU 266 Cb 0.68 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.87 1k6i h GLU 266 CO 0.05 0.18 -0.01 0.28 -1.00 0.00 0.00 179.01 178.51 1k6i h VAL 267 N 0.28 1.23 -0.29 3.13 2.07 -1.33 0.33 116.25 121.67 1k6i h VAL 267 Ca 0.19 -0.81 -0.05 0.00 0.82 0.00 0.00 66.70 66.86 1k6i h VAL 267 Cb 0.20 1.77 -0.01 0.00 -1.52 0.00 0.00 31.29 31.73 1k6i h VAL 267 CO -0.21 0.21 -0.02 0.58 0.02 0.00 0.00 177.57 178.15 1k6i h VAL 268 N -0.39 1.26 0.00 2.57 2.07 -0.87 -1.09 116.25 119.81 1k6i h VAL 268 Ca -0.00 -0.97 -0.32 0.00 0.82 0.00 0.00 66.70 66.22 1k6i h VAL 268 Cb 0.37 1.33 -0.06 0.00 -1.52 0.00 0.00 31.29 31.40 1k6i h VAL 268 CO 0.01 0.31 -2.22 0.49 0.02 0.00 0.00 177.57 176.18 1k6i n PHE 269 N -4.56 0.00 0.04 1.57 3.01 -0.41 -1.13 117.46 115.98 1k6i n PHE 269 Ca -0.03 0.00 -0.03 0.00 1.01 0.00 0.00 57.45 58.40 1k6i n PHE 269 Cb 0.27 -0.87 -0.01 0.00 -0.01 0.00 0.00 39.48 38.86 1k6i n PHE 269 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 1k6i h GLY 270 N 3.15 -0.21 1.06 1.37 0.00 -0.83 -2.97 103.07 104.65 1k6i h GLY 270 Ca -0.48 0.08 -0.20 0.00 0.00 0.00 0.00 47.33 46.73 1k6i h GLY 270 CO 0.01 -0.08 -0.70 -2.09 0.00 0.00 0.00 176.54 173.69 1k6i h GLU 271 N -0.91 0.69 0.00 4.80 4.81 -0.33 -3.38 114.58 120.26 1k6i h GLU 271 Ca -0.02 -0.58 0.00 0.00 -0.13 0.00 0.00 59.36 58.63 1k6i h GLU 271 Cb 0.15 0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.66 1k6i h GLU 271 CO 0.03 1.19 -1.52 0.72 -0.73 0.00 0.00 179.01 178.70 1k6i n HIS 272 N -4.04 0.00 -3.41 0.92 8.25 -0.42 -5.01 115.22 111.51 1k6i n HIS 272 Ca -0.08 0.00 -0.25 0.00 -0.26 0.00 0.00 57.72 57.13 1k6i n HIS 272 Cb 0.70 -0.28 0.03 0.00 1.12 0.00 0.00 29.99 31.56 1k6i n HIS 272 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1k6i n LYS 273 N -1.91 -5.36 -2.21 -0.41 5.02 -0.96 -4.94 118.16 107.39 1k6i n LYS 273 Ca -0.01 0.74 -0.33 0.00 -2.02 0.00 0.00 58.31 56.69 1k6i n LYS 273 Cb 0.42 -5.62 -0.01 0.00 -0.02 0.00 0.00 35.03 29.81 1k6i n LYS 273 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1k6i s ALA 274 N -3.18 2.86 0.69 7.82 0.00 -0.29 -4.99 121.76 124.67 1k6i s ALA 274 Ca 0.46 0.35 -0.17 0.00 0.00 0.00 0.00 51.96 52.61 1k6i s ALA 274 Cb -0.22 -3.20 0.02 0.00 0.00 0.00 0.00 23.12 19.72 1k6i s ALA 274 CO 0.57 -0.58 1.27 -2.14 0.00 0.00 0.00 175.76 174.88 1k6i s PRO 275 N -3.98 2.29 0.05 0.00 0.02 -1.26 -4.71 135.00 127.40 1k6i s PRO 275 Ca 0.62 1.97 -0.20 0.00 0.02 0.00 0.00 61.00 63.41 1k6i s PRO 275 Cb -0.14 -1.83 -0.13 0.00 0.02 0.00 0.00 34.50 32.42 1k6i s PRO 275 CO 0.33 -1.77 1.40 -0.92 -0.33 0.00 0.00 177.00 175.71 1k6i h TYR 276 N 0.12 0.41 -3.58 6.54 5.03 -1.95 -3.33 116.97 120.21 1k6i h TYR 276 Ca -0.50 -0.11 -0.72 0.00 2.58 0.00 0.00 58.73 59.99 1k6i h TYR 276 Cb 1.32 -0.09 -0.32 0.00 1.55 0.00 0.00 36.73 39.19 1k6i h TYR 276 CO 0.43 0.68 -0.27 -0.06 -1.32 0.00 0.00 178.16 177.62 1k6i s PHE 277 N -4.53 3.50 -1.72 -3.82 0.08 -1.26 -4.87 117.98 105.36 1k6i s PHE 277 Ca -0.14 -2.45 0.00 0.00 0.12 0.00 0.00 56.93 54.46 1k6i s PHE 277 Cb 0.06 -3.38 0.00 0.00 -0.57 0.00 0.00 43.02 39.13 1k6i s PHE 277 CO 0.74 -0.90 0.86 -0.35 -0.10 0.00 0.00 175.22 175.48 1k6i n PRO 278 N 3.79 1.01 -2.56 0.24 -0.04 -1.25 -4.73 135.00 131.45 1k6i n PRO 278 Ca 0.07 -0.01 -0.41 0.00 -0.04 0.00 0.00 63.50 63.11 1k6i n PRO 278 Cb 0.40 -1.14 -0.05 0.00 -0.04 0.00 0.00 33.50 32.68 1k6i n PRO 278 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1k6i s LEU 279 N -0.73 4.55 0.46 1.53 2.01 -1.26 -4.88 118.68 120.36 1k6i s LEU 279 Ca 0.00 2.11 0.19 0.00 0.01 0.00 0.00 54.13 56.44 1k6i s LEU 279 Cb 0.00 -3.61 1.17 0.00 0.01 0.00 0.00 46.19 43.75 1k6i s LEU 279 CO 0.00 -0.10 1.95 -0.65 1.01 0.00 0.00 176.35 178.55 1k6i h PRO 280 N 4.47 0.27 -0.86 1.29 0.11 -1.89 -1.02 132.00 134.37 1k6i h PRO 280 Ca -0.45 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.64 1k6i h PRO 280 Cb 1.21 -0.06 -0.04 0.00 0.11 0.00 0.00 31.00 32.22 1k6i h PRO 280 CO 0.69 0.18 0.53 0.93 -0.21 0.00 0.00 178.00 180.12 1k6i h GLU 281 N 0.28 1.15 -1.09 1.05 5.08 -1.95 -2.57 114.58 116.53 1k6i h GLU 281 Ca 0.33 -0.09 -0.37 0.00 -1.00 0.00 0.00 59.36 58.22 1k6i h GLU 281 Cb 0.90 -0.25 -0.20 0.00 0.50 0.00 0.00 28.75 29.70 1k6i h GLU 281 CO -0.08 0.80 0.48 1.19 -1.00 0.00 0.00 179.01 180.40 1k6i n PHE 282 N -4.38 2.08 0.00 4.33 0.99 -0.39 -4.98 117.46 115.11 1k6i n PHE 282 Ca 0.09 -1.65 0.00 0.00 -0.00 0.00 0.00 57.45 55.89 1k6i n PHE 282 Cb 0.05 -0.83 0.00 0.00 -1.00 0.00 0.00 39.48 37.71 1k6i n PHE 282 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.76 175.63 1k6i n SER 283 N -0.47 0.00 -4.83 4.37 3.41 -0.97 -4.87 113.62 110.26 1k6i n SER 283 Ca 0.40 0.00 -0.33 0.00 -0.26 0.00 0.00 58.87 58.68 1k6i n SER 283 Cb 1.10 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.99 1k6i n SER 283 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1k6i s ARG 316 N 0.00 4.12 0.62 4.33 1.81 -1.26 -4.66 118.95 123.91 1k6i s ARG 316 Ca 0.00 0.86 0.30 0.00 -1.72 0.00 0.00 55.73 55.16 1k6i s ARG 316 Cb 0.00 -2.39 1.59 0.00 -0.45 0.00 0.00 34.95 33.70 1k6i s ARG 316 CO 0.00 0.11 1.95 -0.24 -0.68 0.00 0.00 175.30 176.44 1k6i h VAL 317 N 2.02 0.23 -0.00 3.52 3.04 -1.93 -1.12 116.25 122.00 1k6i h VAL 317 Ca -0.48 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.21 1k6i h VAL 317 Cb 1.18 0.68 0.00 0.00 -2.01 0.00 0.00 31.29 31.14 1k6i h VAL 317 CO 0.64 0.00 -0.51 0.35 -1.01 0.00 0.00 177.57 177.04 1k6i n THR 318 N -3.39 0.00 0.06 3.17 -2.24 -1.26 -4.59 114.28 106.03 1k6i n THR 318 Ca 0.03 -0.00 -0.15 0.00 -2.27 0.00 0.00 64.05 61.65 1k6i n THR 318 Cb 0.48 0.28 -0.09 0.00 -2.10 0.00 0.00 70.33 68.90 1k6i n THR 318 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1k6i h ASP 319 N 0.04 -1.56 -0.42 3.42 3.32 -1.51 -2.00 116.42 117.70 1k6i h ASP 319 Ca 0.00 0.17 0.02 0.00 0.02 0.00 0.00 57.03 57.24 1k6i h ASP 319 Cb 0.50 0.59 -0.03 0.00 0.22 0.00 0.00 39.33 40.61 1k6i h ASP 319 CO 0.00 -0.50 0.26 -0.33 -1.72 0.00 0.00 179.24 176.95 1k6i h GLU 320 N -0.64 0.51 -0.56 3.56 4.39 -1.81 -2.10 114.58 117.93 1k6i h GLU 320 Ca 0.01 -0.03 0.06 0.00 0.34 0.00 0.00 59.36 59.73 1k6i h GLU 320 Cb 0.68 -0.11 -0.05 0.00 -0.10 0.00 0.00 28.75 29.17 1k6i h GLU 320 CO -0.33 0.33 0.27 0.00 -1.16 0.00 0.00 179.01 178.13 1k6i h ALA 321 N 1.18 0.72 0.00 3.43 0.00 -1.74 -0.53 119.26 122.32 1k6i h ALA 321 Ca 0.17 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.07 1k6i h ALA 321 Cb -0.01 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1k6i h ALA 321 CO -0.07 -0.08 -0.19 0.00 0.00 0.00 0.00 179.25 178.91 1k6i h ARG 322 N 0.52 0.00 -0.02 0.00 3.08 -1.00 -1.01 114.38 115.95 1k6i h ARG 322 Ca 0.25 0.00 -0.23 0.00 0.07 0.00 0.00 59.98 60.08 1k6i h ARG 322 Cb 0.19 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.24 1k6i h ARG 322 CO -0.19 0.19 -0.93 0.87 -1.07 0.00 0.00 179.97 178.85 1k6i h LYS 323 N 0.00 0.47 -0.28 0.04 1.57 -0.66 -3.23 116.57 114.48 1k6i h LYS 323 Ca -0.00 -0.49 -0.06 0.00 -1.87 0.00 0.00 60.65 58.23 1k6i h LYS 323 Cb 0.62 0.13 -0.01 0.00 0.08 0.00 0.00 32.23 33.05 1k6i h LYS 323 CO 0.03 1.13 -0.07 -0.07 -0.57 0.00 0.00 179.45 179.90 1k6i h LEU 324 N 0.28 0.55 -7.02 2.94 3.38 -0.62 -3.42 115.31 111.40 1k6i h LEU 324 Ca -0.08 -0.37 -0.51 0.00 0.09 0.00 0.00 57.88 57.01 1k6i h LEU 324 Cb 1.56 -0.15 -0.40 0.00 0.09 0.00 0.00 40.66 41.75 1k6i h LEU 324 CO 0.17 0.79 -0.76 0.86 0.09 0.00 0.00 178.44 179.58 1k6i s TRP 325 N -4.76 0.62 -0.01 1.13 -0.00 -0.43 -4.77 118.94 110.72 1k6i s TRP 325 Ca -0.13 -0.82 0.21 0.00 -0.00 0.00 0.00 56.10 55.36 1k6i s TRP 325 Cb 0.08 -0.97 0.61 0.00 -0.00 0.00 0.00 33.47 33.19 1k6i s TRP 325 CO 0.78 -0.69 1.69 0.77 -0.00 0.00 0.00 176.95 179.50 1k6i h SER 326 N 8.33 0.00 -0.57 5.86 0.02 -1.81 -3.32 113.55 122.06 1k6i h SER 326 Ca -0.17 0.00 -0.28 0.00 -0.84 0.00 0.00 61.79 60.50 1k6i h SER 326 Cb 1.08 0.00 -0.17 0.00 0.14 0.00 0.00 62.40 63.45 1k6i h SER 326 CO 0.38 0.28 0.36 0.61 -1.14 0.00 0.00 176.83 177.32 1k6i n GLY 327 N 0.56 3.39 3.75 -3.77 0.00 -1.26 -4.98 105.19 102.88 1k6i n GLY 327 Ca 0.01 -0.64 -0.35 0.00 0.00 0.00 0.00 46.02 45.03 1k6i n GLY 327 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1k6i s TRP 328 N -1.98 2.36 0.01 1.61 1.48 -1.25 -5.01 118.94 116.16 1k6i s TRP 328 Ca 0.34 1.53 0.00 0.00 -1.06 0.00 0.00 56.10 56.91 1k6i s TRP 328 Cb 0.28 -3.46 -0.04 0.00 -1.16 0.00 0.00 33.47 29.10 1k6i s TRP 328 CO 0.07 -2.23 0.07 1.03 -4.06 0.00 0.00 176.95 171.84 1k6i s ARG 329 N -3.46 3.02 0.63 3.25 0.52 -1.26 -5.12 118.95 116.53 1k6i s ARG 329 Ca 0.76 -0.52 0.07 0.00 -0.52 0.00 0.00 55.73 55.52 1k6i s ARG 329 Cb -0.29 -2.83 0.11 0.00 0.52 0.00 0.00 34.95 32.46 1k6i s ARG 329 CO 0.35 0.64 0.87 0.16 0.02 0.00 0.00 175.30 177.34 1k6i s ASP 330 N -1.80 4.80 0.40 0.23 1.47 -1.26 -4.66 116.67 115.85 1k6i s ASP 330 Ca 0.23 -0.76 0.09 0.00 1.18 0.00 0.00 52.55 53.29 1k6i s ASP 330 Cb -0.12 0.31 0.83 0.00 -0.34 0.00 0.00 42.92 43.60 1k6i s ASP 330 CO 0.15 -1.56 1.98 -0.03 0.68 0.00 0.00 175.17 176.38 1k6i h MET 331 N -0.08 0.35 -0.38 2.11 1.85 -1.98 -2.27 114.93 114.52 1k6i h MET 331 Ca -0.31 -0.05 -0.15 0.00 -0.61 0.00 0.00 59.70 58.58 1k6i h MET 331 Cb 1.28 -0.06 -0.01 0.00 0.43 0.00 0.00 31.60 33.24 1k6i h MET 331 CO 0.40 0.36 -0.36 1.49 -0.40 0.00 0.00 176.91 178.39 1k6i h GLU 332 N 0.35 0.92 -0.52 0.39 4.22 -1.95 -1.63 114.58 116.36 1k6i h GLU 332 Ca 0.08 -0.48 -0.09 0.00 0.08 0.00 0.00 59.36 58.96 1k6i h GLU 332 Cb 0.19 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 1k6i h GLU 332 CO 0.00 1.13 -0.03 0.93 -2.18 0.00 0.00 179.01 178.86 1k6i h GLU 333 N 0.73 0.90 0.47 1.92 5.08 -1.85 -2.17 114.58 119.66 1k6i h GLU 333 Ca 0.06 -0.27 -0.02 0.00 -1.00 0.00 0.00 59.36 58.13 1k6i h GLU 333 Cb 0.95 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.12 1k6i h GLU 333 CO 0.09 0.91 -0.23 -0.92 -1.00 0.00 0.00 179.01 177.86 1k6i h TYR 334 N 0.82 -0.59 -0.91 4.33 5.03 -1.20 0.51 116.97 124.96 1k6i h TYR 334 Ca 0.15 -0.01 0.12 0.00 2.58 0.00 0.00 58.73 61.56 1k6i h TYR 334 Cb 0.53 0.20 -0.08 0.00 1.55 0.00 0.00 36.73 38.92 1k6i h TYR 334 CO 0.03 -0.32 0.54 0.00 -1.32 0.00 0.00 178.16 177.09 1k6i h ALA 335 N -0.25 1.35 0.18 1.82 0.00 -1.26 0.12 119.26 121.22 1k6i h ALA 335 Ca -0.07 0.04 -0.31 0.00 0.00 0.00 0.00 54.91 54.57 1k6i h ALA 335 Cb 0.54 -0.14 0.02 0.00 0.00 0.00 0.00 17.79 18.20 1k6i h ALA 335 CO 0.11 0.11 -1.46 -0.09 0.00 0.00 0.00 179.25 177.92 1k6i h ARG 336 N 0.84 0.38 0.00 0.00 2.43 -1.35 -3.36 114.38 113.32 1k6i h ARG 336 Ca 0.46 -0.65 -0.05 0.00 -0.81 0.00 0.00 59.98 58.93 1k6i h ARG 336 Cb 0.49 0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 30.27 1k6i h ARG 336 CO -0.28 1.29 -1.74 0.39 -1.51 0.00 0.00 179.97 178.12 1k6i n GLU 337 N -3.59 0.70 -0.02 0.20 1.02 0.17 -4.72 120.64 114.40 1k6i n GLU 337 Ca -0.15 -0.11 -0.03 0.00 -0.02 0.00 0.00 57.16 56.85 1k6i n GLU 337 Cb 1.07 -1.36 -0.01 0.00 -0.02 0.00 0.00 31.44 31.11 1k6i n GLU 337 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1k6i n VAL 338 N -2.12 0.18 -0.27 2.62 0.31 -0.15 -4.70 118.33 114.20 1k6i n VAL 338 Ca -0.07 -0.06 0.08 0.00 -0.01 0.00 0.00 64.34 64.28 1k6i n VAL 338 Cb 0.50 -0.95 0.22 0.00 -0.91 0.00 0.00 33.84 32.70 1k6i n VAL 338 CO 0.00 0.00 0.00 0.15 -1.32 0.00 0.00 176.83 175.66 1k6i h PHE 339 N -0.04 0.24 -0.66 3.52 3.57 -1.21 -0.04 116.94 122.31 1k6i h PHE 339 Ca -0.08 0.05 -0.02 0.00 3.53 0.00 0.00 57.97 61.45 1k6i h PHE 339 Cb 1.10 0.02 -0.03 0.00 2.79 0.00 0.00 35.95 39.83 1k6i h PHE 339 CO -0.00 -0.16 0.31 -1.35 -2.23 0.00 0.00 178.31 174.88 1k6i h PRO 340 N 0.22 0.94 -0.11 6.41 0.11 -1.83 -0.93 132.00 136.80 1k6i h PRO 340 Ca 0.47 -0.13 -0.18 0.00 0.11 0.00 0.00 66.00 66.27 1k6i h PRO 340 Cb 0.86 -0.18 0.01 0.00 0.11 0.00 0.00 31.00 31.80 1k6i h PRO 340 CO -0.60 0.73 -0.62 0.82 -0.21 0.00 0.00 178.00 178.13 1k6i h ILE 341 N 0.94 1.34 -0.63 4.15 1.08 -1.49 -1.60 117.51 121.29 1k6i h ILE 341 Ca 0.23 -1.90 -0.05 0.00 -0.39 0.00 0.00 64.86 62.75 1k6i h ILE 341 Cb 0.11 2.14 -0.03 0.00 -3.07 0.00 0.00 36.82 35.97 1k6i h ILE 341 CO -0.03 0.58 0.19 -0.33 -0.69 0.00 0.00 178.15 177.87 1k6i h GLU 342 N 0.26 0.97 -0.29 2.37 5.08 -0.88 0.88 114.58 122.97 1k6i h GLU 342 Ca -0.05 -0.19 -0.06 0.00 -1.00 0.00 0.00 59.36 58.06 1k6i h GLU 342 Cb 1.26 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 30.35 1k6i h GLU 342 CO 0.13 0.84 -0.06 0.93 -1.00 0.00 0.00 179.01 179.84 1k6i h GLU 343 N 0.93 0.56 -0.52 2.33 4.39 -1.18 -1.59 114.58 119.51 1k6i h GLU 343 Ca 0.21 -0.21 -0.06 0.00 0.34 0.00 0.00 59.36 59.63 1k6i h GLU 343 Cb 0.28 -0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.87 1k6i h GLU 343 CO -0.01 0.76 0.08 1.49 -1.16 0.00 0.00 179.01 180.16 1k6i h GLU 344 N 0.33 0.82 -0.18 2.33 4.81 -0.98 -0.91 114.58 120.80 1k6i h GLU 344 Ca 0.08 -0.19 -0.03 0.00 -0.13 0.00 0.00 59.36 59.09 1k6i h GLU 344 Cb 0.54 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.80 1k6i h GLU 344 CO 0.03 0.78 -0.02 0.00 -0.73 0.00 0.00 179.01 179.06 1k6i h ALA 345 N 1.30 1.63 -0.01 2.92 0.00 -0.63 -1.24 119.26 123.23 1k6i h ALA 345 Ca 0.16 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1k6i h ALA 345 Cb 0.36 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1k6i h ALA 345 CO 0.01 0.28 -0.00 0.09 0.00 0.00 0.00 179.25 179.63 1k6i n ASN 346 N -4.36 0.68 0.00 0.00 3.02 -0.61 -4.92 115.26 109.07 1k6i n ASN 346 Ca -0.00 -1.22 0.00 0.00 -0.03 0.00 0.00 54.58 53.33 1k6i n ASN 346 Cb 0.20 -0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.36 1k6i n ASN 346 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1k6i n GLY 347 N 1.08 0.74 3.81 7.41 0.00 -0.47 -5.08 105.19 112.68 1k6i n GLY 347 Ca 0.22 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.90 1k6i n GLY 347 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1k6i s LEU 348 N 0.00 3.70 -0.00 0.99 1.43 -0.41 -4.98 118.68 119.42 1k6i s LEU 348 Ca 0.00 1.82 0.03 0.00 -1.03 0.00 0.00 54.13 54.96 1k6i s LEU 348 Cb 0.00 -4.54 -0.04 0.00 0.03 0.00 0.00 46.19 41.64 1k6i s LEU 348 CO 0.00 -0.85 0.15 0.47 0.23 0.00 0.00 176.35 176.35 1k6i n ASP 349 N -1.38 0.29 0.02 2.29 8.00 -1.26 -4.25 116.55 120.26 1k6i n ASP 349 Ca 0.09 -0.56 0.22 0.00 0.71 0.00 0.00 54.79 55.24 1k6i n ASP 349 Cb 0.53 1.01 0.66 0.00 -0.02 0.00 0.00 41.12 43.29 1k6i n ASP 349 CO 0.00 0.00 0.00 4.11 -0.39 0.00 0.00 177.20 180.92 1k6i h TRP 350 N 0.00 0.00 -0.05 1.24 5.08 -1.97 0.67 115.95 120.91 1k6i h TRP 350 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 1k6i h TRP 350 Cb 0.09 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.25 1k6i h TRP 350 CO 0.00 0.00 0.00 0.00 -1.28 0.00 0.00 178.44 177.16 1k6i n MET 351 N -3.52 1.64 -0.13 0.12 0.00 -1.26 -5.20 117.12 108.77 1k6i n MET 351 Ca 0.11 -0.93 0.00 0.00 0.00 0.00 0.00 57.70 56.88 1k6i n MET 351 Cb 0.87 -1.46 0.00 0.00 0.00 0.00 0.00 33.22 32.63 1k6i n MET 351 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 175.97 175.86