#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x7t n TRP 5 N 0.00 1.17 -1.23 1.57 4.27 -1.26 -4.91 117.44 117.05 2x7t n TRP 5 Ca 0.00 0.43 0.00 0.00 -3.89 0.00 0.00 57.50 54.04 2x7t n TRP 5 Cb 0.00 -2.18 0.00 0.00 -1.36 0.00 0.00 31.31 27.77 2x7t n TRP 5 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 2x7t n GLY 6 N 1.17 2.96 0.66 -1.67 0.00 -0.60 -5.04 105.19 102.68 2x7t n GLY 6 Ca 0.14 -0.44 0.06 0.00 0.00 0.00 0.00 46.02 45.78 2x7t n GLY 6 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2x7t n TYR 7 N 0.00 0.00 -2.87 1.61 4.02 -1.26 -3.73 117.16 114.93 2x7t n TYR 7 Ca 0.00 -1.14 -0.21 0.00 -0.01 0.00 0.00 57.90 56.54 2x7t n TYR 7 Cb 0.00 -0.20 0.08 0.00 -0.02 0.00 0.00 39.34 39.20 2x7t n TYR 7 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 2x7t s GLY 8 N -2.82 1.73 0.56 2.72 0.00 -1.26 -4.71 107.32 103.55 2x7t s GLY 8 Ca 0.34 -2.03 0.27 0.00 0.00 0.00 0.00 44.72 43.30 2x7t s GLY 8 CO -0.07 -1.51 2.20 1.70 0.00 0.00 0.00 173.10 175.42 2x7t h LYS 9 N -0.12 0.00 -0.01 2.90 3.64 -1.98 0.11 116.57 121.11 2x7t h LYS 9 Ca -0.32 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.06 2x7t h LYS 9 Cb 1.28 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.10 2x7t h LYS 9 CO 0.40 0.03 -0.38 0.72 -2.27 0.00 0.00 179.45 177.96 2x7t n HIS 10 N -3.90 0.00 -1.42 1.91 8.25 -1.26 -4.64 115.22 114.16 2x7t n HIS 10 Ca -0.03 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.43 2x7t n HIS 10 Cb 0.12 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.23 2x7t n HIS 10 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 2x7t n ASN 11 N -0.50 0.00 -2.79 0.41 0.23 -1.14 -4.95 115.26 106.51 2x7t n ASN 11 Ca 0.05 -1.34 -0.10 0.00 -0.53 0.00 0.00 54.58 52.66 2x7t n ASN 11 Cb 0.26 -0.07 0.08 0.00 -2.08 0.00 0.00 39.78 37.97 2x7t n ASN 11 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2x7t n GLY 12 N 0.00 -2.19 0.43 4.83 0.00 0.36 -1.55 105.19 107.06 2x7t n GLY 12 Ca 0.00 -1.52 0.29 0.00 0.00 0.00 0.00 46.02 44.79 2x7t n GLY 12 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2x7t h PRO 13 N 0.00 0.23 0.00 1.61 0.11 -1.85 0.69 132.00 132.79 2x7t h PRO 13 Ca -0.14 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.96 2x7t h PRO 13 Cb 0.41 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.47 2x7t h PRO 13 CO 0.09 0.16 0.00 0.93 -0.21 0.00 0.00 178.00 178.97 2x7t h GLU 14 N 0.24 0.00 0.00 1.05 4.39 -1.93 -3.09 114.58 115.24 2x7t h GLU 14 Ca 0.71 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.41 2x7t h GLU 14 Cb 2.01 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.66 2x7t h GLU 14 CO -0.39 0.00 -1.30 0.72 -1.16 0.00 0.00 179.01 176.89 2x7t n HIS 15 N -3.04 0.25 -0.24 4.33 8.25 0.22 -4.56 115.22 120.44 2x7t n HIS 15 Ca 0.01 0.07 0.10 0.00 -0.26 0.00 0.00 57.72 57.65 2x7t n HIS 15 Cb 0.33 -0.47 0.38 0.00 1.12 0.00 0.00 29.99 31.34 2x7t n HIS 15 CO 0.00 0.00 0.00 -1.49 0.64 0.00 0.00 176.34 175.49 2x7t h TRP 16 N 0.00 0.78 -0.07 4.41 6.55 -1.44 -2.71 115.95 123.48 2x7t h TRP 16 Ca 0.00 0.02 0.02 0.00 0.95 0.00 0.00 58.89 59.88 2x7t h TRP 16 Cb 0.81 -0.25 -0.00 0.00 -0.86 0.00 0.00 29.16 28.86 2x7t h TRP 16 CO 0.00 0.33 0.14 1.12 -1.05 0.00 0.00 178.44 178.98 2x7t h HIS 17 N 0.70 0.00 -0.50 0.49 2.07 -1.80 0.31 115.15 116.42 2x7t h HIS 17 Ca 0.40 0.00 -0.05 0.00 -2.85 0.00 0.00 60.37 57.86 2x7t h HIS 17 Cb 0.58 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 30.54 2x7t h HIS 17 CO -0.00 0.00 0.10 0.87 -3.07 0.00 0.00 177.93 175.83 2x7t h LYS 18 N 0.00 0.81 0.00 5.12 1.57 -1.82 -2.61 116.57 119.64 2x7t h LYS 18 Ca 0.03 -0.21 -0.00 0.00 -1.87 0.00 0.00 60.65 58.60 2x7t h LYS 18 Cb 0.31 -0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.52 2x7t h LYS 18 CO -0.00 0.80 -1.59 -0.25 -0.57 0.00 0.00 179.45 177.84 2x7t n ASP 19 N -4.43 0.36 -3.59 0.86 8.00 -0.89 -4.66 116.55 112.20 2x7t n ASP 19 Ca 0.01 0.14 -0.28 0.00 0.71 0.00 0.00 54.79 55.38 2x7t n ASP 19 Cb 0.24 1.34 -0.11 0.00 -0.02 0.00 0.00 41.12 42.57 2x7t n ASP 19 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2x7t s PHE 20 N -3.44 1.96 0.51 1.24 0.08 0.05 -4.99 117.98 113.37 2x7t s PHE 20 Ca -0.05 -2.64 0.32 0.00 0.12 0.00 0.00 56.93 54.68 2x7t s PHE 20 Cb 0.12 -1.58 1.44 0.00 -0.57 0.00 0.00 43.02 42.43 2x7t s PHE 20 CO 0.86 -0.73 1.81 -1.35 -0.10 0.00 0.00 175.22 175.71 2x7t h PRO 21 N 5.70 0.09 0.00 0.24 0.11 -1.70 -0.78 132.00 135.66 2x7t h PRO 21 Ca 0.20 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.30 2x7t h PRO 21 Cb 0.86 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.95 2x7t h PRO 21 CO 0.49 0.06 0.00 1.51 -0.21 0.00 0.00 178.00 179.85 2x7t n ILE 22 N -4.30 0.69 0.30 4.15 3.06 -1.26 -2.13 119.36 119.86 2x7t n ILE 22 Ca 0.24 0.17 0.20 0.00 -2.50 0.00 0.00 62.75 60.86 2x7t n ILE 22 Cb 1.11 -1.07 1.01 0.00 0.54 0.00 0.00 39.64 41.23 2x7t n ILE 22 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2x7t h ALA 23 N 2.32 1.00 -0.33 1.51 0.00 -1.46 0.75 119.26 123.05 2x7t h ALA 23 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 2x7t h ALA 23 Cb 0.04 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 2x7t h ALA 23 CO 0.00 0.00 0.01 1.63 0.00 0.00 0.00 179.25 180.89 2x7t n LYS 24 N -2.90 3.10 -0.60 0.00 5.02 -0.91 -4.98 118.16 116.89 2x7t n LYS 24 Ca -0.02 -2.92 -0.23 0.00 -2.02 0.00 0.00 58.31 53.12 2x7t n LYS 24 Cb 0.10 -1.91 0.20 0.00 -0.02 0.00 0.00 35.03 33.40 2x7t n LYS 24 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2x7t n GLY 25 N -0.42 -3.07 0.19 0.72 0.00 0.26 -4.99 105.19 97.88 2x7t n GLY 25 Ca 0.24 -1.42 0.12 0.00 0.00 0.00 0.00 46.02 44.96 2x7t n GLY 25 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2x7t h GLU 26 N 0.00 0.00 -1.98 1.61 4.39 -1.96 -3.39 114.58 113.25 2x7t h GLU 26 Ca -0.31 0.00 -0.50 0.00 0.34 0.00 0.00 59.36 58.90 2x7t h GLU 26 Cb 0.96 0.00 -0.40 0.00 -0.10 0.00 0.00 28.75 29.21 2x7t h GLU 26 CO 0.20 0.00 -1.07 2.89 -1.16 0.00 0.00 179.01 179.87 2x7t n ARG 27 N -3.00 1.52 -2.88 2.33 1.85 -1.26 -4.68 116.66 110.55 2x7t n ARG 27 Ca 0.03 -3.71 -0.30 0.00 -1.00 0.00 0.00 57.85 52.87 2x7t n ARG 27 Cb 0.54 -1.80 -0.03 0.00 -1.05 0.00 0.00 32.46 30.12 2x7t n ARG 27 CO 0.00 0.00 0.00 -0.65 -0.01 0.00 0.00 177.63 176.97 2x7t s GLN 28 N -2.73 3.72 0.14 2.89 -1.52 -1.26 -2.68 119.66 118.21 2x7t s GLN 28 Ca 0.41 0.36 0.06 0.00 -1.95 0.00 0.00 55.36 54.24 2x7t s GLN 28 Cb 0.34 -2.42 -0.04 0.00 -0.22 0.00 0.00 33.01 30.67 2x7t s GLN 28 CO -0.09 -0.03 -0.13 -1.12 -0.25 0.00 0.00 175.29 173.67 2x7t s SER 29 N -3.32 2.01 1.02 5.90 0.01 -1.26 -4.64 113.70 113.41 2x7t s SER 29 Ca 0.50 -0.89 -0.15 0.00 1.31 0.00 0.00 55.95 56.72 2x7t s SER 29 Cb -0.10 -0.06 0.21 0.00 0.21 0.00 0.00 66.02 66.27 2x7t s SER 29 CO 0.33 -0.20 1.15 -0.81 0.41 0.00 0.00 173.24 174.13 2x7t n PRO 30 N 0.23 -1.33 -3.97 12.44 -0.04 -1.26 -4.52 135.00 136.55 2x7t n PRO 30 Ca -0.13 -1.78 -0.09 0.00 -0.04 0.00 0.00 63.50 61.46 2x7t n PRO 30 Cb 0.58 -1.23 -0.08 0.00 -0.04 0.00 0.00 33.50 32.74 2x7t n PRO 30 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2x7t s VAL 31 N -3.47 0.11 0.03 0.52 -7.23 -1.26 -0.16 120.40 108.94 2x7t s VAL 31 Ca 0.66 -1.44 -0.24 0.00 -1.81 0.00 0.00 61.98 59.15 2x7t s VAL 31 Cb -0.02 -1.69 -0.05 0.00 0.56 0.00 0.00 36.38 35.18 2x7t s VAL 31 CO 0.47 -0.49 0.72 -0.62 -0.31 0.00 0.00 175.10 174.87 2x7t s ASP 32 N -2.94 7.16 -0.49 4.85 3.68 -1.26 -3.03 116.67 124.63 2x7t s ASP 32 Ca 0.14 1.38 -0.17 0.00 2.13 0.00 0.00 52.55 56.03 2x7t s ASP 32 Cb 0.05 -2.44 0.07 0.00 -1.45 0.00 0.00 42.92 39.14 2x7t s ASP 32 CO -0.04 0.04 0.48 -0.63 0.13 0.00 0.00 175.17 175.15 2x7t s ILE 33 N -0.11 5.11 -0.76 4.11 1.01 0.20 -4.93 121.20 125.84 2x7t s ILE 33 Ca 0.37 -0.89 -0.22 0.00 0.00 0.00 0.00 60.65 59.91 2x7t s ILE 33 Cb -0.20 -4.19 0.08 0.00 0.01 0.00 0.00 42.46 38.16 2x7t s ILE 33 CO 0.22 -0.67 1.05 -0.62 0.00 0.00 0.00 174.94 174.92 2x7t s ASP 34 N 2.67 6.31 0.64 3.58 3.68 -1.26 -0.18 116.67 132.11 2x7t s ASP 34 Ca 0.08 -1.27 0.29 0.00 2.13 0.00 0.00 52.55 53.78 2x7t s ASP 34 Cb -0.23 -2.43 1.59 0.00 -1.45 0.00 0.00 42.92 40.40 2x7t s ASP 34 CO 0.08 -1.37 1.93 0.71 0.13 0.00 0.00 175.17 176.65 2x7t h THR 35 N 5.99 0.14 0.00 1.71 1.35 -1.94 -0.35 112.91 119.81 2x7t h THR 35 Ca -0.14 0.00 -0.14 0.00 -0.55 0.00 0.00 66.41 65.58 2x7t h THR 35 Cb 1.05 0.67 -0.02 0.00 -1.73 0.00 0.00 68.15 68.12 2x7t h THR 35 CO 1.18 0.00 -1.20 0.45 -0.25 0.00 0.00 175.52 175.70 2x7t h HIS 36 N 0.00 0.00 0.00 4.73 3.86 -2.02 -3.33 115.15 118.39 2x7t h HIS 36 Ca 0.07 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.28 2x7t h HIS 36 Cb 0.80 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.27 2x7t h HIS 36 CO 0.00 0.49 -0.91 0.25 0.86 0.00 0.00 177.93 178.62 2x7t n THR 37 N -2.92 0.01 -2.16 2.45 -2.24 -0.29 -4.90 114.28 104.23 2x7t n THR 37 Ca -0.06 -0.03 -0.41 0.00 -2.27 0.00 0.00 64.05 61.27 2x7t n THR 37 Cb 0.79 0.72 -0.03 0.00 -2.10 0.00 0.00 70.33 69.71 2x7t n THR 37 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2x7t s ALA 38 N -3.03 3.54 -0.27 6.98 0.00 -0.33 -4.80 121.76 123.85 2x7t s ALA 38 Ca 0.08 1.18 -0.16 0.00 0.00 0.00 0.00 51.96 53.06 2x7t s ALA 38 Cb 0.16 -3.49 -0.03 0.00 0.00 0.00 0.00 23.12 19.76 2x7t s ALA 38 CO 0.82 -0.59 0.43 0.21 0.00 0.00 0.00 175.76 176.64 2x7t s LYS 39 N -0.64 4.02 0.03 0.00 2.36 0.02 -4.79 119.74 120.74 2x7t s LYS 39 Ca 0.55 0.13 -0.30 0.00 -2.55 0.00 0.00 55.97 53.80 2x7t s LYS 39 Cb -0.38 -3.66 -0.07 0.00 -1.05 0.00 0.00 37.83 32.67 2x7t s LYS 39 CO 0.43 -0.32 1.52 -0.47 1.55 0.00 0.00 175.35 178.06 2x7t s TYR 40 N 2.17 2.63 -0.35 4.03 6.14 -1.26 -0.26 117.35 130.45 2x7t s TYR 40 Ca 0.17 0.58 0.02 0.00 0.64 0.00 0.00 57.07 58.48 2x7t s TYR 40 Cb -0.16 -3.81 0.10 0.00 0.42 0.00 0.00 41.96 38.52 2x7t s TYR 40 CO 0.10 -3.13 0.08 0.34 0.64 0.00 0.00 175.55 173.58 2x7t s ASP 41 N 2.16 4.88 0.37 4.32 3.68 -0.27 -4.88 116.67 126.93 2x7t s ASP 41 Ca 0.69 -2.06 0.25 0.00 2.13 0.00 0.00 52.55 53.56 2x7t s ASP 41 Cb -0.35 -1.68 1.35 0.00 -1.45 0.00 0.00 42.92 40.79 2x7t s ASP 41 CO 0.29 -0.41 1.78 1.55 0.13 0.00 0.00 175.17 178.51 2x7t h PRO 42 N 7.74 0.00 0.00 4.34 0.13 -1.92 -1.23 132.00 141.06 2x7t h PRO 42 Ca -0.08 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.05 2x7t h PRO 42 Cb 1.03 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.16 2x7t h PRO 42 CO 0.56 0.00 -0.30 -1.13 -0.23 0.00 0.00 178.00 176.91 2x7t n SER 43 N -2.39 0.33 -4.77 1.44 3.41 -1.26 -4.85 113.62 105.53 2x7t n SER 43 Ca -0.01 0.10 -0.40 0.00 -0.26 0.00 0.00 58.87 58.29 2x7t n SER 43 Cb 0.06 -0.09 -0.01 0.00 -0.26 0.00 0.00 64.21 63.92 2x7t n SER 43 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 2x7t s LEU 44 N -3.14 4.28 0.31 1.04 2.96 -0.47 -5.01 118.68 118.65 2x7t s LEU 44 Ca 0.12 2.74 0.06 0.00 -0.22 0.00 0.00 54.13 56.83 2x7t s LEU 44 Cb 0.18 -3.81 -0.01 0.00 0.50 0.00 0.00 46.19 43.05 2x7t s LEU 44 CO 0.63 -0.79 0.44 -0.54 -1.32 0.00 0.00 176.35 174.77 2x7t s LYS 45 N -2.12 3.19 0.61 1.98 1.02 -1.17 -5.01 119.74 118.24 2x7t s LYS 45 Ca 0.54 -0.96 -0.19 0.00 0.02 0.00 0.00 55.97 55.39 2x7t s LYS 45 Cb -0.40 -2.83 -0.03 0.00 -0.52 0.00 0.00 37.83 34.05 2x7t s LYS 45 CO 0.52 0.15 1.25 -2.14 -0.92 0.00 0.00 175.35 174.21 2x7t s PRO 46 N -4.13 2.83 0.30 -1.68 0.02 -1.26 -3.23 135.00 127.86 2x7t s PRO 46 Ca 0.42 1.93 -0.28 0.00 0.02 0.00 0.00 61.00 63.10 2x7t s PRO 46 Cb -0.09 -1.91 -0.09 0.00 0.02 0.00 0.00 34.50 32.42 2x7t s PRO 46 CO 0.31 -1.34 1.01 -0.51 -0.33 0.00 0.00 177.00 176.13 2x7t s LEU 47 N -4.15 4.44 -0.34 -5.54 1.43 -1.26 -0.60 118.68 112.66 2x7t s LEU 47 Ca 0.79 2.04 -0.03 0.00 -1.03 0.00 0.00 54.13 55.90 2x7t s LEU 47 Cb -0.33 -3.83 0.07 0.00 0.03 0.00 0.00 46.19 42.13 2x7t s LEU 47 CO 0.36 -0.12 0.09 -0.55 0.23 0.00 0.00 176.35 176.36 2x7t s SER 48 N -1.27 5.08 -0.37 2.29 0.15 0.21 -4.81 113.70 114.98 2x7t s SER 48 Ca 0.48 -1.51 -0.08 0.00 0.70 0.00 0.00 55.95 55.53 2x7t s SER 48 Cb -0.25 -1.78 0.06 0.00 -1.71 0.00 0.00 66.02 62.34 2x7t s SER 48 CO 0.32 -0.37 0.18 -0.69 1.20 0.00 0.00 173.24 173.88 2x7t s VAL 49 N 1.23 4.00 -0.68 4.45 1.01 -1.26 -0.53 120.40 128.63 2x7t s VAL 49 Ca 0.00 -1.24 -0.03 0.00 0.00 0.00 0.00 61.98 60.71 2x7t s VAL 49 Cb -0.21 -3.35 0.17 0.00 0.00 0.00 0.00 36.38 32.99 2x7t s VAL 49 CO -0.02 -0.33 0.51 -0.44 0.00 0.00 0.00 175.10 174.82 2x7t s SER 50 N 1.69 5.38 -0.02 3.32 0.01 -0.43 -4.90 113.70 118.75 2x7t s SER 50 Ca 0.01 -3.02 0.15 0.00 1.31 0.00 0.00 55.95 54.40 2x7t s SER 50 Cb -0.21 -1.87 0.44 0.00 0.21 0.00 0.00 66.02 64.59 2x7t s SER 50 CO 0.03 -0.34 1.37 -1.22 0.41 0.00 0.00 173.24 173.49 2x7t n TYR 51 N 3.28 0.70 0.26 2.43 0.53 -1.26 -1.63 117.16 121.47 2x7t n TYR 51 Ca 0.10 -0.53 0.09 0.00 -1.02 0.00 0.00 57.90 56.55 2x7t n TYR 51 Cb 0.38 -0.05 0.68 0.00 -1.03 0.00 0.00 39.34 39.32 2x7t n TYR 51 CO 0.00 0.00 0.00 0.38 -1.02 0.00 0.00 176.86 176.22 2x7t h ASP 52 N 2.77 0.00 -0.41 7.72 2.03 -1.91 -2.84 116.42 123.78 2x7t h ASP 52 Ca 0.00 0.00 -0.14 0.00 -0.73 0.00 0.00 57.03 56.16 2x7t h ASP 52 Cb 0.90 0.00 -0.08 0.00 -0.83 0.00 0.00 39.33 39.31 2x7t h ASP 52 CO 0.03 0.02 0.05 0.00 -1.03 0.00 0.00 179.24 178.32 2x7t n GLN 53 N -4.36 2.52 -1.85 4.15 1.13 -1.17 -5.03 117.38 112.78 2x7t n GLN 53 Ca -0.03 -3.03 -0.41 0.00 -1.94 0.00 0.00 57.00 51.59 2x7t n GLN 53 Cb 0.11 -1.91 -0.00 0.00 0.11 0.00 0.00 30.24 28.55 2x7t n GLN 53 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2x7t s ALA 54 N -3.06 3.53 -0.33 -1.58 0.00 -1.07 -4.64 121.76 114.61 2x7t s ALA 54 Ca 0.46 1.52 0.01 0.00 0.00 0.00 0.00 51.96 53.95 2x7t s ALA 54 Cb 0.39 -3.59 0.10 0.00 0.00 0.00 0.00 23.12 20.02 2x7t s ALA 54 CO 0.06 -1.01 0.09 0.99 0.00 0.00 0.00 175.76 175.89 2x7t s THR 55 N -1.13 1.39 0.51 0.00 2.01 -1.26 -4.92 115.64 112.24 2x7t s THR 55 Ca 0.53 -1.81 -0.19 0.00 0.31 0.00 0.00 61.69 60.53 2x7t s THR 55 Cb -0.45 -2.04 -0.08 0.00 0.01 0.00 0.00 72.50 69.94 2x7t s THR 55 CO 0.61 -0.67 1.02 -0.94 -0.69 0.00 0.00 174.62 173.96 2x7t s SER 56 N 1.27 6.34 -0.04 3.53 1.04 -1.26 -0.54 113.70 124.04 2x7t s SER 56 Ca 0.11 1.82 -0.02 0.00 0.48 0.00 0.00 55.95 58.33 2x7t s SER 56 Cb -0.18 -2.54 -0.02 0.00 0.10 0.00 0.00 66.02 63.37 2x7t s SER 56 CO -0.18 -0.78 -0.06 0.18 0.98 0.00 0.00 173.24 173.38 2x7t n LEU 57 N -1.25 0.44 -3.79 2.42 4.77 0.12 -4.23 117.00 115.49 2x7t n LEU 57 Ca 0.08 0.07 -0.04 0.00 -0.03 0.00 0.00 56.01 56.09 2x7t n LEU 57 Cb 0.53 -0.17 -0.01 0.00 -2.33 0.00 0.00 43.42 41.44 2x7t n LEU 57 CO 0.42 0.01 0.69 0.00 -1.33 0.00 0.00 177.39 177.18 2x7t s ARG 58 N -2.09 1.34 -0.06 3.23 1.70 -1.24 -1.58 118.95 120.25 2x7t s ARG 58 Ca -0.06 -0.76 0.05 0.00 -0.47 0.00 0.00 55.73 54.49 2x7t s ARG 58 Cb 0.02 0.44 -0.01 0.00 -0.57 0.00 0.00 34.95 34.83 2x7t s ARG 58 CO 0.08 -0.62 -0.23 -1.50 -1.08 0.00 0.00 175.30 171.96 2x7t s ILE 59 N -3.20 2.24 0.02 4.99 2.07 -0.58 -0.66 121.20 126.09 2x7t s ILE 59 Ca 0.13 -1.00 0.04 0.00 -1.41 0.00 0.00 60.65 58.42 2x7t s ILE 59 Cb -0.02 -1.83 -0.02 0.00 0.13 0.00 0.00 42.46 40.72 2x7t s ILE 59 CO 0.04 0.57 -0.13 -0.22 -1.91 0.00 0.00 174.94 173.29 2x7t s LEU 60 N -0.18 2.13 -0.39 8.50 2.96 0.43 -1.59 118.68 130.54 2x7t s LEU 60 Ca -0.03 -0.38 -0.13 0.00 -0.22 0.00 0.00 54.13 53.37 2x7t s LEU 60 Cb -0.14 -0.56 0.02 0.00 0.50 0.00 0.00 46.19 46.01 2x7t s LEU 60 CO 0.04 0.05 0.26 0.21 -1.32 0.00 0.00 176.35 175.58 2x7t s ASN 61 N -0.88 5.93 0.00 3.68 3.84 -0.45 0.13 114.94 127.20 2x7t s ASN 61 Ca 0.02 -0.95 0.22 0.00 0.21 0.00 0.00 52.86 52.35 2x7t s ASN 61 Cb -0.07 -2.10 0.60 0.00 -0.55 0.00 0.00 41.25 39.14 2x7t s ASN 61 CO 0.01 -0.42 1.48 -0.46 -2.79 0.00 0.00 177.10 174.91 2x7t n ASN 62 N 5.08 2.37 0.00 -4.21 0.23 -0.90 -1.00 115.26 116.83 2x7t n ASN 62 Ca -0.11 -1.83 0.00 0.00 -0.53 0.00 0.00 54.58 52.11 2x7t n ASN 62 Cb 0.46 -0.16 0.00 0.00 -2.08 0.00 0.00 39.78 38.01 2x7t n ASN 62 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2x7t n GLY 63 N 1.27 1.08 0.38 4.83 0.00 -1.26 -4.79 105.19 106.70 2x7t n GLY 63 Ca 0.17 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.18 2x7t n GLY 63 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2x7t n HIS 64 N -2.00 0.00 -2.17 1.61 8.25 -1.26 -4.74 115.22 114.91 2x7t n HIS 64 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2x7t n HIS 64 Cb 0.00 -0.04 0.00 0.00 1.12 0.00 0.00 29.99 31.07 2x7t n HIS 64 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2x7t n ALA 65 N -2.73 0.00 -2.51 -1.41 0.00 -1.26 -4.84 120.51 107.76 2x7t n ALA 65 Ca -0.02 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.17 2x7t n ALA 65 Cb 0.52 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.83 2x7t n ALA 65 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 2x7t s PHE 66 N -3.79 1.73 -0.07 0.00 -0.12 -1.26 -2.13 117.98 112.35 2x7t s PHE 66 Ca 0.00 -0.37 0.05 0.00 -0.05 0.00 0.00 56.93 56.55 2x7t s PHE 66 Cb 0.00 -1.02 -0.00 0.00 -0.63 0.00 0.00 43.02 41.36 2x7t s PHE 66 CO 0.00 0.09 -0.22 -0.80 -0.05 0.00 0.00 175.22 174.24 2x7t s ASN 67 N -1.23 2.80 -0.33 1.98 0.01 0.12 -4.24 114.94 114.05 2x7t s ASN 67 Ca 0.07 -0.48 -0.11 0.00 -0.71 0.00 0.00 52.86 51.63 2x7t s ASN 67 Cb -0.09 -0.97 -0.00 0.00 0.41 0.00 0.00 41.25 40.60 2x7t s ASN 67 CO 0.02 0.19 0.19 -0.69 -1.51 0.00 0.00 177.10 175.30 2x7t s VAL 68 N 0.09 4.82 0.16 1.60 1.01 -0.76 -0.43 120.40 126.89 2x7t s VAL 68 Ca -0.09 -0.44 -0.03 0.00 0.00 0.00 0.00 61.98 61.42 2x7t s VAL 68 Cb -0.15 -3.51 -0.05 0.00 0.00 0.00 0.00 36.38 32.68 2x7t s VAL 68 CO 0.05 -0.02 0.37 -1.61 0.00 0.00 0.00 175.10 173.90 2x7t s GLU 69 N 1.64 3.57 0.28 2.72 2.02 0.16 -2.00 118.70 127.10 2x7t s GLU 69 Ca 0.05 -0.19 0.07 0.00 0.02 0.00 0.00 54.97 54.92 2x7t s GLU 69 Cb -0.18 -2.85 -0.06 0.00 0.10 0.00 0.00 34.13 31.15 2x7t s GLU 69 CO 0.08 0.45 -0.08 -0.06 0.02 0.00 0.00 175.26 175.66 2x7t s PHE 70 N -1.73 2.00 -0.42 1.61 0.40 -0.62 0.13 117.98 119.36 2x7t s PHE 70 Ca 0.40 -0.64 -0.26 0.00 -0.60 0.00 0.00 56.93 55.83 2x7t s PHE 70 Cb -0.12 -1.10 0.02 0.00 0.51 0.00 0.00 43.02 42.33 2x7t s PHE 70 CO 0.26 0.35 0.97 0.34 0.70 0.00 0.00 175.22 177.85 2x7t s ASP 71 N -3.45 6.63 -0.32 1.36 2.15 0.30 -4.85 116.67 118.49 2x7t s ASP 71 Ca 0.29 0.43 0.09 0.00 0.43 0.00 0.00 52.55 53.79 2x7t s ASP 71 Cb 0.02 -2.48 0.57 0.00 -0.30 0.00 0.00 42.92 40.74 2x7t s ASP 71 CO 0.12 -0.99 1.60 -0.90 -0.17 0.00 0.00 175.17 174.83 2x7t n ASP 72 N 7.10 3.17 -0.29 -0.34 3.85 -1.26 -4.52 116.55 124.26 2x7t n ASP 72 Ca 0.08 -3.59 0.15 0.00 -0.71 0.00 0.00 54.79 50.71 2x7t n ASP 72 Cb 0.48 -0.68 0.66 0.00 -1.35 0.00 0.00 41.12 40.23 2x7t n ASP 72 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.20 174.65 2x7t n SER 73 N -0.96 0.92 -3.88 -1.12 3.41 -1.26 -4.87 113.62 105.86 2x7t n SER 73 Ca 0.39 -1.24 -0.10 0.00 -0.26 0.00 0.00 58.87 57.66 2x7t n SER 73 Cb 1.20 -0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 65.09 2x7t n SER 73 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 2x7t s GLN 74 N -2.06 1.22 -1.55 4.33 -0.21 -1.26 -5.05 119.66 115.08 2x7t s GLN 74 Ca 0.40 -1.05 -0.10 0.00 0.02 0.00 0.00 55.36 54.63 2x7t s GLN 74 Cb 0.21 0.43 -0.09 0.00 1.00 0.00 0.00 33.01 34.55 2x7t s GLN 74 CO 0.36 -0.47 2.94 -0.25 -2.12 0.00 0.00 175.29 175.76 2x7t n ASP 75 N -0.25 8.49 0.04 5.90 8.00 -1.26 -4.52 116.55 132.94 2x7t n ASP 75 Ca -0.09 -2.55 -0.08 0.00 0.71 0.00 0.00 54.79 52.78 2x7t n ASP 75 Cb 0.63 -1.53 -0.13 0.00 -0.02 0.00 0.00 41.12 40.07 2x7t n ASP 75 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 2x7t h LYS 76 N 5.01 0.02 -2.70 -1.24 1.57 -1.86 -3.43 116.57 113.93 2x7t h LYS 76 Ca 0.84 -0.04 -0.47 0.00 -1.87 0.00 0.00 60.65 59.11 2x7t h LYS 76 Cb 0.31 0.01 -0.39 0.00 0.08 0.00 0.00 32.23 32.25 2x7t h LYS 76 CO 1.73 0.85 -0.74 0.00 -0.57 0.00 0.00 179.45 180.72 2x7t s ALA 77 N -2.67 0.34 0.17 3.86 0.00 -1.26 -3.06 121.76 119.14 2x7t s ALA 77 Ca -0.02 -0.74 0.07 0.00 0.00 0.00 0.00 51.96 51.28 2x7t s ALA 77 Cb 0.09 -1.40 -0.04 0.00 0.00 0.00 0.00 23.12 21.77 2x7t s ALA 77 CO 0.83 -1.55 -0.15 0.14 0.00 0.00 0.00 175.76 175.03 2x7t s VAL 78 N 2.17 1.59 -0.11 0.00 -7.23 -0.65 -1.00 120.40 115.17 2x7t s VAL 78 Ca 0.08 -2.01 0.02 0.00 -1.81 0.00 0.00 61.98 58.26 2x7t s VAL 78 Cb -0.16 -1.85 -0.01 0.00 0.56 0.00 0.00 36.38 34.93 2x7t s VAL 78 CO -0.30 -0.51 -0.19 -0.22 -0.31 0.00 0.00 175.10 173.58 2x7t s LEU 79 N -2.94 2.40 0.28 1.32 0.20 0.19 -1.31 118.68 118.81 2x7t s LEU 79 Ca 0.17 -0.45 -0.06 0.00 0.69 0.00 0.00 54.13 54.48 2x7t s LEU 79 Cb -0.02 -1.51 -0.01 0.00 -0.43 0.00 0.00 46.19 44.22 2x7t s LEU 79 CO 0.05 0.16 0.42 -1.59 -0.29 0.00 0.00 176.35 175.10 2x7t s LYS 80 N 0.35 1.64 3.79 1.98 -2.85 0.31 -2.04 119.74 122.92 2x7t s LYS 80 Ca -0.15 -1.53 0.00 0.00 -1.00 0.00 0.00 55.97 53.29 2x7t s LYS 80 Cb -0.17 0.43 0.00 0.00 -2.06 0.00 0.00 37.83 36.03 2x7t s LYS 80 CO 0.07 -0.66 0.00 0.41 0.10 0.00 0.00 175.35 175.27 2x7t n GLY 81 N -0.44 0.40 7.00 0.59 0.00 -1.26 0.65 105.19 112.12 2x7t n GLY 81 Ca 0.00 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 45.11 2x7t n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2x7t n GLY 82 N 0.00 3.23 0.73 -0.02 0.00 0.23 -0.37 105.19 108.98 2x7t n GLY 82 Ca 0.00 -0.09 0.13 0.00 0.00 0.00 0.00 46.02 46.06 2x7t n GLY 82 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2x7t n PRO 83 N 14.00 1.99 -2.41 1.61 -0.04 -1.26 -3.02 135.00 145.87 2x7t n PRO 83 Ca 0.00 -1.45 -0.29 0.00 -0.04 0.00 0.00 63.50 61.72 2x7t n PRO 83 Cb 0.00 -1.47 -0.00 0.00 -0.04 0.00 0.00 33.50 31.99 2x7t n PRO 83 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2x7t s LEU 84 N -1.90 3.52 -0.09 1.53 1.43 0.51 -5.08 118.68 118.60 2x7t s LEU 84 Ca 0.34 1.12 0.03 0.00 -1.03 0.00 0.00 54.13 54.58 2x7t s LEU 84 Cb 0.20 -4.10 0.01 0.00 0.03 0.00 0.00 46.19 42.34 2x7t s LEU 84 CO 0.31 -0.65 -0.17 -1.81 0.23 0.00 0.00 176.35 174.26 2x7t s ASP 85 N -4.01 2.37 0.00 2.29 1.11 -1.26 -4.29 116.67 112.87 2x7t s ASP 85 Ca 0.50 -0.42 0.00 0.00 0.18 0.00 0.00 52.55 52.82 2x7t s ASP 85 Cb -0.10 -1.08 0.00 0.00 1.07 0.00 0.00 42.92 42.81 2x7t s ASP 85 CO 0.46 0.06 0.00 0.61 1.18 0.00 0.00 175.17 177.48 2x7t n GLY 86 N 3.86 -2.31 3.70 0.21 0.00 -1.26 -4.95 105.19 104.44 2x7t n GLY 86 Ca -0.21 -1.73 -0.34 0.00 0.00 0.00 0.00 46.02 43.75 2x7t n GLY 86 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2x7t s THR 87 N -0.31 4.35 -0.15 2.61 2.01 -1.26 -4.55 115.64 118.34 2x7t s THR 87 Ca 0.00 -0.39 0.00 0.00 0.31 0.00 0.00 61.69 61.61 2x7t s THR 87 Cb 0.00 -2.90 0.02 0.00 0.01 0.00 0.00 72.50 69.64 2x7t s THR 87 CO 0.00 0.48 -0.14 -0.31 -0.69 0.00 0.00 174.62 173.96 2x7t s TYR 88 N -1.01 2.22 0.02 4.92 2.02 -0.87 -1.43 117.35 123.22 2x7t s TYR 88 Ca 0.17 -1.27 -0.22 0.00 -0.37 0.00 0.00 57.07 55.37 2x7t s TYR 88 Cb -0.12 -1.62 -0.05 0.00 -0.40 0.00 0.00 41.96 39.77 2x7t s TYR 88 CO 0.07 -0.68 0.67 1.03 -1.57 0.00 0.00 175.55 175.06 2x7t s ARG 89 N 1.47 4.39 -0.01 -0.62 0.52 -0.26 -0.64 118.95 123.82 2x7t s ARG 89 Ca 0.05 0.88 -0.30 0.00 -0.52 0.00 0.00 55.73 55.83 2x7t s ARG 89 Cb -0.13 -3.35 -0.06 0.00 0.52 0.00 0.00 34.95 31.93 2x7t s ARG 89 CO -0.11 0.33 1.44 -1.17 0.02 0.00 0.00 175.30 175.81 2x7t s LEU 90 N -0.14 4.31 -0.15 2.53 2.96 -0.17 -1.10 118.68 126.92 2x7t s LEU 90 Ca 0.34 2.14 0.08 0.00 -0.22 0.00 0.00 54.13 56.46 2x7t s LEU 90 Cb -0.19 -3.56 -0.15 0.00 0.50 0.00 0.00 46.19 42.80 2x7t s LEU 90 CO 0.20 -0.75 -0.03 0.00 -1.32 0.00 0.00 176.35 174.44 2x7t n ILE 91 N 4.77 0.95 -3.65 6.68 3.06 0.49 -4.52 119.36 127.14 2x7t n ILE 91 Ca 0.14 -0.49 0.00 0.00 -2.50 0.00 0.00 62.75 59.90 2x7t n ILE 91 Cb 0.43 -0.83 -0.01 0.00 0.54 0.00 0.00 39.64 39.77 2x7t n ILE 91 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2x7t s GLN 92 N -2.34 0.58 0.01 9.51 1.03 -1.22 -1.58 119.66 125.64 2x7t s GLN 92 Ca -0.13 -0.32 -0.03 0.00 0.04 0.00 0.00 55.36 54.92 2x7t s GLN 92 Cb 0.05 0.20 -0.01 0.00 0.03 0.00 0.00 33.01 33.28 2x7t s GLN 92 CO 0.49 -0.26 0.04 -0.59 -2.54 0.00 0.00 175.29 172.43 2x7t s PHE 93 N -2.62 0.12 0.35 9.60 -0.12 -0.85 -0.82 117.98 123.65 2x7t s PHE 93 Ca 0.14 -0.26 -0.00 0.00 -0.05 0.00 0.00 56.93 56.76 2x7t s PHE 93 Cb 0.03 -0.10 0.00 0.00 -0.63 0.00 0.00 43.02 42.33 2x7t s PHE 93 CO -0.03 -0.18 0.45 -2.39 -0.05 0.00 0.00 175.22 173.02 2x7t n HIS 94 N 1.89 -1.33 -4.28 3.49 1.44 -0.76 -1.83 115.22 113.85 2x7t n HIS 94 Ca -0.21 -2.42 -0.15 0.00 -2.01 0.00 0.00 57.72 52.93 2x7t n HIS 94 Cb 0.56 0.50 -0.10 0.00 0.12 0.00 0.00 29.99 31.07 2x7t n HIS 94 CO 0.00 0.00 0.00 -0.06 -2.81 0.00 0.00 176.34 173.47 2x7t s PHE 95 N -3.00 1.35 -0.09 -1.40 0.40 -1.26 -0.95 117.98 113.03 2x7t s PHE 95 Ca 0.31 -0.96 0.00 0.00 -0.60 0.00 0.00 56.93 55.68 2x7t s PHE 95 Cb -0.00 -0.77 0.02 0.00 0.51 0.00 0.00 43.02 42.78 2x7t s PHE 95 CO 0.22 -0.12 -0.08 -1.01 0.70 0.00 0.00 175.22 174.92 2x7t s HIS 96 N -3.54 1.36 0.24 0.36 3.76 -0.42 -4.76 115.29 112.29 2x7t s HIS 96 Ca 0.25 -0.60 0.01 0.00 -0.15 0.00 0.00 55.06 54.57 2x7t s HIS 96 Cb 0.06 -1.11 -0.04 0.00 1.11 0.00 0.00 32.58 32.60 2x7t s HIS 96 CO 0.06 -0.41 0.15 1.67 -0.85 0.00 0.00 174.74 175.36 2x7t s TRP 97 N 1.36 1.36 0.26 1.40 -2.14 -1.24 -1.01 118.94 118.93 2x7t s TRP 97 Ca -0.02 -1.39 0.02 0.00 2.66 0.00 0.00 56.10 57.37 2x7t s TRP 97 Cb -0.14 -0.68 0.02 0.00 -3.10 0.00 0.00 33.47 29.58 2x7t s TRP 97 CO -0.04 -0.61 0.18 0.41 -2.66 0.00 0.00 176.95 174.23 2x7t n GLY 98 N -0.39 2.98 0.14 3.67 0.00 -1.15 -1.07 105.19 109.36 2x7t n GLY 98 Ca 0.02 -2.23 0.12 0.00 0.00 0.00 0.00 46.02 43.93 2x7t n GLY 98 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2x7t h SER 99 N 0.33 0.00 -4.53 1.61 4.64 -1.89 -3.37 113.55 110.34 2x7t h SER 99 Ca -0.17 -0.02 -0.27 0.00 -0.47 0.00 0.00 61.79 60.86 2x7t h SER 99 Cb 0.59 0.00 -0.17 0.00 -0.31 0.00 0.00 62.40 62.51 2x7t h SER 99 CO 0.26 0.01 -0.72 -0.76 -0.87 0.00 0.00 176.83 174.75 2x7t s LEU 100 N -5.51 2.42 0.61 5.97 2.01 -1.26 -5.04 118.68 117.88 2x7t s LEU 100 Ca 0.02 -0.84 0.38 0.00 0.01 0.00 0.00 54.13 53.70 2x7t s LEU 100 Cb 0.09 -0.19 2.01 0.00 0.01 0.00 0.00 46.19 48.10 2x7t s LEU 100 CO 0.75 -0.33 2.25 0.44 1.01 0.00 0.00 176.35 180.46 2x7t h ASP 101 N 3.50 0.00 0.20 2.29 3.45 -1.90 -2.53 116.42 121.44 2x7t h ASP 101 Ca -0.36 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.10 2x7t h ASP 101 Cb 1.18 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.95 2x7t h ASP 101 CO 0.55 0.02 0.00 0.61 -1.57 0.00 0.00 179.24 178.85 2x7t n GLY 102 N -0.87 -1.05 3.31 2.75 0.00 -1.26 -3.08 105.19 105.00 2x7t n GLY 102 Ca -0.02 -0.17 -0.09 0.00 0.00 0.00 0.00 46.02 45.74 2x7t n GLY 102 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2x7t s GLN 103 N -2.21 1.07 0.00 1.61 -2.07 -0.95 -4.67 119.66 112.44 2x7t s GLN 103 Ca 0.38 -0.99 0.00 0.00 -1.82 0.00 0.00 55.36 52.93 2x7t s GLN 103 Cb 0.20 0.40 0.00 0.00 -1.09 0.00 0.00 33.01 32.52 2x7t s GLN 103 CO 0.38 -0.39 0.00 0.41 -1.32 0.00 0.00 175.29 174.37 2x7t n GLY 104 N -0.18 3.76 3.79 2.60 0.00 -1.05 -3.09 105.19 111.01 2x7t n GLY 104 Ca -0.12 -0.55 -0.31 0.00 0.00 0.00 0.00 46.02 45.04 2x7t n GLY 104 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2x7t s SER 105 N 0.00 4.96 -0.24 1.61 1.04 -0.46 -3.66 113.70 116.95 2x7t s SER 105 Ca 0.00 1.78 -0.18 0.00 0.48 0.00 0.00 55.95 58.03 2x7t s SER 105 Cb 0.00 -2.52 -0.15 0.00 0.10 0.00 0.00 66.02 63.45 2x7t s SER 105 CO 0.00 -1.73 -0.07 -0.62 0.98 0.00 0.00 173.24 171.81 2x7t n GLU 106 N -3.13 0.57 -2.76 4.02 1.02 -1.26 -4.83 120.64 114.26 2x7t n GLU 106 Ca 0.09 0.42 -0.32 0.00 -0.02 0.00 0.00 57.16 57.33 2x7t n GLU 106 Cb 0.53 -1.62 -0.06 0.00 -0.02 0.00 0.00 31.44 30.27 2x7t n GLU 106 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 2x7t s HIS 107 N -2.44 3.38 0.15 -0.32 3.76 -1.26 -4.29 115.29 114.26 2x7t s HIS 107 Ca -0.33 1.45 0.08 0.00 -0.15 0.00 0.00 55.06 56.10 2x7t s HIS 107 Cb 0.10 -2.74 -0.04 0.00 1.11 0.00 0.00 32.58 31.01 2x7t s HIS 107 CO 0.54 -0.14 -0.17 0.95 -0.85 0.00 0.00 174.74 175.06 2x7t s THR 108 N -2.29 1.65 -0.26 1.30 -4.23 -1.17 -4.68 115.64 105.97 2x7t s THR 108 Ca 0.59 -1.82 0.01 0.00 -1.18 0.00 0.00 61.69 59.29 2x7t s THR 108 Cb -0.10 -1.72 0.05 0.00 1.34 0.00 0.00 72.50 72.07 2x7t s THR 108 CO 0.21 -0.33 -0.09 -0.69 -0.54 0.00 0.00 174.62 173.18 2x7t s VAL 109 N -2.00 2.46 -1.47 2.29 1.01 -0.75 0.61 120.40 122.55 2x7t s VAL 109 Ca 0.13 -1.41 -0.10 0.00 0.00 0.00 0.00 61.98 60.59 2x7t s VAL 109 Cb -0.06 -2.37 0.06 0.00 0.00 0.00 0.00 36.38 34.01 2x7t s VAL 109 CO 0.05 0.05 0.92 0.47 0.00 0.00 0.00 175.10 176.59 2x7t n ASP 110 N 4.53 -3.99 0.00 3.32 10.43 0.74 -0.61 116.55 130.98 2x7t n ASP 110 Ca -0.15 -0.78 0.00 0.00 2.57 0.00 0.00 54.79 56.43 2x7t n ASP 110 Cb 0.44 -3.98 0.00 0.00 1.84 0.00 0.00 41.12 39.42 2x7t n ASP 110 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 2x7t n LYS 111 N -4.61 0.00 -2.55 -1.24 4.76 -1.26 -5.00 118.16 108.27 2x7t n LYS 111 Ca -0.04 0.00 -0.41 0.00 -2.87 0.00 0.00 58.31 54.98 2x7t n LYS 111 Cb 0.57 -2.65 -0.04 0.00 -1.84 0.00 0.00 35.03 31.07 2x7t n LYS 111 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 2x7t s LYS 112 N -0.14 4.57 -0.12 1.97 2.20 0.22 -4.99 119.74 123.44 2x7t s LYS 112 Ca 0.00 1.66 -0.04 0.00 -0.36 0.00 0.00 55.97 57.22 2x7t s LYS 112 Cb 0.00 -3.33 -0.04 0.00 -1.51 0.00 0.00 37.83 32.96 2x7t s LYS 112 CO 0.00 0.00 0.04 0.15 -0.36 0.00 0.00 175.35 175.18 2x7t s LYS 113 N 0.17 3.37 0.48 4.03 1.02 -1.26 -1.82 119.74 125.74 2x7t s LYS 113 Ca 0.51 -0.35 0.03 0.00 0.02 0.00 0.00 55.97 56.18 2x7t s LYS 113 Cb -0.28 -2.98 0.02 0.00 -0.52 0.00 0.00 37.83 34.07 2x7t s LYS 113 CO 0.32 0.57 0.68 0.71 -0.92 0.00 0.00 175.35 176.72 2x7t s TYR 114 N -0.49 2.96 0.42 3.18 1.51 -1.26 -4.62 117.35 119.04 2x7t s TYR 114 Ca 0.09 -0.05 0.15 0.00 -1.01 0.00 0.00 57.07 56.25 2x7t s TYR 114 Cb -0.12 -2.51 0.93 0.00 -0.11 0.00 0.00 41.96 40.14 2x7t s TYR 114 CO 0.02 -0.59 1.94 0.00 -1.11 0.00 0.00 175.55 175.80 2x7t h ALA 115 N 0.33 1.55 -2.92 3.71 0.00 -1.33 -1.16 119.26 119.44 2x7t h ALA 115 Ca -0.43 -0.23 0.05 0.00 0.00 0.00 0.00 54.91 54.31 2x7t h ALA 115 Cb 1.28 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 19.00 2x7t h ALA 115 CO 0.52 0.31 0.29 0.00 0.00 0.00 0.00 179.25 180.37 2x7t s ALA 116 N -4.44 -1.10 -0.12 0.00 0.00 -1.09 -2.94 121.76 112.08 2x7t s ALA 116 Ca -0.03 -0.44 -0.05 0.00 0.00 0.00 0.00 51.96 51.43 2x7t s ALA 116 Cb 0.15 0.76 0.05 0.00 0.00 0.00 0.00 23.12 24.09 2x7t s ALA 116 CO 0.70 -1.02 0.27 -2.00 0.00 0.00 0.00 175.76 173.71 2x7t s GLU 117 N -3.18 0.20 -0.06 0.00 2.12 -0.18 -1.34 118.70 116.26 2x7t s GLU 117 Ca 0.13 0.63 -0.15 0.00 0.36 0.00 0.00 54.97 55.94 2x7t s GLU 117 Cb -0.05 -0.08 -0.05 0.00 0.26 0.00 0.00 34.13 34.21 2x7t s GLU 117 CO 0.08 -0.20 0.40 -1.17 -0.54 0.00 0.00 175.26 173.82 2x7t s LEU 118 N 1.68 4.39 -0.17 2.70 2.96 0.10 -1.30 118.68 129.04 2x7t s LEU 118 Ca -0.06 0.84 0.01 0.00 -0.22 0.00 0.00 54.13 54.69 2x7t s LEU 118 Cb -0.11 -2.56 0.03 0.00 0.50 0.00 0.00 46.19 44.05 2x7t s LEU 118 CO -0.09 0.21 -0.15 -1.00 -1.32 0.00 0.00 176.35 174.00 2x7t s HIS 119 N -0.40 2.41 -0.39 5.38 3.76 -0.13 -1.26 115.29 124.66 2x7t s HIS 119 Ca 0.23 -1.42 -0.11 0.00 -0.15 0.00 0.00 55.06 53.60 2x7t s HIS 119 Cb -0.16 -1.70 0.04 0.00 1.11 0.00 0.00 32.58 31.87 2x7t s HIS 119 CO 0.11 -0.73 0.23 -0.51 -0.85 0.00 0.00 174.74 172.99 2x7t s LEU 120 N 1.41 4.85 -0.18 0.89 1.43 -0.71 -1.83 118.68 124.54 2x7t s LEU 120 Ca 0.04 -1.08 -0.19 0.00 -1.03 0.00 0.00 54.13 51.87 2x7t s LEU 120 Cb -0.13 -2.03 -0.03 0.00 0.03 0.00 0.00 46.19 44.02 2x7t s LEU 120 CO -0.11 -0.43 0.54 -0.69 0.23 0.00 0.00 176.35 175.90 2x7t s VAL 121 N 1.55 5.10 0.05 -1.59 1.01 0.00 -1.36 120.40 125.16 2x7t s VAL 121 Ca 0.02 1.02 0.06 0.00 0.00 0.00 0.00 61.98 63.08 2x7t s VAL 121 Cb -0.20 -3.86 -0.02 0.00 0.00 0.00 0.00 36.38 32.29 2x7t s VAL 121 CO 0.06 0.19 -0.18 -1.00 0.00 0.00 0.00 175.10 174.17 2x7t s HIS 122 N 1.51 1.56 0.09 5.22 3.76 -0.56 -0.38 115.29 126.49 2x7t s HIS 122 Ca 0.26 -0.37 0.10 0.00 -0.15 0.00 0.00 55.06 54.89 2x7t s HIS 122 Cb -0.16 -0.92 -0.04 0.00 1.11 0.00 0.00 32.58 32.58 2x7t s HIS 122 CO 0.10 0.08 -0.25 1.67 -0.85 0.00 0.00 174.74 175.49 2x7t s TRP 123 N -0.86 2.36 -0.08 1.40 1.48 -0.26 -1.19 118.94 121.79 2x7t s TRP 123 Ca 0.05 -0.37 -0.29 0.00 -1.06 0.00 0.00 56.10 54.43 2x7t s TRP 123 Cb -0.09 -1.33 -0.06 0.00 -1.16 0.00 0.00 33.47 30.84 2x7t s TRP 123 CO 0.02 0.27 1.81 1.21 -4.06 0.00 0.00 176.95 176.19 2x7t s ASN 124 N -1.74 6.39 0.66 -2.66 3.84 0.17 -1.10 114.94 120.50 2x7t s ASN 124 Ca 0.14 2.19 0.43 0.00 0.21 0.00 0.00 52.86 55.83 2x7t s ASN 124 Cb -0.10 -2.53 2.35 0.00 -0.55 0.00 0.00 41.25 40.42 2x7t s ASN 124 CO 0.05 -1.16 2.35 0.71 -2.79 0.00 0.00 177.10 176.26 2x7t h THR 125 N 5.91 0.04 0.00 -5.21 1.35 -1.58 -1.57 112.91 111.85 2x7t h THR 125 Ca -0.41 -0.03 0.00 0.00 -0.55 0.00 0.00 66.41 65.42 2x7t h THR 125 Cb 1.20 1.03 0.00 0.00 -1.73 0.00 0.00 68.15 68.65 2x7t h THR 125 CO 0.96 0.00 0.00 2.29 -0.25 0.00 0.00 175.52 178.52 2x7t n LYS 126 N -3.13 0.13 -0.28 4.72 2.85 -1.26 -2.50 118.16 118.68 2x7t n LYS 126 Ca -0.03 0.17 0.10 0.00 -1.05 0.00 0.00 58.31 57.50 2x7t n LYS 126 Cb 0.08 -1.50 0.25 0.00 -0.65 0.00 0.00 35.03 33.22 2x7t n LYS 126 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2x7t n TYR 127 N -1.38 0.75 0.00 5.58 0.53 -0.59 -5.01 117.16 117.03 2x7t n TYR 127 Ca 0.06 -0.46 0.00 0.00 -1.02 0.00 0.00 57.90 56.48 2x7t n TYR 127 Cb 0.16 -0.01 0.00 0.00 -1.03 0.00 0.00 39.34 38.46 2x7t n TYR 127 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 2x7t n GLY 128 N 1.26 0.75 3.37 2.72 0.00 -1.04 -4.46 105.19 107.78 2x7t n GLY 128 Ca 0.20 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.12 2x7t n GLY 128 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2x7t s ASP 129 N 0.00 -0.09 0.28 1.61 1.47 -1.26 -5.05 116.67 113.62 2x7t s ASP 129 Ca 0.00 -0.61 -0.03 0.00 1.18 0.00 0.00 52.55 53.09 2x7t s ASP 129 Cb 0.00 0.47 0.41 0.00 -0.34 0.00 0.00 42.92 43.46 2x7t s ASP 129 CO 0.00 -0.91 1.93 0.15 0.68 0.00 0.00 175.17 177.01 2x7t h PHE 130 N 2.43 1.14 -0.99 2.11 3.04 -1.94 -1.70 116.94 121.03 2x7t h PHE 130 Ca -0.32 0.03 0.06 0.00 3.98 0.00 0.00 57.97 61.72 2x7t h PHE 130 Cb 1.24 -0.38 -0.06 0.00 2.56 0.00 0.00 35.95 39.30 2x7t h PHE 130 CO 0.37 0.66 0.64 0.78 -2.02 0.00 0.00 178.31 178.75 2x7t h GLY 131 N 1.18 1.49 1.67 2.40 0.00 -1.96 -2.27 103.07 105.57 2x7t h GLY 131 Ca 0.37 -0.48 -0.25 0.00 0.00 0.00 0.00 47.33 46.97 2x7t h GLY 131 CO -0.11 0.36 -1.14 0.50 0.00 0.00 0.00 176.54 176.14 2x7t h LYS 132 N 1.18 0.26 -0.61 4.80 1.79 -1.73 -3.33 116.57 118.93 2x7t h LYS 132 Ca 0.42 -0.40 0.03 0.00 -2.18 0.00 0.00 60.65 58.52 2x7t h LYS 132 Cb 0.13 0.14 -0.04 0.00 -1.58 0.00 0.00 32.23 30.88 2x7t h LYS 132 CO -0.16 1.16 0.38 0.00 -1.08 0.00 0.00 179.45 179.75 2x7t h ALA 133 N 0.68 0.79 0.00 3.86 0.00 -0.77 -2.52 119.26 121.29 2x7t h ALA 133 Ca -0.11 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2x7t h ALA 133 Cb 1.85 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.45 2x7t h ALA 133 CO 0.19 0.12 0.00 1.33 0.00 0.00 0.00 179.25 180.89 2x7t n VAL 134 N -4.73 1.08 1.08 0.00 0.24 -0.91 -0.89 118.33 114.21 2x7t n VAL 134 Ca 0.05 0.62 0.11 0.00 -2.04 0.00 0.00 64.34 63.08 2x7t n VAL 134 Cb 0.08 -1.60 0.34 0.00 -1.47 0.00 0.00 33.84 31.18 2x7t n VAL 134 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2x7t n GLN 135 N -2.18 1.85 -4.69 7.34 6.02 -0.95 -4.55 117.38 120.22 2x7t n GLN 135 Ca -0.01 -1.29 -0.31 0.00 -0.01 0.00 0.00 57.00 55.39 2x7t n GLN 135 Cb 0.07 -1.41 -0.13 0.00 1.02 0.00 0.00 30.24 29.79 2x7t n GLN 135 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2x7t s GLN 136 N -1.74 2.17 0.56 -1.09 -1.52 -0.07 -5.02 119.66 112.95 2x7t s GLN 136 Ca 0.33 -0.92 0.26 0.00 -1.95 0.00 0.00 55.36 53.07 2x7t s GLN 136 Cb 0.18 -2.23 1.64 0.00 -0.22 0.00 0.00 33.01 32.38 2x7t s GLN 136 CO 0.27 0.56 2.21 -1.00 -0.25 0.00 0.00 175.29 177.07 2x7t h PRO 137 N 4.66 0.00 -0.45 2.91 0.13 -1.85 -2.50 132.00 134.91 2x7t h PRO 137 Ca -0.47 0.00 -0.33 0.00 -0.87 0.00 0.00 66.00 64.33 2x7t h PRO 137 Cb 1.15 0.00 -0.32 0.00 0.13 0.00 0.00 31.00 31.97 2x7t h PRO 137 CO 0.48 0.02 -0.82 -0.40 -0.23 0.00 0.00 178.00 177.05 2x7t n ASP 138 N -4.01 3.21 0.09 1.44 3.85 -1.26 -4.11 116.55 115.75 2x7t n ASP 138 Ca -0.03 -3.32 -0.01 0.00 -0.71 0.00 0.00 54.79 50.72 2x7t n ASP 138 Cb 0.10 -0.41 -0.04 0.00 -1.35 0.00 0.00 41.12 39.42 2x7t n ASP 138 CO 0.00 0.00 0.00 1.23 -1.01 0.00 0.00 177.20 177.42 2x7t h GLY 139 N 1.87 0.00 -3.33 6.12 0.00 -1.38 -3.43 103.07 102.93 2x7t h GLY 139 Ca 0.14 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 46.94 2x7t h GLY 139 CO 0.42 0.00 -0.78 1.08 0.00 0.00 0.00 176.54 177.25 2x7t s LEU 140 N -6.44 2.43 -0.14 3.11 1.43 -0.19 0.44 118.68 119.33 2x7t s LEU 140 Ca 0.02 -0.85 -0.03 0.00 -1.03 0.00 0.00 54.13 52.23 2x7t s LEU 140 Cb 0.08 -0.83 0.05 0.00 0.03 0.00 0.00 46.19 45.53 2x7t s LEU 140 CO 0.78 -0.03 0.06 0.00 0.23 0.00 0.00 176.35 177.39 2x7t s ALA 141 N -2.01 0.56 -0.20 4.21 0.00 -0.33 -1.25 121.76 122.74 2x7t s ALA 141 Ca 0.15 -0.28 -0.04 0.00 0.00 0.00 0.00 51.96 51.79 2x7t s ALA 141 Cb -0.06 -0.96 -0.02 0.00 0.00 0.00 0.00 23.12 22.09 2x7t s ALA 141 CO 0.06 -0.96 -0.04 0.08 0.00 0.00 0.00 175.76 174.90 2x7t s VAL 142 N 2.06 3.52 -0.39 0.00 1.01 -1.16 -1.50 120.40 123.94 2x7t s VAL 142 Ca 0.02 -0.46 -0.22 0.00 0.00 0.00 0.00 61.98 61.33 2x7t s VAL 142 Cb -0.15 -2.58 0.01 0.00 0.00 0.00 0.00 36.38 33.66 2x7t s VAL 142 CO -0.07 0.44 0.70 -0.22 0.00 0.00 0.00 175.10 175.95 2x7t s LEU 143 N 1.11 4.26 -0.12 3.92 0.20 -0.46 -2.11 118.68 125.47 2x7t s LEU 143 Ca 0.01 0.08 -0.12 0.00 0.69 0.00 0.00 54.13 54.80 2x7t s LEU 143 Cb -0.15 -2.87 -0.05 0.00 -0.43 0.00 0.00 46.19 42.70 2x7t s LEU 143 CO -0.00 -0.71 0.25 -0.83 -0.29 0.00 0.00 176.35 174.77 2x7t s GLY 144 N 1.89 2.23 -0.08 7.98 0.00 0.80 -1.74 107.32 118.40 2x7t s GLY 144 Ca 0.27 -0.49 -0.01 0.00 0.00 0.00 0.00 44.72 44.49 2x7t s GLY 144 CO 0.17 0.12 -0.03 -0.42 0.00 0.00 0.00 173.10 172.94 2x7t s ILE 145 N -0.27 0.61 0.41 0.90 1.01 -0.39 -1.35 121.20 122.12 2x7t s ILE 145 Ca 0.16 -0.04 -0.24 0.00 0.00 0.00 0.00 60.65 60.54 2x7t s ILE 145 Cb -0.13 -0.71 -0.09 0.00 0.01 0.00 0.00 42.46 41.54 2x7t s ILE 145 CO 0.05 0.30 1.07 -0.36 0.00 0.00 0.00 174.94 176.00 2x7t s PHE 146 N 1.80 3.19 -0.10 3.97 0.08 -1.26 -0.72 117.98 124.94 2x7t s PHE 146 Ca 0.04 1.62 0.03 0.00 0.12 0.00 0.00 56.93 58.74 2x7t s PHE 146 Cb -0.13 -3.18 -0.00 0.00 -0.57 0.00 0.00 43.02 39.14 2x7t s PHE 146 CO -0.06 -0.80 -0.23 -0.51 -0.10 0.00 0.00 175.22 173.53 2x7t s LEU 147 N -2.70 2.18 0.19 -0.37 1.02 -0.45 -0.60 118.68 117.95 2x7t s LEU 147 Ca 0.59 -0.53 0.11 0.00 0.02 0.00 0.00 54.13 54.32 2x7t s LEU 147 Cb -0.23 -1.44 -0.04 0.00 0.02 0.00 0.00 46.19 44.50 2x7t s LEU 147 CO 0.29 0.16 -0.22 -1.59 0.02 0.00 0.00 176.35 175.01 2x7t s LYS 148 N 0.33 1.58 -0.07 1.70 -2.85 -0.57 -2.01 119.74 117.86 2x7t s LYS 148 Ca -0.18 -1.49 -0.23 0.00 -1.00 0.00 0.00 55.97 53.07 2x7t s LYS 148 Cb -0.18 -1.88 -0.04 0.00 -2.06 0.00 0.00 37.83 33.67 2x7t s LYS 148 CO 0.08 0.40 0.68 0.08 0.10 0.00 0.00 175.35 176.70 2x7t s VAL 149 N -1.67 5.06 0.00 1.79 1.01 -1.26 -0.85 120.40 124.48 2x7t s VAL 149 Ca 0.21 1.39 0.00 0.00 0.00 0.00 0.00 61.98 63.59 2x7t s VAL 149 Cb -0.08 -4.02 0.00 0.00 0.00 0.00 0.00 36.38 32.28 2x7t s VAL 149 CO 0.10 0.26 0.00 0.61 0.00 0.00 0.00 175.10 176.07 2x7t n GLY 150 N 3.13 -0.11 3.77 4.51 0.00 0.25 -4.87 105.19 111.87 2x7t n GLY 150 Ca -0.02 0.54 -0.35 0.00 0.00 0.00 0.00 46.02 46.20 2x7t n GLY 150 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2x7t s SER 151 N 2.00 5.62 0.50 1.61 1.04 -1.26 -3.76 113.70 119.45 2x7t s SER 151 Ca 0.00 2.18 -0.20 0.00 0.48 0.00 0.00 55.95 58.40 2x7t s SER 151 Cb 0.00 -2.58 -0.07 0.00 0.10 0.00 0.00 66.02 63.47 2x7t s SER 151 CO 0.00 -1.29 1.09 0.00 0.98 0.00 0.00 173.24 174.01 2x7t s ALA 152 N -1.81 2.82 -0.47 5.32 0.00 -1.26 -2.41 121.76 123.95 2x7t s ALA 152 Ca 0.73 0.73 -0.14 0.00 0.00 0.00 0.00 51.96 53.27 2x7t s ALA 152 Cb -0.24 -3.31 0.08 0.00 0.00 0.00 0.00 23.12 19.65 2x7t s ALA 152 CO 0.29 -0.51 0.39 0.21 0.00 0.00 0.00 175.76 176.13 2x7t s LYS 153 N -3.16 2.90 0.23 0.00 2.47 -1.22 -4.81 119.74 116.15 2x7t s LYS 153 Ca 0.69 -1.43 -0.09 0.00 -1.56 0.00 0.00 55.97 53.57 2x7t s LYS 153 Cb -0.21 -4.09 0.35 0.00 -1.46 0.00 0.00 37.83 32.42 2x7t s LYS 153 CO 0.24 -1.06 1.66 -1.35 0.16 0.00 0.00 175.35 175.00 2x7t h PRO 154 N 8.71 0.12 0.00 4.03 0.11 -1.91 -0.88 132.00 142.17 2x7t h PRO 154 Ca -0.28 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.83 2x7t h PRO 154 Cb 1.10 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.19 2x7t h PRO 154 CO 0.88 0.08 0.00 0.41 -0.21 0.00 0.00 178.00 179.16 2x7t n GLY 155 N -1.38 -0.68 0.01 -0.55 0.00 -1.26 -1.82 105.19 99.51 2x7t n GLY 155 Ca 0.11 0.07 0.11 0.00 0.00 0.00 0.00 46.02 46.31 2x7t n GLY 155 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2x7t n LEU 156 N -1.79 0.67 -0.33 0.99 7.94 -0.34 -4.55 117.00 119.60 2x7t n LEU 156 Ca -0.00 -0.26 0.01 0.00 -1.11 0.00 0.00 56.01 54.65 2x7t n LEU 156 Cb 0.03 -0.04 0.14 0.00 0.53 0.00 0.00 43.42 44.08 2x7t n LEU 156 CO 0.05 0.14 1.22 -0.61 -1.11 0.00 0.00 177.39 177.08 2x7t h GLN 157 N 0.00 1.02 -0.74 1.96 5.75 -1.39 -1.80 115.11 119.91 2x7t h GLN 157 Ca 0.00 -0.06 0.08 0.00 -0.15 0.00 0.00 58.65 58.51 2x7t h GLN 157 Cb 0.66 -0.23 -0.05 0.00 1.07 0.00 0.00 27.48 28.93 2x7t h GLN 157 CO 0.00 0.67 0.49 -0.22 -2.65 0.00 0.00 178.83 177.12 2x7t h LYS 158 N 1.05 0.71 -0.00 1.69 3.64 -1.80 -1.18 116.57 120.68 2x7t h LYS 158 Ca 0.38 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.72 2x7t h LYS 158 Cb 0.13 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 31.79 2x7t h LYS 158 CO -0.16 0.47 -0.00 0.28 -2.27 0.00 0.00 179.45 177.77 2x7t h VAL 159 N 0.73 1.34 -0.58 2.00 2.07 -1.65 -3.28 116.25 116.89 2x7t h VAL 159 Ca 0.33 -1.01 0.06 0.00 0.82 0.00 0.00 66.70 66.89 2x7t h VAL 159 Cb 0.33 2.03 -0.05 0.00 -1.52 0.00 0.00 31.29 32.08 2x7t h VAL 159 CO -0.11 0.26 0.29 0.58 0.02 0.00 0.00 177.57 178.61 2x7t h VAL 160 N -0.43 0.93 0.00 2.57 2.07 -0.90 -2.89 116.25 117.60 2x7t h VAL 160 Ca 0.00 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 67.33 2x7t h VAL 160 Cb 0.43 0.33 0.00 0.00 -1.52 0.00 0.00 31.29 30.54 2x7t h VAL 160 CO 0.00 0.10 0.00 0.47 0.02 0.00 0.00 177.57 178.16 2x7t n ASP 161 N -4.87 0.47 -0.34 0.57 8.00 -0.50 -2.78 116.55 117.10 2x7t n ASP 161 Ca 0.06 0.64 0.11 0.00 0.71 0.00 0.00 54.79 56.31 2x7t n ASP 161 Cb 0.17 -0.73 -0.04 0.00 -0.02 0.00 0.00 41.12 40.50 2x7t n ASP 161 CO 0.00 0.00 0.00 0.55 -0.39 0.00 0.00 177.20 177.36 2x7t n VAL 162 N -2.04 0.00 0.11 2.53 3.14 -1.09 -4.52 118.33 116.46 2x7t n VAL 162 Ca 0.02 -0.18 0.06 0.00 -2.96 0.00 0.00 64.34 61.27 2x7t n VAL 162 Cb 0.17 1.18 0.53 0.00 -1.06 0.00 0.00 33.84 34.65 2x7t n VAL 162 CO 0.00 0.00 0.00 -0.07 -6.46 0.00 0.00 176.83 170.30 2x7t h LEU 163 N 1.65 0.25 -0.86 6.55 3.38 -1.57 -1.39 115.31 123.33 2x7t h LEU 163 Ca 0.00 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2x7t h LEU 163 Cb 0.67 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.35 2x7t h LEU 163 CO 0.00 0.18 0.00 -0.90 0.09 0.00 0.00 178.44 177.81 2x7t n ASP 164 N -4.50 0.66 -0.03 -0.43 5.75 -1.26 -1.51 116.55 115.23 2x7t n ASP 164 Ca 0.01 0.69 0.13 0.00 -0.01 0.00 0.00 54.79 55.60 2x7t n ASP 164 Cb 0.09 -0.82 0.34 0.00 -1.03 0.00 0.00 41.12 39.70 2x7t n ASP 164 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 2x7t n SER 165 N -2.26 0.46 -2.61 -1.12 3.41 -0.52 -3.89 113.62 107.08 2x7t n SER 165 Ca 0.01 -0.19 -0.12 0.00 -0.26 0.00 0.00 58.87 58.31 2x7t n SER 165 Cb 0.19 0.09 0.03 0.00 -0.26 0.00 0.00 64.21 64.26 2x7t n SER 165 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 2x7t n ILE 166 N -1.40 1.42 -0.28 -1.33 -5.35 -0.57 -4.71 119.36 107.14 2x7t n ILE 166 Ca 0.07 -3.50 -0.02 0.00 -0.27 0.00 0.00 62.75 59.03 2x7t n ILE 166 Cb 0.33 0.25 0.15 0.00 -1.74 0.00 0.00 39.64 38.64 2x7t n ILE 166 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 2x7t h LYS 167 N 2.80 1.14 -6.12 6.28 3.64 -1.61 -3.43 116.57 119.27 2x7t h LYS 167 Ca 0.01 -0.12 -0.54 0.00 -1.27 0.00 0.00 60.65 58.72 2x7t h LYS 167 Cb 1.16 -0.23 -0.08 0.00 -0.41 0.00 0.00 32.23 32.67 2x7t h LYS 167 CO 0.54 0.82 -0.56 0.95 -2.27 0.00 0.00 179.45 178.93 2x7t s THR 168 N -5.80 3.17 0.03 1.00 -4.23 -1.26 0.16 115.64 108.70 2x7t s THR 168 Ca -0.12 -1.72 -0.34 0.00 -1.18 0.00 0.00 61.69 58.33 2x7t s THR 168 Cb 0.17 -2.97 -0.13 0.00 1.34 0.00 0.00 72.50 70.91 2x7t s THR 168 CO 0.81 -0.23 1.72 1.17 -0.54 0.00 0.00 174.62 177.55 2x7t n LYS 169 N -1.10 2.11 0.00 3.99 4.81 -0.36 -2.08 118.16 125.52 2x7t n LYS 169 Ca -0.04 0.77 0.00 0.00 -0.87 0.00 0.00 58.31 58.17 2x7t n LYS 169 Cb 0.61 -2.57 0.00 0.00 0.02 0.00 0.00 35.03 33.09 2x7t n LYS 169 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2x7t n GLY 170 N 3.87 2.70 3.77 3.14 0.00 -0.17 -4.44 105.19 114.07 2x7t n GLY 170 Ca 0.20 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.84 2x7t n GLY 170 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2x7t s LYS 171 N -0.32 4.11 0.09 1.61 1.02 -0.88 -4.84 119.74 120.52 2x7t s LYS 171 Ca 0.00 1.82 -0.09 0.00 0.02 0.00 0.00 55.97 57.72 2x7t s LYS 171 Cb 0.00 -2.70 -0.00 0.00 -0.52 0.00 0.00 37.83 34.61 2x7t s LYS 171 CO 0.00 -0.27 0.18 -1.54 -0.92 0.00 0.00 175.35 172.81 2x7t s SER 172 N -1.14 0.13 0.00 2.83 1.04 -1.26 -1.34 113.70 113.95 2x7t s SER 172 Ca 0.56 -0.65 -0.18 0.00 0.48 0.00 0.00 55.95 56.17 2x7t s SER 172 Cb -0.30 0.33 0.03 0.00 0.10 0.00 0.00 66.02 66.18 2x7t s SER 172 CO 0.38 -0.72 0.39 0.00 0.98 0.00 0.00 173.24 174.27 2x7t s ALA 173 N -3.80 -0.97 0.68 5.32 0.00 -0.62 -4.95 121.76 117.42 2x7t s ALA 173 Ca 0.04 0.42 -0.17 0.00 0.00 0.00 0.00 51.96 52.26 2x7t s ALA 173 Cb 0.05 0.16 -0.01 0.00 0.00 0.00 0.00 23.12 23.32 2x7t s ALA 173 CO -0.11 -0.34 1.00 -0.25 0.00 0.00 0.00 175.76 176.06 2x7t n ASP 174 N 0.94 0.75 -2.74 0.00 8.00 -1.26 -1.52 116.55 120.71 2x7t n ASP 174 Ca -0.20 0.73 -0.05 0.00 0.71 0.00 0.00 54.79 55.98 2x7t n ASP 174 Cb 0.57 -1.42 0.02 0.00 -0.02 0.00 0.00 41.12 40.28 2x7t n ASP 174 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 2x7t n PHE 175 N -2.20 -3.29 -3.88 1.24 7.35 -0.61 -4.61 117.46 111.46 2x7t n PHE 175 Ca 0.14 -1.33 -0.21 0.00 -0.76 0.00 0.00 57.45 55.30 2x7t n PHE 175 Cb 0.49 1.44 -0.02 0.00 0.35 0.00 0.00 39.48 41.74 2x7t n PHE 175 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 2x7t s THR 176 N 0.83 4.97 -1.98 -2.13 -4.23 -1.26 -3.21 115.64 108.63 2x7t s THR 176 Ca 0.29 -1.02 0.00 0.00 -1.18 0.00 0.00 61.69 59.79 2x7t s THR 176 Cb 0.06 -3.74 0.00 0.00 1.34 0.00 0.00 72.50 70.16 2x7t s THR 176 CO -0.09 -0.29 0.00 0.59 -0.54 0.00 0.00 174.62 174.28 2x7t n ASN 177 N -1.44 -5.52 -4.72 3.99 4.13 -1.26 -4.97 115.26 105.47 2x7t n ASN 177 Ca -0.07 0.31 -0.41 0.00 1.68 0.00 0.00 54.58 56.09 2x7t n ASN 177 Cb 0.57 -4.69 -0.04 0.00 -1.54 0.00 0.00 39.78 34.08 2x7t n ASN 177 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 2x7t s PHE 178 N -2.83 3.66 -0.40 3.10 5.36 -1.26 -5.00 117.98 120.61 2x7t s PHE 178 Ca 0.00 1.54 -0.11 0.00 -0.96 0.00 0.00 56.93 57.40 2x7t s PHE 178 Cb 0.00 -2.98 0.04 0.00 -0.34 0.00 0.00 43.02 39.74 2x7t s PHE 178 CO 0.00 0.08 0.24 0.34 -1.46 0.00 0.00 175.22 174.41 2x7t s ASP 179 N 0.72 5.76 0.29 6.13 3.68 -1.26 -4.45 116.67 127.54 2x7t s ASP 179 Ca 0.45 -1.15 0.23 0.00 2.13 0.00 0.00 52.55 54.21 2x7t s ASP 179 Cb -0.20 -2.03 1.08 0.00 -1.45 0.00 0.00 42.92 40.32 2x7t s ASP 179 CO 0.25 -0.45 1.69 -0.81 0.13 0.00 0.00 175.17 175.97 2x7t n PRO 180 N 5.00 0.17 0.29 4.34 -0.04 -1.26 -2.50 135.00 141.00 2x7t n PRO 180 Ca -0.11 0.54 0.16 0.00 -0.04 0.00 0.00 63.50 64.04 2x7t n PRO 180 Cb 0.45 -1.92 0.88 0.00 -0.04 0.00 0.00 33.50 32.87 2x7t n PRO 180 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2x7t h ARG 181 N 0.00 0.00 0.00 0.54 3.08 -1.93 -0.32 114.38 115.75 2x7t h ARG 181 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2x7t h ARG 181 Cb 0.18 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.23 2x7t h ARG 181 CO 0.00 0.05 0.00 0.41 -1.07 0.00 0.00 179.97 179.36 2x7t n GLY 182 N -0.83 -0.98 1.05 0.04 0.00 -1.04 -2.77 105.19 100.66 2x7t n GLY 182 Ca -0.02 -0.10 0.11 0.00 0.00 0.00 0.00 46.02 46.01 2x7t n GLY 182 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2x7t n LEU 183 N -1.28 3.30 -4.89 0.99 4.77 -0.13 -4.11 117.00 115.65 2x7t n LEU 183 Ca 0.10 -1.52 -0.34 0.00 -0.03 0.00 0.00 56.01 54.22 2x7t n LEU 183 Cb 0.17 -0.23 -0.05 0.00 -2.33 0.00 0.00 43.42 40.97 2x7t n LEU 183 CO 0.16 0.72 -0.09 -0.76 -1.33 0.00 0.00 177.39 176.09 2x7t s LEU 184 N -1.37 4.37 0.90 2.23 1.43 -1.11 -4.95 118.68 120.16 2x7t s LEU 184 Ca 0.35 0.49 -0.14 0.00 -1.03 0.00 0.00 54.13 53.80 2x7t s LEU 184 Cb 0.21 -2.65 0.14 0.00 0.03 0.00 0.00 46.19 43.91 2x7t s LEU 184 CO 0.29 0.26 1.21 -2.16 0.23 0.00 0.00 176.35 176.17 2x7t s PRO 185 N -1.81 1.23 0.08 1.29 0.04 -1.26 -4.99 135.00 129.58 2x7t s PRO 185 Ca 0.27 -0.00 -0.23 0.00 0.04 0.00 0.00 61.00 61.08 2x7t s PRO 185 Cb -0.13 -1.88 -0.15 0.00 0.04 0.00 0.00 34.50 32.38 2x7t s PRO 185 CO 0.17 -2.08 1.71 0.93 0.04 0.00 0.00 177.00 177.77 2x7t h GLU 186 N -1.41 -0.03 -6.32 4.56 5.08 -1.92 -3.44 114.58 111.10 2x7t h GLU 186 Ca -0.47 0.00 -0.56 0.00 -1.00 0.00 0.00 59.36 57.34 2x7t h GLU 186 Cb 1.30 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 30.52 2x7t h GLU 186 CO 0.56 0.00 -0.16 0.45 -1.00 0.00 0.00 179.01 178.87 2x7t s SER 187 N -5.19 6.66 -0.14 1.42 0.15 -1.26 -5.00 113.70 110.34 2x7t s SER 187 Ca -0.13 0.89 0.15 0.00 0.70 0.00 0.00 55.95 57.56 2x7t s SER 187 Cb 0.06 -2.21 0.49 0.00 -1.71 0.00 0.00 66.02 62.64 2x7t s SER 187 CO 0.66 0.03 1.40 0.18 1.20 0.00 0.00 173.24 176.70 2x7t n LEU 188 N 0.30 3.73 -4.76 3.45 4.77 -1.26 -4.71 117.00 118.52 2x7t n LEU 188 Ca -0.03 -2.79 -0.39 0.00 -0.03 0.00 0.00 56.01 52.77 2x7t n LEU 188 Cb 0.52 -0.48 0.03 0.00 -2.33 0.00 0.00 43.42 41.16 2x7t n LEU 188 CO 0.44 0.69 1.03 -1.81 -1.33 0.00 0.00 177.39 176.41 2x7t s ASP 189 N -1.69 5.57 0.23 -1.43 -0.00 -1.26 -4.68 116.67 113.41 2x7t s ASP 189 Ca 0.38 2.85 -0.15 0.00 -0.00 0.00 0.00 52.55 55.63 2x7t s ASP 189 Cb 0.29 -2.65 0.01 0.00 -0.00 0.00 0.00 42.92 40.58 2x7t s ASP 189 CO 0.11 -1.37 0.52 -0.72 -0.00 0.00 0.00 175.17 173.70 2x7t s TYR 190 N -1.25 0.14 0.11 4.23 -0.85 -1.26 -1.61 117.35 116.86 2x7t s TYR 190 Ca 0.66 -0.52 0.08 0.00 -0.52 0.00 0.00 57.07 56.77 2x7t s TYR 190 Cb -0.42 0.32 -0.04 0.00 0.38 0.00 0.00 41.96 42.20 2x7t s TYR 190 CO 0.52 -1.00 -0.13 -1.58 -1.52 0.00 0.00 175.55 171.84 2x7t s TRP 191 N -3.96 2.65 -0.06 -3.49 0.51 -0.11 -0.96 118.94 113.53 2x7t s TRP 191 Ca 0.17 -0.20 -0.08 0.00 -2.12 0.00 0.00 56.10 53.86 2x7t s TRP 191 Cb -0.01 -1.39 0.02 0.00 -0.81 0.00 0.00 33.47 31.27 2x7t s TRP 191 CO 0.05 0.41 0.21 -0.08 -0.51 0.00 0.00 176.95 177.03 2x7t s THR 192 N -1.20 0.03 0.04 2.01 -1.32 0.70 -1.02 115.64 114.88 2x7t s THR 192 Ca 0.20 -0.21 -0.27 0.00 -1.21 0.00 0.00 61.69 60.20 2x7t s THR 192 Cb -0.11 -0.37 0.08 0.00 -1.51 0.00 0.00 72.50 70.59 2x7t s THR 192 CO 0.12 -0.12 0.72 -0.72 -2.21 0.00 0.00 174.62 172.42 2x7t s TYR 193 N -0.38 -0.51 -0.06 9.09 -0.85 -1.03 -1.25 117.35 122.36 2x7t s TYR 193 Ca -0.05 0.52 -0.28 0.00 -0.52 0.00 0.00 57.07 56.74 2x7t s TYR 193 Cb -0.03 0.51 -0.02 0.00 0.38 0.00 0.00 41.96 42.79 2x7t s TYR 193 CO 0.01 -0.68 0.92 -1.25 -1.52 0.00 0.00 175.55 173.03 2x7t s PRO 194 N -2.77 4.47 0.00 -3.49 0.04 -1.26 -1.03 135.00 130.95 2x7t s PRO 194 Ca -0.01 1.27 0.00 0.00 0.04 0.00 0.00 61.00 62.30 2x7t s PRO 194 Cb -0.01 -3.50 0.00 0.00 0.04 0.00 0.00 34.50 31.04 2x7t s PRO 194 CO -0.05 -0.15 0.00 0.41 0.04 0.00 0.00 177.00 177.25 2x7t n GLY 195 N 3.06 4.71 3.28 0.56 0.00 0.14 -4.82 105.19 112.13 2x7t n GLY 195 Ca 0.05 -0.78 -0.19 0.00 0.00 0.00 0.00 46.02 45.10 2x7t n GLY 195 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2x7t s SER 196 N 1.40 1.66 0.57 1.61 1.04 -1.09 -2.08 113.70 116.82 2x7t s SER 196 Ca 0.00 -1.76 -0.19 0.00 0.48 0.00 0.00 55.95 54.48 2x7t s SER 196 Cb 0.00 0.56 -0.04 0.00 0.10 0.00 0.00 66.02 66.63 2x7t s SER 196 CO 0.00 -1.06 1.19 -0.76 0.98 0.00 0.00 173.24 173.59 2x7t s LEU 197 N -3.37 3.70 0.00 2.42 1.43 -0.23 -4.48 118.68 118.15 2x7t s LEU 197 Ca 0.41 2.34 0.21 0.00 -1.03 0.00 0.00 54.13 56.05 2x7t s LEU 197 Cb 0.02 -4.57 0.56 0.00 0.03 0.00 0.00 46.19 42.23 2x7t s LEU 197 CO 0.28 -1.47 1.47 0.35 0.23 0.00 0.00 176.35 177.21 2x7t n THR 198 N -1.46 0.78 -4.12 5.49 -2.24 -1.26 -4.49 114.28 106.98 2x7t n THR 198 Ca 0.13 -0.83 -0.08 0.00 -2.27 0.00 0.00 64.05 61.00 2x7t n THR 198 Cb 0.50 0.53 -0.10 0.00 -2.10 0.00 0.00 70.33 69.15 2x7t n THR 198 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2x7t s THR 199 N -1.22 0.35 0.55 4.28 -4.23 -1.26 -4.69 115.64 109.42 2x7t s THR 199 Ca 0.42 -1.86 -0.20 0.00 -1.18 0.00 0.00 61.69 58.87 2x7t s THR 199 Cb 0.22 -1.63 -0.06 0.00 1.34 0.00 0.00 72.50 72.37 2x7t s THR 199 CO 0.30 -0.90 0.98 -2.65 -0.54 0.00 0.00 174.62 171.81 2x7t n PRO 200 N 0.04 1.05 0.00 3.99 -0.02 -1.26 0.01 135.00 138.81 2x7t n PRO 200 Ca -0.13 0.40 0.01 0.00 -2.02 0.00 0.00 63.50 61.76 2x7t n PRO 200 Cb 0.61 -2.15 0.05 0.00 -0.02 0.00 0.00 33.50 32.00 2x7t n PRO 200 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2x7t n PRO 201 N -0.69 0.62 -2.46 0.52 -0.04 -1.26 -4.98 135.00 126.71 2x7t n PRO 201 Ca 0.12 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.46 2x7t n PRO 201 Cb 0.45 -1.05 -0.01 0.00 -0.04 0.00 0.00 33.50 32.86 2x7t n PRO 201 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2x7t n LEU 202 N -0.55 -1.17 -4.76 1.53 4.77 0.10 -4.90 117.00 112.02 2x7t n LEU 202 Ca 0.01 0.18 -0.41 0.00 -0.03 0.00 0.00 56.01 55.76 2x7t n LEU 202 Cb 0.01 -2.16 -0.01 0.00 -2.33 0.00 0.00 43.42 38.92 2x7t n LEU 202 CO 0.01 -0.12 1.15 -0.76 -1.33 0.00 0.00 177.39 176.33 2x7t s LEU 203 N -5.64 4.36 -1.29 2.23 1.43 -1.26 -4.43 118.68 114.08 2x7t s LEU 203 Ca 0.01 2.87 -0.10 0.00 -1.03 0.00 0.00 54.13 55.87 2x7t s LEU 203 Cb -0.00 -3.64 0.16 0.00 0.03 0.00 0.00 46.19 42.73 2x7t s LEU 203 CO 0.01 -0.80 1.86 -0.62 0.23 0.00 0.00 176.35 177.03 2x7t n GLU 204 N 1.60 3.54 -0.13 1.70 1.02 -1.26 -1.07 120.64 126.03 2x7t n GLU 204 Ca 0.05 -3.49 0.06 0.00 -0.02 0.00 0.00 57.16 53.76 2x7t n GLU 204 Cb 0.39 -2.97 0.09 0.00 -0.02 0.00 0.00 31.44 28.93 2x7t n GLU 204 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2x7t s VAL 206 N -1.96 2.82 -0.47 0.00 1.01 -0.88 -1.02 120.40 119.89 2x7t s VAL 206 Ca 0.20 -0.76 -0.17 0.00 0.00 0.00 0.00 61.98 61.25 2x7t s VAL 206 Cb 0.18 -2.14 0.06 0.00 0.00 0.00 0.00 36.38 34.47 2x7t s VAL 206 CO 0.02 0.55 0.45 -0.89 0.00 0.00 0.00 175.10 175.23 2x7t s THR 207 N 0.09 5.12 0.13 3.92 2.01 -0.38 0.28 115.64 126.81 2x7t s THR 207 Ca -0.07 -0.78 -0.27 0.00 0.31 0.00 0.00 61.69 60.88 2x7t s THR 207 Cb -0.15 -4.14 -0.07 0.00 0.01 0.00 0.00 72.50 68.15 2x7t s THR 207 CO 0.05 -0.60 0.82 0.26 -0.69 0.00 0.00 174.62 174.47 2x7t s TRP 208 N 1.98 3.85 -0.26 4.92 0.52 -0.20 -2.99 118.94 126.75 2x7t s TRP 208 Ca 0.08 1.65 -0.01 0.00 0.02 0.00 0.00 56.10 57.84 2x7t s TRP 208 Cb -0.21 -2.86 0.08 0.00 -1.15 0.00 0.00 33.47 29.33 2x7t s TRP 208 CO 0.09 0.39 0.05 0.42 0.02 0.00 0.00 176.95 177.92 2x7t s ILE 209 N -0.63 0.90 -0.21 2.03 1.01 -0.90 -2.46 121.20 120.94 2x7t s ILE 209 Ca 0.39 -1.11 -0.05 0.00 0.00 0.00 0.00 60.65 59.87 2x7t s ILE 209 Cb -0.23 -1.50 -0.02 0.00 0.01 0.00 0.00 42.46 40.72 2x7t s ILE 209 CO 0.27 -0.43 0.00 -0.69 0.00 0.00 0.00 174.94 174.09 2x7t s VAL 210 N 1.64 3.90 0.27 2.92 1.01 -0.19 -0.14 120.40 129.81 2x7t s VAL 210 Ca 0.04 -0.33 -0.29 0.00 0.00 0.00 0.00 61.98 61.40 2x7t s VAL 210 Cb -0.17 -2.77 -0.09 0.00 0.00 0.00 0.00 36.38 33.34 2x7t s VAL 210 CO -0.16 0.41 1.14 -0.76 0.00 0.00 0.00 175.10 175.74 2x7t s LEU 211 N 1.18 4.52 0.12 3.92 1.43 -0.46 -0.94 118.68 128.44 2x7t s LEU 211 Ca 0.03 2.31 -0.14 0.00 -1.03 0.00 0.00 54.13 55.30 2x7t s LEU 211 Cb -0.14 -3.63 -0.05 0.00 0.03 0.00 0.00 46.19 42.40 2x7t s LEU 211 CO 0.01 -0.24 1.49 0.50 0.23 0.00 0.00 176.35 178.35 2x7t h LYS 212 N 4.05 0.74 -5.82 1.70 3.64 -1.64 -3.43 116.57 115.81 2x7t h LYS 212 Ca -0.47 -0.32 -0.60 0.00 -1.27 0.00 0.00 60.65 57.99 2x7t h LYS 212 Cb 1.21 -0.02 -0.10 0.00 -0.41 0.00 0.00 32.23 32.91 2x7t h LYS 212 CO 0.68 0.93 0.45 -2.00 -2.27 0.00 0.00 179.45 177.24 2x7t s GLU 213 N -4.63 4.00 0.66 1.90 2.12 -1.26 -5.01 118.70 116.47 2x7t s GLU 213 Ca -0.12 0.67 -0.10 0.00 0.36 0.00 0.00 54.97 55.77 2x7t s GLU 213 Cb 0.10 -3.72 -0.00 0.00 0.26 0.00 0.00 34.13 30.76 2x7t s GLU 213 CO 0.82 -0.68 1.04 -1.25 -0.54 0.00 0.00 175.26 174.65 2x7t s PRO 214 N 3.01 3.09 0.15 4.30 0.04 -1.26 -4.69 135.00 139.63 2x7t s PRO 214 Ca 0.34 0.46 0.03 0.00 0.04 0.00 0.00 61.00 61.87 2x7t s PRO 214 Cb -0.14 -2.09 -0.04 0.00 0.04 0.00 0.00 34.50 32.28 2x7t s PRO 214 CO 0.12 -0.83 0.21 0.96 0.04 0.00 0.00 177.00 177.50 2x7t s ILE 215 N -3.23 4.97 -0.10 0.56 -4.36 0.23 -4.89 121.20 114.37 2x7t s ILE 215 Ca 0.56 -0.83 -0.03 0.00 -0.26 0.00 0.00 60.65 60.09 2x7t s ILE 215 Cb -0.11 -3.54 -0.03 0.00 1.25 0.00 0.00 42.46 40.03 2x7t s ILE 215 CO 0.51 -0.08 0.02 -0.94 0.24 0.00 0.00 174.94 174.70 2x7t s SER 216 N -3.11 5.38 0.22 4.36 1.04 -1.26 -1.51 113.70 118.82 2x7t s SER 216 Ca 0.33 0.16 0.09 0.00 0.48 0.00 0.00 55.95 57.00 2x7t s SER 216 Cb -0.11 -1.61 -0.05 0.00 0.10 0.00 0.00 66.02 64.35 2x7t s SER 216 CO 0.26 0.35 -0.16 0.68 0.98 0.00 0.00 173.24 175.35 2x7t s VAL 217 N -0.69 1.88 0.50 5.02 -7.23 -0.03 -3.41 120.40 116.44 2x7t s VAL 217 Ca 0.11 -2.23 -0.07 0.00 -1.81 0.00 0.00 61.98 57.98 2x7t s VAL 217 Cb -0.12 -2.08 -0.04 0.00 0.56 0.00 0.00 36.38 34.70 2x7t s VAL 217 CO 0.02 -0.55 0.83 -0.94 -0.31 0.00 0.00 175.10 174.15 2x7t s SER 218 N -3.32 6.29 0.43 4.85 1.04 -1.17 0.85 113.70 122.67 2x7t s SER 218 Ca 0.24 1.05 0.09 0.00 0.48 0.00 0.00 55.95 57.80 2x7t s SER 218 Cb -0.02 -2.30 0.93 0.00 0.10 0.00 0.00 66.02 64.74 2x7t s SER 218 CO 0.08 -0.61 2.08 0.77 0.98 0.00 0.00 173.24 176.54 2x7t h SER 219 N 0.27 0.39 -0.66 7.02 4.64 -1.93 -1.63 113.55 121.64 2x7t h SER 219 Ca -0.46 -0.01 -0.08 0.00 -0.47 0.00 0.00 61.79 60.77 2x7t h SER 219 Cb 1.20 -0.10 -0.03 0.00 -0.31 0.00 0.00 62.40 63.17 2x7t h SER 219 CO 0.62 0.28 0.11 -0.33 -0.87 0.00 0.00 176.83 176.64 2x7t h GLU 220 N 0.46 1.10 -0.29 4.77 3.07 -1.94 -1.04 114.58 120.71 2x7t h GLU 220 Ca 0.12 -0.30 -0.03 0.00 -0.50 0.00 0.00 59.36 58.66 2x7t h GLU 220 Cb -0.05 -0.13 -0.01 0.00 -0.84 0.00 0.00 28.75 27.72 2x7t h GLU 220 CO -0.03 1.01 0.05 1.96 -1.40 0.00 0.00 179.01 180.60 2x7t h GLN 221 N 1.02 0.48 0.00 2.33 4.20 -1.69 -2.53 115.11 118.92 2x7t h GLN 221 Ca 0.20 -0.13 -0.10 0.00 0.06 0.00 0.00 58.65 58.68 2x7t h GLN 221 Cb 0.44 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.15 2x7t h GLN 221 CO 0.01 0.58 -0.49 -0.24 -0.67 0.00 0.00 178.83 178.03 2x7t h VAL 222 N 0.30 1.23 -0.55 -0.54 3.04 -1.39 -2.82 116.25 115.52 2x7t h VAL 222 Ca 0.09 -1.74 -0.05 0.00 -1.01 0.00 0.00 66.70 63.99 2x7t h VAL 222 Cb 0.33 1.97 -0.03 0.00 -2.01 0.00 0.00 31.29 31.55 2x7t h VAL 222 CO 0.00 0.48 0.13 -0.07 -1.01 0.00 0.00 177.57 177.10 2x7t h LEU 223 N 0.00 0.80 -1.48 3.16 3.38 -0.97 -1.46 115.31 118.74 2x7t h LEU 223 Ca -0.00 -0.15 -0.04 0.00 0.09 0.00 0.00 57.88 57.78 2x7t h LEU 223 Cb 0.93 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.46 2x7t h LEU 223 CO 0.06 0.79 -0.19 0.11 0.09 0.00 0.00 178.44 179.31 2x7t h LYS 224 N 0.82 0.00 -0.18 1.13 1.57 -1.20 -2.07 116.57 116.63 2x7t h LYS 224 Ca 0.18 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.93 2x7t h LYS 224 Cb 0.31 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.62 2x7t h LYS 224 CO 0.00 0.19 -0.00 0.74 -0.57 0.00 0.00 179.45 179.81 2x7t h PHE 225 N 0.00 0.36 0.00 -1.35 -1.00 -1.19 -2.99 116.94 110.77 2x7t h PHE 225 Ca -0.00 -0.06 0.00 0.00 2.81 0.00 0.00 57.97 60.72 2x7t h PHE 225 Cb 0.57 -0.09 0.00 0.00 3.61 0.00 0.00 35.95 40.03 2x7t h PHE 225 CO 0.00 0.53 0.00 0.54 -1.61 0.00 0.00 178.31 177.77 2x7t n ARG 226 N -4.71 0.22 0.02 1.51 1.74 -0.81 -2.58 116.66 112.06 2x7t n ARG 226 Ca -0.05 0.14 0.12 0.00 -0.77 0.00 0.00 57.85 57.29 2x7t n ARG 226 Cb 0.23 -1.50 0.23 0.00 -1.02 0.00 0.00 32.46 30.39 2x7t n ARG 226 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2x7t n LYS 227 N -1.28 0.10 -1.10 5.56 5.02 -1.05 -4.37 118.16 121.04 2x7t n LYS 227 Ca 0.07 0.02 -0.31 0.00 -2.02 0.00 0.00 58.31 56.08 2x7t n LYS 227 Cb 0.12 -1.56 0.12 0.00 -0.02 0.00 0.00 35.03 33.69 2x7t n LYS 227 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2x7t s LEU 228 N -3.41 2.79 0.06 -0.35 1.43 -1.07 -4.84 118.68 113.30 2x7t s LEU 228 Ca 0.09 1.84 0.07 0.00 -1.03 0.00 0.00 54.13 55.10 2x7t s LEU 228 Cb 0.16 -4.40 -0.04 0.00 0.03 0.00 0.00 46.19 41.95 2x7t s LEU 228 CO 0.71 -2.45 -0.15 0.20 0.23 0.00 0.00 176.35 174.89 2x7t s ASN 229 N -3.21 4.04 0.01 2.29 0.02 0.12 0.13 114.94 118.34 2x7t s ASN 229 Ca 0.63 -0.41 -0.14 0.00 -1.02 0.00 0.00 52.86 51.92 2x7t s ASN 229 Cb -0.19 -0.70 -0.34 0.00 0.02 0.00 0.00 41.25 40.04 2x7t s ASN 229 CO 0.57 0.23 0.91 -0.26 0.02 0.00 0.00 177.10 178.57 2x7t h PHE 230 N 4.20 0.88 -4.21 2.20 0.05 -1.20 -3.35 116.94 115.51 2x7t h PHE 230 Ca -0.48 -0.64 -0.48 0.00 3.82 0.00 0.00 57.97 60.18 2x7t h PHE 230 Cb 1.16 -0.04 0.13 0.00 2.00 0.00 0.00 35.95 39.20 2x7t h PHE 230 CO 0.57 1.58 0.30 0.54 -0.18 0.00 0.00 178.31 181.12 2x7t s ASN 231 N -7.47 3.96 0.44 2.17 4.22 -1.26 -4.38 114.94 112.62 2x7t s ASN 231 Ca -0.11 1.27 -0.01 0.00 -2.14 0.00 0.00 52.86 51.87 2x7t s ASN 231 Cb 0.05 -1.95 -0.01 0.00 1.28 0.00 0.00 41.25 40.61 2x7t s ASN 231 CO 0.92 -2.30 0.67 -0.83 -2.04 0.00 0.00 177.10 173.52 2x7t s GLY 232 N -3.80 1.50 0.18 0.45 0.00 -1.26 -1.23 107.32 103.16 2x7t s GLY 232 Ca 0.62 -0.91 -0.33 0.00 0.00 0.00 0.00 44.72 44.10 2x7t s GLY 232 CO 0.55 -0.76 1.40 -2.21 0.00 0.00 0.00 173.10 172.07 2x7t n GLU 233 N -2.07 1.76 -0.76 2.90 2.13 -1.26 -2.37 120.64 120.97 2x7t n GLU 233 Ca -0.00 0.63 0.00 0.00 0.66 0.00 0.00 57.16 58.45 2x7t n GLU 233 Cb 0.57 -2.29 0.00 0.00 0.27 0.00 0.00 31.44 29.99 2x7t n GLU 233 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2x7t n GLY 234 N 2.52 0.56 3.48 8.31 0.00 -1.26 -5.06 105.19 113.75 2x7t n GLY 234 Ca 0.15 -0.53 -0.23 0.00 0.00 0.00 0.00 46.02 45.41 2x7t n GLY 234 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2x7t s GLU 235 N -1.04 1.68 0.20 1.61 2.02 -1.00 -5.09 118.70 117.09 2x7t s GLU 235 Ca 0.00 -1.89 -0.32 0.00 0.02 0.00 0.00 54.97 52.78 2x7t s GLU 235 Cb 0.00 -1.29 -0.14 0.00 0.10 0.00 0.00 34.13 32.80 2x7t s GLU 235 CO 0.00 0.00 1.39 -2.30 0.02 0.00 0.00 175.26 174.37 2x7t n PRO 236 N -0.70 1.83 -2.44 0.39 -0.02 -1.26 -4.88 135.00 127.92 2x7t n PRO 236 Ca -0.05 0.65 -0.42 0.00 -2.02 0.00 0.00 63.50 61.66 2x7t n PRO 236 Cb 0.65 -2.30 -0.03 0.00 -0.02 0.00 0.00 33.50 31.80 2x7t n PRO 236 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 2x7t s GLU 237 N -0.12 4.31 -0.23 -0.52 2.12 -1.26 -4.75 118.70 118.24 2x7t s GLU 237 Ca 0.72 1.68 0.00 0.00 0.36 0.00 0.00 54.97 57.73 2x7t s GLU 237 Cb -0.71 -3.62 0.06 0.00 0.26 0.00 0.00 34.13 30.11 2x7t s GLU 237 CO 0.48 -0.53 -0.04 -1.83 -0.54 0.00 0.00 175.26 172.79 2x7t s GLU 238 N 2.64 1.52 0.40 4.30 -1.05 -1.26 -5.05 118.70 120.19 2x7t s GLU 238 Ca 0.56 -0.94 -0.27 0.00 -0.15 0.00 0.00 54.97 54.17 2x7t s GLU 238 Cb -0.24 -2.54 -0.10 0.00 -0.44 0.00 0.00 34.13 30.80 2x7t s GLU 238 CO 0.20 -0.61 1.35 1.28 0.95 0.00 0.00 175.26 178.43 2x7t n LEU 239 N 4.71 4.28 -4.52 1.83 4.77 -1.26 -0.79 117.00 126.02 2x7t n LEU 239 Ca -0.11 1.16 -0.42 0.00 -0.03 0.00 0.00 56.01 56.61 2x7t n LEU 239 Cb 0.44 -1.54 -0.03 0.00 -2.33 0.00 0.00 43.42 39.96 2x7t n LEU 239 CO 0.17 -0.34 1.21 -0.32 -1.33 0.00 0.00 177.39 176.78 2x7t s MET 240 N -2.15 3.45 0.06 3.23 -2.45 0.12 -4.54 119.30 117.01 2x7t s MET 240 Ca 0.58 -1.06 -0.03 0.00 -1.25 0.00 0.00 55.69 53.93 2x7t s MET 240 Cb -0.50 -4.87 -0.03 0.00 1.25 0.00 0.00 34.83 30.68 2x7t s MET 240 CO 0.60 -2.04 0.03 0.14 1.05 0.00 0.00 175.02 174.80 2x7t s VAL 241 N 4.48 0.19 -1.39 10.11 -7.23 -1.26 -4.47 120.40 120.83 2x7t s VAL 241 Ca 0.38 -1.54 -0.07 0.00 -1.81 0.00 0.00 61.98 58.94 2x7t s VAL 241 Cb -0.05 -1.34 0.03 0.00 0.56 0.00 0.00 36.38 35.58 2x7t s VAL 241 CO -0.02 -0.85 0.92 0.47 -0.31 0.00 0.00 175.10 175.31 2x7t n ASP 242 N 0.23 -3.49 -2.78 4.85 10.43 -0.24 -4.85 116.55 120.69 2x7t n ASP 242 Ca -0.15 -0.73 -0.33 0.00 2.57 0.00 0.00 54.79 56.15 2x7t n ASP 242 Cb 0.61 -4.29 -0.02 0.00 1.84 0.00 0.00 41.12 39.25 2x7t n ASP 242 CO 0.00 0.00 0.00 -0.46 -1.07 0.00 0.00 177.20 175.67 2x7t n ASN 243 N -2.98 6.98 -4.29 -2.24 0.23 -1.10 -4.92 115.26 106.94 2x7t n ASN 243 Ca -0.12 -3.39 -0.25 0.00 -0.53 0.00 0.00 54.58 50.29 2x7t n ASN 243 Cb 0.60 -1.20 -0.13 0.00 -2.08 0.00 0.00 39.78 36.97 2x7t n ASN 243 CO 0.00 0.00 0.00 -1.66 -0.93 0.00 0.00 177.26 174.67 2x7t s TRP 244 N -2.39 1.88 -0.12 -2.53 1.48 -1.26 -4.63 118.94 111.37 2x7t s TRP 244 Ca 0.55 -0.40 -0.10 0.00 -1.06 0.00 0.00 56.10 55.10 2x7t s TRP 244 Cb 0.36 -1.05 -0.05 0.00 -1.16 0.00 0.00 33.47 31.58 2x7t s TRP 244 CO -0.25 0.19 0.20 0.50 -4.06 0.00 0.00 176.95 173.53 2x7t s ARG 245 N -1.74 3.73 0.85 3.25 3.52 -1.26 -4.96 118.95 122.34 2x7t s ARG 245 Ca 0.08 -0.02 -0.12 0.00 -0.13 0.00 0.00 55.73 55.54 2x7t s ARG 245 Cb -0.10 -3.26 0.10 0.00 -1.56 0.00 0.00 34.95 30.14 2x7t s ARG 245 CO 0.04 0.63 1.10 -1.25 -0.81 0.00 0.00 175.30 175.00 2x7t s PRO 246 N -0.65 1.63 0.47 5.12 0.04 -1.26 -4.62 135.00 135.74 2x7t s PRO 246 Ca 0.16 0.70 -0.24 0.00 0.04 0.00 0.00 61.00 61.66 2x7t s PRO 246 Cb -0.13 -1.86 -0.08 0.00 0.04 0.00 0.00 34.50 32.47 2x7t s PRO 246 CO 0.05 -1.95 1.32 0.00 0.04 0.00 0.00 177.00 176.46 2x7t n ALA 247 N -3.67 1.52 -2.57 8.56 0.00 -1.26 -4.33 120.51 118.77 2x7t n ALA 247 Ca 0.07 0.21 -0.24 0.00 0.00 0.00 0.00 53.44 53.48 2x7t n ALA 247 Cb 0.56 -2.32 -0.07 0.00 0.00 0.00 0.00 19.45 17.62 2x7t n ALA 247 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2x7t s GLN 248 N -2.49 2.22 0.23 0.00 -1.52 0.77 -4.93 119.66 113.95 2x7t s GLN 248 Ca 0.65 -1.58 -0.32 0.00 -1.95 0.00 0.00 55.36 52.16 2x7t s GLN 248 Cb -0.46 -2.07 -0.12 0.00 -0.22 0.00 0.00 33.01 30.13 2x7t s GLN 248 CO 0.55 0.22 1.67 -2.30 -0.25 0.00 0.00 175.29 175.18 2x7t n PRO 249 N -0.98 2.69 0.00 2.91 -0.02 -1.26 -4.58 135.00 133.77 2x7t n PRO 249 Ca -0.05 0.97 -0.05 0.00 -2.02 0.00 0.00 63.50 62.35 2x7t n PRO 249 Cb 0.61 -2.79 0.15 0.00 -0.02 0.00 0.00 33.50 31.45 2x7t n PRO 249 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2x7t h LEU 250 N 6.14 0.54 0.00 2.45 5.85 -1.94 -3.43 115.31 124.92 2x7t h LEU 250 Ca -0.44 -0.21 0.00 0.00 0.84 0.00 0.00 57.88 58.07 2x7t h LEU 250 Cb 1.21 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 42.10 2x7t h LEU 250 CO 0.91 0.83 0.00 0.29 -0.34 0.00 0.00 178.44 180.12 2x7t n LYS 251 N -4.07 0.00 -1.82 1.25 5.02 -1.26 -3.29 118.16 113.99 2x7t n LYS 251 Ca -0.01 0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 55.91 2x7t n LYS 251 Cb 0.46 0.00 -0.02 0.00 -0.02 0.00 0.00 35.03 35.45 2x7t n LYS 251 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2x7t n ASN 252 N 2.66 7.78 -4.20 4.39 5.15 -1.26 -4.90 115.26 124.88 2x7t n ASN 252 Ca 0.00 -3.09 -0.18 0.00 -0.60 0.00 0.00 54.58 50.71 2x7t n ASN 252 Cb 0.00 -1.36 -0.12 0.00 -0.53 0.00 0.00 39.78 37.78 2x7t n ASN 252 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 2x7t s ARG 253 N -0.92 0.89 -0.12 1.20 0.52 -1.21 -5.14 118.95 114.18 2x7t s ARG 253 Ca 0.57 -1.07 0.01 0.00 -0.52 0.00 0.00 55.73 54.72 2x7t s ARG 253 Cb 0.22 -0.83 0.02 0.00 0.52 0.00 0.00 34.95 34.88 2x7t s ARG 253 CO -0.11 0.17 -0.15 -1.14 0.02 0.00 0.00 175.30 174.08 2x7t s GLN 254 N -2.15 2.31 -0.14 3.54 2.00 -1.26 -5.02 119.66 118.94 2x7t s GLN 254 Ca 0.02 -0.58 -0.28 0.00 -2.00 0.00 0.00 55.36 52.52 2x7t s GLN 254 Cb -0.08 -2.00 -0.01 0.00 0.80 0.00 0.00 33.01 31.72 2x7t s GLN 254 CO 0.02 -0.11 0.94 0.42 -0.50 0.00 0.00 175.29 176.06 2x7t s ILE 255 N 1.12 4.82 -0.09 -2.34 1.01 -1.26 -4.77 121.20 119.69 2x7t s ILE 255 Ca -0.03 1.88 -0.05 0.00 0.00 0.00 0.00 60.65 62.45 2x7t s ILE 255 Cb -0.14 -4.24 -0.04 0.00 0.01 0.00 0.00 42.46 38.05 2x7t s ILE 255 CO -0.04 0.00 0.12 -0.54 0.00 0.00 0.00 174.94 174.48 2x7t s LYS 256 N 2.12 3.33 -0.08 2.79 -0.14 -0.38 -0.80 119.74 126.59 2x7t s LYS 256 Ca 0.44 -0.24 0.01 0.00 -1.36 0.00 0.00 55.97 54.83 2x7t s LYS 256 Cb -0.17 -3.08 -0.03 0.00 -1.68 0.00 0.00 37.83 32.87 2x7t s LYS 256 CO 0.15 0.74 -0.11 0.00 -0.76 0.00 0.00 175.35 175.37 2x7t s ALA 257 N -1.07 2.79 -2.00 5.17 0.00 0.64 -0.21 121.76 127.08 2x7t s ALA 257 Ca 0.18 -0.92 0.29 0.00 0.00 0.00 0.00 51.96 51.50 2x7t s ALA 257 Cb -0.12 -1.15 1.17 0.00 0.00 0.00 0.00 23.12 23.03 2x7t s ALA 257 CO 0.07 0.48 1.82 -1.13 0.00 0.00 0.00 175.76 177.00 2x7t n SER 258 N 2.60 0.85 -4.17 0.00 3.41 -0.13 -1.12 113.62 115.06 2x7t n SER 258 Ca -0.18 -1.00 -0.15 0.00 -0.26 0.00 0.00 58.87 57.28 2x7t n SER 258 Cb 0.53 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.37 2x7t n SER 258 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 2x7t s PHE 259 N -2.25 1.08 -2.36 7.33 -0.71 -1.26 -4.89 117.98 114.91 2x7t s PHE 259 Ca 0.34 -0.60 0.29 0.00 -1.04 0.00 0.00 56.93 55.91 2x7t s PHE 259 Cb 0.20 -0.59 1.28 0.00 -1.21 0.00 0.00 43.02 42.70 2x7t s PHE 259 CO 0.42 0.02 1.88 1.63 -1.34 0.00 0.00 175.22 177.82