#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nxt s HIS 4 N 0.00 1.44 0.71 1.57 -0.00 -1.26 -5.02 115.29 112.73 2nxt s HIS 4 Ca 0.00 -0.20 -0.14 0.00 -0.00 0.00 0.00 55.06 54.71 2nxt s HIS 4 Cb 0.00 -3.23 0.03 0.00 -0.00 0.00 0.00 32.58 29.38 2nxt s HIS 4 CO 0.00 -1.97 1.15 1.67 -0.00 0.00 0.00 174.74 175.58 2nxt s TRP 5 N -3.32 2.34 0.00 0.38 1.48 -1.26 -4.86 118.94 113.71 2nxt s TRP 5 Ca 0.69 1.59 0.00 0.00 -1.06 0.00 0.00 56.10 57.31 2nxt s TRP 5 Cb -0.04 -3.28 0.00 0.00 -1.16 0.00 0.00 33.47 28.98 2nxt s TRP 5 CO 0.46 -2.11 0.00 0.41 -4.06 0.00 0.00 176.95 171.66 2nxt n GLY 6 N -0.18 2.11 0.51 3.67 0.00 -0.03 -5.03 105.19 106.25 2nxt n GLY 6 Ca 0.11 -0.10 0.05 0.00 0.00 0.00 0.00 46.02 46.09 2nxt n GLY 6 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2nxt n PHE 7 N 0.00 0.00 -2.12 1.61 3.01 -1.26 -3.78 117.46 114.92 2nxt n PHE 7 Ca 0.00 -0.68 -0.01 0.00 1.01 0.00 0.00 57.45 57.77 2nxt n PHE 7 Cb 0.00 -0.13 0.01 0.00 -0.01 0.00 0.00 39.48 39.34 2nxt n PHE 7 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2nxt n GLY 8 N -0.63 0.53 0.25 1.37 0.00 -1.26 -4.78 105.19 100.67 2nxt n GLY 8 Ca 0.10 -1.93 0.00 0.00 0.00 0.00 0.00 46.02 44.20 2nxt n GLY 8 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2nxt h LYS 9 N 0.00 0.37 -0.01 1.61 1.63 -1.99 -2.28 116.57 115.90 2nxt h LYS 9 Ca -0.02 -0.09 0.00 0.00 -0.85 0.00 0.00 60.65 59.69 2nxt h LYS 9 Cb 0.07 -0.05 0.00 0.00 -0.60 0.00 0.00 32.23 31.65 2nxt h LYS 9 CO 0.02 0.50 -0.30 0.72 -3.45 0.00 0.00 179.45 176.94 2nxt n HIS 10 N -4.24 0.00 -1.83 1.91 8.25 -1.26 -4.54 115.22 113.50 2nxt n HIS 10 Ca 0.00 0.00 0.01 0.00 -0.26 0.00 0.00 57.72 57.47 2nxt n HIS 10 Cb 0.29 0.00 0.02 0.00 1.12 0.00 0.00 29.99 31.42 2nxt n HIS 10 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 2nxt n ASN 11 N -0.14 0.30 -3.39 0.41 6.94 -1.22 -4.97 115.26 113.19 2nxt n ASN 11 Ca 0.06 -2.09 -0.23 0.00 -0.02 0.00 0.00 54.58 52.30 2nxt n ASN 11 Cb 0.31 -0.22 0.18 0.00 -2.36 0.00 0.00 39.78 37.69 2nxt n ASN 11 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2nxt n GLY 12 N -0.18 -2.13 0.47 4.83 0.00 -0.86 -0.85 105.19 106.48 2nxt n GLY 12 Ca 0.02 -1.58 0.29 0.00 0.00 0.00 0.00 46.02 44.75 2nxt n GLY 12 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2nxt h PRO 13 N 0.00 0.17 0.00 1.61 0.11 -1.88 0.24 132.00 132.26 2nxt h PRO 13 Ca -0.33 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.77 2nxt h PRO 13 Cb 0.95 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.02 2nxt h PRO 13 CO 0.22 0.11 0.00 -0.85 -0.21 0.00 0.00 178.00 177.27 2nxt n GLU 14 N -4.40 0.19 -0.00 1.05 0.00 -1.26 -2.77 120.64 113.45 2nxt n GLU 14 Ca 0.25 0.13 0.08 0.00 0.00 0.00 0.00 57.16 57.62 2nxt n GLU 14 Cb 1.07 -1.50 -0.12 0.00 0.00 0.00 0.00 31.44 30.89 2nxt n GLU 14 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 2nxt n HIS 15 N -1.35 0.00 0.21 -1.84 8.25 0.84 -4.60 115.22 116.74 2nxt n HIS 15 Ca 0.08 0.00 0.06 0.00 -0.26 0.00 0.00 57.72 57.60 2nxt n HIS 15 Cb 0.17 -0.21 0.56 0.00 1.12 0.00 0.00 29.99 31.64 2nxt n HIS 15 CO 0.00 0.00 0.00 -1.49 0.64 0.00 0.00 176.34 175.49 2nxt h TRP 16 N 0.00 0.07 0.00 4.41 6.55 -1.47 -2.21 115.95 123.30 2nxt h TRP 16 Ca 0.00 -0.00 -0.00 0.00 0.95 0.00 0.00 58.89 59.84 2nxt h TRP 16 Cb 0.61 -0.02 -0.00 0.00 -0.86 0.00 0.00 29.16 28.89 2nxt h TRP 16 CO 0.00 0.11 -0.01 1.12 -1.05 0.00 0.00 178.44 178.61 2nxt h HIS 17 N 0.08 0.00 -0.26 0.49 2.07 -1.79 0.81 115.15 116.55 2nxt h HIS 17 Ca 0.02 0.00 -0.13 0.00 -2.85 0.00 0.00 60.37 57.41 2nxt h HIS 17 Cb 0.10 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.07 2nxt h HIS 17 CO 0.00 0.01 -0.37 0.87 -3.07 0.00 0.00 177.93 175.37 2nxt h LYS 18 N 0.00 0.59 0.00 5.12 1.57 -1.74 -2.81 116.57 119.31 2nxt h LYS 18 Ca -0.00 -0.29 -0.09 0.00 -1.87 0.00 0.00 60.65 58.40 2nxt h LYS 18 Cb 0.03 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.32 2nxt h LYS 18 CO 0.00 0.87 -1.52 -0.25 -0.57 0.00 0.00 179.45 177.98 2nxt n ASP 19 N -4.05 0.56 -3.59 0.86 8.00 -0.86 -4.72 116.55 112.75 2nxt n ASP 19 Ca -0.01 0.23 -0.27 0.00 0.71 0.00 0.00 54.79 55.45 2nxt n ASP 19 Cb 0.50 0.79 -0.10 0.00 -0.02 0.00 0.00 41.12 42.28 2nxt n ASP 19 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 2nxt n PHE 20 N -2.65 1.19 0.31 1.24 3.72 0.22 -4.98 117.46 116.51 2nxt n PHE 20 Ca -0.08 -3.81 0.19 0.00 -0.05 0.00 0.00 57.45 53.71 2nxt n PHE 20 Cb 0.71 -0.21 1.03 0.00 -0.94 0.00 0.00 39.48 40.07 2nxt n PHE 20 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 2nxt h PRO 21 N 5.29 0.00 0.00 -1.08 0.13 -1.74 0.18 132.00 134.77 2nxt h PRO 21 Ca 0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.33 2nxt h PRO 21 Cb 0.82 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.95 2nxt h PRO 21 CO 0.56 0.00 0.00 1.51 -0.23 0.00 0.00 178.00 179.84 2nxt n ILE 22 N -3.21 1.58 0.19 -3.56 3.06 -1.26 -2.07 119.36 114.09 2nxt n ILE 22 Ca -0.02 0.43 0.18 0.00 -2.50 0.00 0.00 62.75 60.84 2nxt n ILE 22 Cb 0.20 -1.34 0.82 0.00 0.54 0.00 0.00 39.64 39.85 2nxt n ILE 22 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2nxt h ALA 23 N 2.17 1.84 -0.60 1.51 0.00 -1.27 0.14 119.26 123.05 2nxt h ALA 23 Ca 0.00 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.78 2nxt h ALA 23 Cb 0.09 0.02 -0.07 0.00 0.00 0.00 0.00 17.79 17.82 2nxt h ALA 23 CO 0.00 -0.37 0.14 1.63 0.00 0.00 0.00 179.25 180.65 2nxt n LYS 24 N -3.73 3.78 -0.92 0.00 5.02 -0.88 -4.96 118.16 116.48 2nxt n LYS 24 Ca 0.03 -3.08 -0.16 0.00 -2.02 0.00 0.00 58.31 53.08 2nxt n LYS 24 Cb 0.39 -2.15 0.12 0.00 -0.02 0.00 0.00 35.03 33.37 2nxt n LYS 24 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2nxt n GLY 25 N -0.08 -1.62 0.03 0.72 0.00 0.50 -4.99 105.19 99.73 2nxt n GLY 25 Ca 0.34 -1.64 0.13 0.00 0.00 0.00 0.00 46.02 44.84 2nxt n GLY 25 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2nxt n GLU 26 N -2.69 0.10 -2.93 1.61 -0.58 -1.26 -4.31 120.64 110.58 2nxt n GLU 26 Ca 0.09 0.04 -0.13 0.00 -0.42 0.00 0.00 57.16 56.74 2nxt n GLU 26 Cb 0.31 -1.58 0.02 0.00 -0.57 0.00 0.00 31.44 29.62 2nxt n GLU 26 CO 0.00 0.00 0.00 2.89 -0.48 0.00 0.00 177.13 179.54 2nxt n ARG 27 N -1.73 1.04 -2.92 3.49 1.85 -1.26 -4.55 116.66 112.57 2nxt n ARG 27 Ca 0.05 -2.95 -0.31 0.00 -1.00 0.00 0.00 57.85 53.64 2nxt n ARG 27 Cb 0.37 -1.31 -0.04 0.00 -1.05 0.00 0.00 32.46 30.43 2nxt n ARG 27 CO 0.00 0.00 0.00 -0.65 -0.01 0.00 0.00 177.63 176.97 2nxt s GLN 28 N -1.90 3.85 0.20 2.89 -1.52 -1.26 -2.90 119.66 119.02 2nxt s GLN 28 Ca 0.32 0.54 0.09 0.00 -1.95 0.00 0.00 55.36 54.36 2nxt s GLN 28 Cb 0.37 -2.40 -0.05 0.00 -0.22 0.00 0.00 33.01 30.72 2nxt s GLN 28 CO -0.04 0.01 -0.17 -1.12 -0.25 0.00 0.00 175.29 173.71 2nxt s SER 29 N -2.90 2.85 0.99 5.90 0.01 -1.26 -4.66 113.70 114.62 2nxt s SER 29 Ca 0.52 -0.96 -0.17 0.00 1.31 0.00 0.00 55.95 56.66 2nxt s SER 29 Cb -0.10 -0.18 0.22 0.00 0.21 0.00 0.00 66.02 66.17 2nxt s SER 29 CO 0.27 -0.07 1.35 -2.16 0.41 0.00 0.00 173.24 173.04 2nxt s PRO 30 N -3.26 0.43 0.12 12.44 0.04 -1.26 -4.61 135.00 138.91 2nxt s PRO 30 Ca 0.21 -0.50 0.02 0.00 0.04 0.00 0.00 61.00 60.77 2nxt s PRO 30 Cb -0.04 -1.83 -0.04 0.00 0.04 0.00 0.00 34.50 32.63 2nxt s PRO 30 CO 0.08 -2.54 -0.04 0.14 0.04 0.00 0.00 177.00 174.68 2nxt s VAL 31 N -3.94 0.70 0.14 -0.36 -7.23 -1.26 -0.53 120.40 107.92 2nxt s VAL 31 Ca 0.76 -1.96 -0.30 0.00 -1.81 0.00 0.00 61.98 58.67 2nxt s VAL 31 Cb -0.03 -1.83 -0.07 0.00 0.56 0.00 0.00 36.38 35.02 2nxt s VAL 31 CO 0.54 -0.74 1.08 -0.62 -0.31 0.00 0.00 175.10 175.04 2nxt s ASP 32 N -3.09 7.29 -0.50 4.85 2.15 -1.26 -2.97 116.67 123.15 2nxt s ASP 32 Ca 0.16 1.99 -0.16 0.00 0.43 0.00 0.00 52.55 54.97 2nxt s ASP 32 Cb 0.05 -2.60 0.09 0.00 -0.30 0.00 0.00 42.92 40.17 2nxt s ASP 32 CO -0.02 -0.22 0.47 -0.63 -0.17 0.00 0.00 175.17 174.60 2nxt s ILE 33 N 0.06 5.16 -0.59 4.11 1.01 0.60 -4.93 121.20 126.61 2nxt s ILE 33 Ca 0.50 -1.11 -0.27 0.00 0.00 0.00 0.00 60.65 59.77 2nxt s ILE 33 Cb -0.28 -4.23 0.03 0.00 0.01 0.00 0.00 42.46 38.00 2nxt s ILE 33 CO 0.33 -0.72 1.14 -0.62 0.00 0.00 0.00 174.94 175.07 2nxt s ASP 34 N 2.94 6.39 0.45 3.58 -1.08 -1.26 -0.52 116.67 127.17 2nxt s ASP 34 Ca 0.05 -0.08 0.23 0.00 -0.52 0.00 0.00 52.55 52.24 2nxt s ASP 34 Cb -0.25 -2.52 1.02 0.00 -1.46 0.00 0.00 42.92 39.70 2nxt s ASP 34 CO 0.06 -1.45 1.88 0.71 0.52 0.00 0.00 175.17 176.89 2nxt h THR 35 N 6.11 0.67 0.00 1.71 1.35 -1.95 -1.60 112.91 119.20 2nxt h THR 35 Ca -0.26 -1.04 -0.11 0.00 -0.55 0.00 0.00 66.41 64.46 2nxt h THR 35 Cb 1.06 1.67 -0.02 0.00 -1.73 0.00 0.00 68.15 69.13 2nxt h THR 35 CO 1.17 0.23 -0.51 0.45 -0.25 0.00 0.00 175.52 176.61 2nxt h HIS 36 N 0.00 0.00 0.00 4.73 3.86 -2.04 -3.31 115.15 118.40 2nxt h HIS 36 Ca -0.00 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.14 2nxt h HIS 36 Cb 0.65 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.11 2nxt h HIS 36 CO 0.00 0.51 -1.29 2.41 0.86 0.00 0.00 177.93 180.43 2nxt n THR 37 N -3.29 0.75 -1.76 2.45 -1.04 -0.94 -4.92 114.28 105.54 2nxt n THR 37 Ca 0.01 -0.60 -0.40 0.00 -2.04 0.00 0.00 64.05 61.02 2nxt n THR 37 Cb 0.71 -0.43 0.02 0.00 -1.82 0.00 0.00 70.33 68.80 2nxt n THR 37 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2nxt n ALA 38 N -2.27 2.03 -2.85 2.41 0.00 -0.65 -4.85 120.51 114.33 2nxt n ALA 38 Ca -0.04 0.26 -0.35 0.00 0.00 0.00 0.00 53.44 53.31 2nxt n ALA 38 Cb 0.66 -2.39 -0.10 0.00 0.00 0.00 0.00 19.45 17.62 2nxt n ALA 38 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2nxt s LYS 39 N -2.37 3.91 0.08 0.00 2.20 -0.70 -4.83 119.74 118.02 2nxt s LYS 39 Ca 0.60 -0.38 -0.35 0.00 -0.36 0.00 0.00 55.97 55.48 2nxt s LYS 39 Cb -0.46 -3.20 -0.15 0.00 -1.51 0.00 0.00 37.83 32.51 2nxt s LYS 39 CO 0.59 0.21 1.53 0.98 -0.36 0.00 0.00 175.35 178.30 2nxt n TYR 40 N 3.71 1.99 -3.88 4.03 9.36 -1.26 0.60 117.16 131.71 2nxt n TYR 40 Ca -0.17 0.39 -0.29 0.00 3.32 0.00 0.00 57.90 61.15 2nxt n TYR 40 Cb 0.52 -2.47 -0.13 0.00 -0.63 0.00 0.00 39.34 36.63 2nxt n TYR 40 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 2nxt s ASP 41 N 1.26 4.22 0.09 2.98 -1.08 -0.30 -4.83 116.67 118.99 2nxt s ASP 41 Ca 0.84 -3.12 0.11 0.00 -0.52 0.00 0.00 52.55 49.86 2nxt s ASP 41 Cb -0.81 -1.49 0.50 0.00 -1.46 0.00 0.00 42.92 39.66 2nxt s ASP 41 CO 0.44 -0.21 1.33 -0.81 0.52 0.00 0.00 175.17 176.45 2nxt n PRO 42 N 2.95 0.05 0.00 4.34 -0.04 -1.26 0.59 135.00 141.63 2nxt n PRO 42 Ca 0.09 0.45 0.15 0.00 -0.04 0.00 0.00 63.50 64.15 2nxt n PRO 42 Cb 0.33 -1.63 0.71 0.00 -0.04 0.00 0.00 33.50 32.88 2nxt n PRO 42 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2nxt n SER 43 N -1.72 0.37 -4.65 3.54 3.41 -1.26 -4.80 113.62 108.50 2nxt n SER 43 Ca 0.01 -0.67 -0.43 0.00 -0.26 0.00 0.00 58.87 57.52 2nxt n SER 43 Cb 0.08 -0.09 -0.02 0.00 -0.26 0.00 0.00 64.21 63.92 2nxt n SER 43 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2nxt s LEU 44 N -2.34 4.02 0.73 1.04 1.43 0.20 -5.02 118.68 118.73 2nxt s LEU 44 Ca 0.34 1.36 -0.11 0.00 -1.03 0.00 0.00 54.13 54.69 2nxt s LEU 44 Cb 0.21 -3.54 0.03 0.00 0.03 0.00 0.00 46.19 42.92 2nxt s LEU 44 CO 0.44 -0.89 1.09 -0.54 0.23 0.00 0.00 176.35 176.67 2nxt s LYS 45 N 3.74 2.64 0.54 1.70 1.02 -1.25 -4.97 119.74 123.17 2nxt s LYS 45 Ca 0.52 0.61 -0.21 0.00 0.02 0.00 0.00 55.97 56.92 2nxt s LYS 45 Cb -0.17 -1.98 -0.05 0.00 -0.52 0.00 0.00 37.83 35.10 2nxt s LYS 45 CO 0.17 -1.22 1.24 -2.14 -0.92 0.00 0.00 175.35 172.47 2nxt s PRO 46 N -5.23 3.23 0.46 -1.68 0.02 -1.26 -2.80 135.00 127.74 2nxt s PRO 46 Ca 0.59 1.93 -0.25 0.00 0.02 0.00 0.00 61.00 63.29 2nxt s PRO 46 Cb -0.13 -2.15 -0.08 0.00 0.02 0.00 0.00 34.50 32.17 2nxt s PRO 46 CO 0.53 -1.03 1.36 -0.51 -0.33 0.00 0.00 177.00 177.03 2nxt s LEU 47 N -3.64 4.08 -0.28 -5.54 1.43 -1.26 -2.03 118.68 111.44 2nxt s LEU 47 Ca 0.72 2.78 -0.01 0.00 -1.03 0.00 0.00 54.13 56.60 2nxt s LEU 47 Cb -0.33 -4.01 0.05 0.00 0.03 0.00 0.00 46.19 41.93 2nxt s LEU 47 CO 0.37 -1.15 -0.04 -0.55 0.23 0.00 0.00 176.35 175.21 2nxt s SER 48 N -0.71 4.67 -0.38 2.29 0.15 0.28 -4.85 113.70 115.14 2nxt s SER 48 Ca 0.62 -1.23 -0.09 0.00 0.70 0.00 0.00 55.95 55.95 2nxt s SER 48 Cb -0.41 -1.66 0.05 0.00 -1.71 0.00 0.00 66.02 62.29 2nxt s SER 48 CO 0.51 -0.22 0.20 -0.69 1.20 0.00 0.00 173.24 174.25 2nxt s VAL 49 N 1.23 4.24 -0.62 4.45 1.01 -1.26 -1.34 120.40 128.11 2nxt s VAL 49 Ca -0.05 -1.14 -0.01 0.00 0.00 0.00 0.00 61.98 60.78 2nxt s VAL 49 Cb -0.19 -3.47 0.16 0.00 0.00 0.00 0.00 36.38 32.87 2nxt s VAL 49 CO -0.03 -0.33 0.41 -0.55 0.00 0.00 0.00 175.10 174.60 2nxt s SER 50 N 1.73 5.00 0.00 3.32 0.15 0.26 -4.89 113.70 119.28 2nxt s SER 50 Ca 0.01 -2.98 0.12 0.00 0.70 0.00 0.00 55.95 53.80 2nxt s SER 50 Cb -0.21 -1.79 0.30 0.00 -1.71 0.00 0.00 66.02 62.61 2nxt s SER 50 CO 0.04 -0.31 1.22 -1.22 1.20 0.00 0.00 173.24 174.17 2nxt n TYR 51 N 3.26 0.43 0.25 3.44 4.01 -1.26 -1.68 117.16 125.62 2nxt n TYR 51 Ca 0.08 -0.43 0.11 0.00 -0.16 0.00 0.00 57.90 57.50 2nxt n TYR 51 Cb 0.36 -0.02 0.67 0.00 -0.31 0.00 0.00 39.34 40.04 2nxt n TYR 51 CO 0.00 0.00 0.00 0.38 -0.46 0.00 0.00 176.86 176.78 2nxt h ASP 52 N 2.24 0.00 -0.48 7.72 2.03 -1.90 -2.02 116.42 124.01 2nxt h ASP 52 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 2nxt h ASP 52 Cb 0.72 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.22 2nxt h ASP 52 CO 0.00 0.14 0.00 0.00 -1.03 0.00 0.00 179.24 178.35 2nxt n GLN 53 N -3.82 3.96 -1.73 4.15 1.13 -1.19 -5.02 117.38 114.85 2nxt n GLN 53 Ca -0.02 -2.96 -0.42 0.00 -1.94 0.00 0.00 57.00 51.66 2nxt n GLN 53 Cb 0.24 -2.01 -0.00 0.00 0.11 0.00 0.00 30.24 28.57 2nxt n GLN 53 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2nxt n ALA 54 N 0.35 1.72 -3.87 -1.58 0.00 -0.76 -4.63 120.51 111.73 2nxt n ALA 54 Ca 0.25 0.34 -0.30 0.00 0.00 0.00 0.00 53.44 53.73 2nxt n ALA 54 Cb 1.01 -2.32 -0.14 0.00 0.00 0.00 0.00 19.45 17.99 2nxt n ALA 54 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2nxt s THR 55 N -1.12 1.96 0.55 0.00 2.01 -1.26 -4.92 115.64 112.86 2nxt s THR 55 Ca 0.55 -2.62 -0.18 0.00 0.31 0.00 0.00 61.69 59.76 2nxt s THR 55 Cb -0.52 -2.40 -0.06 0.00 0.01 0.00 0.00 72.50 69.53 2nxt s THR 55 CO 0.62 -0.76 1.06 -0.94 -0.69 0.00 0.00 174.62 173.91 2nxt s SER 56 N 0.43 5.98 0.00 3.53 1.04 -1.26 -0.70 113.70 122.71 2nxt s SER 56 Ca 0.15 1.89 0.00 0.00 0.48 0.00 0.00 55.95 58.46 2nxt s SER 56 Cb -0.23 -2.55 0.00 0.00 0.10 0.00 0.00 66.02 63.35 2nxt s SER 56 CO -0.05 -1.03 0.00 0.18 0.98 0.00 0.00 173.24 173.32 2nxt n LEU 57 N -1.59 0.76 -3.47 2.42 4.77 0.53 -4.04 117.00 116.38 2nxt n LEU 57 Ca 0.09 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.95 2nxt n LEU 57 Cb 0.53 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.59 2nxt n LEU 57 CO 0.44 0.11 0.35 -0.60 -1.33 0.00 0.00 177.39 176.36 2nxt s ARG 58 N -1.99 1.22 -0.03 3.23 3.52 -1.21 -1.23 118.95 122.46 2nxt s ARG 58 Ca 0.00 -0.48 0.04 0.00 -0.13 0.00 0.00 55.73 55.16 2nxt s ARG 58 Cb 0.00 0.56 -0.01 0.00 -1.56 0.00 0.00 34.95 33.94 2nxt s ARG 58 CO 0.00 -0.52 -0.16 -1.50 -0.81 0.00 0.00 175.30 172.31 2nxt s ILE 59 N -3.63 1.36 -0.05 4.11 2.07 -0.26 -0.78 121.20 124.02 2nxt s ILE 59 Ca 0.01 -0.69 0.02 0.00 -1.41 0.00 0.00 60.65 58.57 2nxt s ILE 59 Cb -0.00 -1.16 0.02 0.00 0.13 0.00 0.00 42.46 41.44 2nxt s ILE 59 CO -0.12 0.39 -0.08 -0.22 -1.91 0.00 0.00 174.94 173.00 2nxt s LEU 60 N -0.07 1.53 -0.40 8.50 2.96 -0.33 -1.29 118.68 129.57 2nxt s LEU 60 Ca -0.01 -0.20 -0.24 0.00 -0.22 0.00 0.00 54.13 53.47 2nxt s LEU 60 Cb -0.10 -0.59 0.02 0.00 0.50 0.00 0.00 46.19 46.01 2nxt s LEU 60 CO 0.01 -0.00 0.83 0.21 -1.32 0.00 0.00 176.35 176.08 2nxt s ASN 61 N 0.69 6.52 -0.05 3.68 3.84 -0.21 -0.80 114.94 128.62 2nxt s ASN 61 Ca -0.11 0.23 0.19 0.00 0.21 0.00 0.00 52.86 53.37 2nxt s ASN 61 Cb -0.14 -2.41 0.63 0.00 -0.55 0.00 0.00 41.25 38.78 2nxt s ASN 61 CO 0.02 -0.85 1.52 -0.46 -2.79 0.00 0.00 177.10 174.54 2nxt n ASN 62 N 6.66 3.98 0.00 -4.21 0.23 -0.73 -0.30 115.26 120.89 2nxt n ASN 62 Ca 0.04 -2.20 0.00 0.00 -0.53 0.00 0.00 54.58 51.89 2nxt n ASN 62 Cb 0.48 -0.50 0.00 0.00 -2.08 0.00 0.00 39.78 37.68 2nxt n ASN 62 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2nxt n GLY 63 N 1.33 1.91 0.00 4.83 0.00 -1.26 -4.77 105.19 107.23 2nxt n GLY 63 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.25 2nxt n GLY 63 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2nxt n HIS 64 N -2.00 0.00 -3.15 1.61 -0.00 -1.26 -4.71 115.22 105.71 2nxt n HIS 64 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 57.72 57.71 2nxt n HIS 64 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 29.99 2nxt n HIS 64 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2nxt n ALA 65 N -1.50 -0.12 -2.42 1.59 0.00 -1.26 -4.86 120.51 111.95 2nxt n ALA 65 Ca 0.00 -0.10 -0.32 0.00 0.00 0.00 0.00 53.44 53.02 2nxt n ALA 65 Cb 0.32 0.08 -0.14 0.00 0.00 0.00 0.00 19.45 19.71 2nxt n ALA 65 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 2nxt s PHE 66 N -7.89 2.55 -0.13 0.00 -0.12 -1.26 -1.78 117.98 109.35 2nxt s PHE 66 Ca 0.01 -0.27 -0.02 0.00 -0.05 0.00 0.00 56.93 56.61 2nxt s PHE 66 Cb -0.00 -1.56 -0.03 0.00 -0.63 0.00 0.00 43.02 40.80 2nxt s PHE 66 CO 0.01 0.12 -0.06 -0.80 -0.05 0.00 0.00 175.22 174.44 2nxt s ASN 67 N -0.81 4.61 -0.32 1.98 0.01 0.02 -4.29 114.94 116.13 2nxt s ASN 67 Ca 0.11 -0.14 -0.17 0.00 -0.71 0.00 0.00 52.86 51.95 2nxt s ASN 67 Cb -0.10 -1.62 -0.01 0.00 0.41 0.00 0.00 41.25 39.92 2nxt s ASN 67 CO 0.01 0.21 0.48 -0.69 -1.51 0.00 0.00 177.10 175.60 2nxt s VAL 68 N 0.11 5.06 0.06 1.60 1.01 -0.00 -1.18 120.40 127.05 2nxt s VAL 68 Ca -0.02 0.43 0.00 0.00 0.00 0.00 0.00 61.98 62.40 2nxt s VAL 68 Cb -0.14 -3.90 -0.04 0.00 0.00 0.00 0.00 36.38 32.30 2nxt s VAL 68 CO 0.03 -0.11 0.18 -1.61 0.00 0.00 0.00 175.10 173.59 2nxt s GLU 69 N 2.31 3.33 0.20 2.72 2.02 0.04 -1.19 118.70 128.12 2nxt s GLU 69 Ca 0.18 -0.48 0.10 0.00 0.02 0.00 0.00 54.97 54.78 2nxt s GLU 69 Cb -0.16 -2.98 -0.04 0.00 0.10 0.00 0.00 34.13 31.05 2nxt s GLU 69 CO 0.12 0.60 -0.20 -0.06 0.02 0.00 0.00 175.26 175.75 2nxt s PHE 70 N -1.47 2.01 -0.24 1.61 0.40 -0.33 -0.34 117.98 119.62 2nxt s PHE 70 Ca 0.33 -0.43 -0.29 0.00 -0.60 0.00 0.00 56.93 55.95 2nxt s PHE 70 Cb -0.13 -0.97 -0.02 0.00 0.51 0.00 0.00 43.02 42.41 2nxt s PHE 70 CO 0.26 0.44 1.52 0.34 0.70 0.00 0.00 175.22 178.48 2nxt s ASP 71 N -2.88 6.48 -0.20 1.36 2.15 0.12 -4.84 116.67 118.86 2nxt s ASP 71 Ca 0.20 1.51 0.14 0.00 0.43 0.00 0.00 52.55 54.84 2nxt s ASP 71 Cb -0.06 -2.53 0.43 0.00 -0.30 0.00 0.00 42.92 40.46 2nxt s ASP 71 CO 0.09 -1.19 1.31 -0.90 -0.17 0.00 0.00 175.17 174.31 2nxt n ASP 72 N 8.16 2.66 -0.43 -0.34 5.75 -1.26 -4.56 116.55 126.53 2nxt n ASP 72 Ca 0.17 -3.39 0.11 0.00 -0.01 0.00 0.00 54.79 51.68 2nxt n ASP 72 Cb 0.46 -0.53 0.45 0.00 -1.03 0.00 0.00 41.12 40.47 2nxt n ASP 72 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 2nxt n SER 73 N -1.06 1.30 -3.87 -1.12 3.41 -1.26 -4.88 113.62 106.13 2nxt n SER 73 Ca 0.22 -1.60 -0.10 0.00 -0.26 0.00 0.00 58.87 57.14 2nxt n SER 73 Cb 0.81 -0.07 -0.06 0.00 -0.26 0.00 0.00 64.21 64.64 2nxt n SER 73 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 2nxt s GLN 74 N -1.87 1.18 -1.18 4.33 -0.21 -1.26 -5.06 119.66 115.58 2nxt s GLN 74 Ca 0.33 -1.04 -0.19 0.00 0.02 0.00 0.00 55.36 54.48 2nxt s GLN 74 Cb 0.17 0.42 -0.03 0.00 1.00 0.00 0.00 33.01 34.57 2nxt s GLN 74 CO 0.27 -0.45 1.96 -0.25 -2.12 0.00 0.00 175.29 174.71 2nxt n ASP 75 N -0.23 3.63 -0.10 5.90 8.00 -1.26 -4.67 116.55 127.82 2nxt n ASP 75 Ca -0.09 -2.79 -0.13 0.00 0.71 0.00 0.00 54.79 52.49 2nxt n ASP 75 Cb 0.63 -1.56 -0.14 0.00 -0.02 0.00 0.00 41.12 40.03 2nxt n ASP 75 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2nxt n LYS 76 N 7.37 0.68 -3.59 -1.24 5.02 -1.26 -4.87 118.16 120.26 2nxt n LYS 76 Ca 0.49 0.08 -0.27 0.00 -2.02 0.00 0.00 58.31 56.59 2nxt n LYS 76 Cb 0.43 -1.55 -0.16 0.00 -0.02 0.00 0.00 35.03 33.73 2nxt n LYS 76 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2nxt s ALA 77 N -2.51 0.48 0.08 7.82 0.00 -1.26 -2.95 121.76 123.42 2nxt s ALA 77 Ca -0.19 -0.51 0.04 0.00 0.00 0.00 0.00 51.96 51.30 2nxt s ALA 77 Cb 0.07 -1.13 -0.03 0.00 0.00 0.00 0.00 23.12 22.03 2nxt s ALA 77 CO 0.75 -1.30 -0.12 0.14 0.00 0.00 0.00 175.76 175.24 2nxt s VAL 78 N 2.12 0.98 -0.09 0.00 -7.23 -0.68 -0.71 120.40 114.80 2nxt s VAL 78 Ca 0.04 -1.41 0.02 0.00 -1.81 0.00 0.00 61.98 58.82 2nxt s VAL 78 Cb -0.16 -1.12 -0.02 0.00 0.56 0.00 0.00 36.38 35.64 2nxt s VAL 78 CO -0.16 -0.37 -0.14 -0.22 -0.31 0.00 0.00 175.10 173.90 2nxt s LEU 79 N -1.99 2.74 0.23 1.32 2.96 0.28 -0.57 118.68 123.65 2nxt s LEU 79 Ca -0.00 -0.25 -0.07 0.00 -0.22 0.00 0.00 54.13 53.59 2nxt s LEU 79 Cb -0.07 -1.58 -0.02 0.00 0.50 0.00 0.00 46.19 45.01 2nxt s LEU 79 CO 0.01 0.26 0.32 -0.54 -1.32 0.00 0.00 176.35 175.09 2nxt s LYS 80 N -0.24 1.41 2.00 1.98 1.02 -0.45 -1.24 119.74 124.22 2nxt s LYS 80 Ca 0.01 -1.45 0.00 0.00 0.02 0.00 0.00 55.97 54.55 2nxt s LYS 80 Cb -0.13 0.38 0.00 0.00 -0.52 0.00 0.00 37.83 37.56 2nxt s LYS 80 CO 0.03 -0.54 0.00 0.41 -0.92 0.00 0.00 175.35 174.33 2nxt n GLY 81 N -0.34 -1.41 7.00 -3.33 0.00 -1.26 -0.56 105.19 105.29 2nxt n GLY 81 Ca 0.00 -1.29 0.00 0.00 0.00 0.00 0.00 46.02 44.73 2nxt n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nxt n GLY 82 N 0.00 3.34 0.08 -0.02 0.00 -0.86 -0.67 105.19 107.06 2nxt n GLY 82 Ca 0.00 -0.20 0.15 0.00 0.00 0.00 0.00 46.02 45.97 2nxt n GLY 82 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2nxt n PRO 83 N 14.00 0.87 -3.12 1.61 -0.04 -1.26 -3.78 135.00 143.28 2nxt n PRO 83 Ca 0.00 -0.16 -0.38 0.00 -0.04 0.00 0.00 63.50 62.92 2nxt n PRO 83 Cb 0.00 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 31.90 2nxt n PRO 83 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2nxt s LEU 84 N -2.24 4.48 -0.25 1.53 1.43 0.15 -5.06 118.68 118.73 2nxt s LEU 84 Ca 0.38 1.43 -0.12 0.00 -1.03 0.00 0.00 54.13 54.80 2nxt s LEU 84 Cb 0.21 -3.27 -0.05 0.00 0.03 0.00 0.00 46.19 43.11 2nxt s LEU 84 CO 0.41 0.17 0.21 -1.81 0.23 0.00 0.00 176.35 175.56 2nxt s ASP 85 N -1.33 6.13 0.00 2.29 1.01 -1.26 -4.18 116.67 119.33 2nxt s ASP 85 Ca 0.36 0.14 0.00 0.00 0.71 0.00 0.00 52.55 53.76 2nxt s ASP 85 Cb -0.20 -2.13 0.00 0.00 1.01 0.00 0.00 42.92 41.60 2nxt s ASP 85 CO 0.22 -0.00 0.00 0.61 0.21 0.00 0.00 175.17 176.21 2nxt n GLY 86 N 4.49 -1.80 3.22 0.21 0.00 -1.26 -4.94 105.19 105.11 2nxt n GLY 86 Ca -0.13 -1.83 -0.32 0.00 0.00 0.00 0.00 46.02 43.73 2nxt n GLY 86 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2nxt s THR 87 N 0.00 2.16 -0.14 2.61 2.01 -1.26 -4.52 115.64 116.49 2nxt s THR 87 Ca 0.00 -0.97 0.02 0.00 0.31 0.00 0.00 61.69 61.04 2nxt s THR 87 Cb 0.00 -1.84 0.00 0.00 0.01 0.00 0.00 72.50 70.67 2nxt s THR 87 CO 0.00 0.55 -0.19 -0.31 -0.69 0.00 0.00 174.62 173.98 2nxt s TYR 88 N 0.46 2.71 -0.07 4.92 1.51 -0.37 -1.18 117.35 125.33 2nxt s TYR 88 Ca -0.15 -1.12 -0.12 0.00 -1.01 0.00 0.00 57.07 54.66 2nxt s TYR 88 Cb -0.17 -1.83 -0.05 0.00 -0.11 0.00 0.00 41.96 39.80 2nxt s TYR 88 CO 0.06 -0.49 0.31 1.03 -1.11 0.00 0.00 175.55 175.35 2nxt s ARG 89 N 0.70 3.86 0.00 -0.62 0.52 0.09 -0.55 118.95 122.94 2nxt s ARG 89 Ca -0.09 0.20 -0.30 0.00 -0.52 0.00 0.00 55.73 55.03 2nxt s ARG 89 Cb -0.16 -3.25 -0.06 0.00 0.52 0.00 0.00 34.95 32.00 2nxt s ARG 89 CO 0.01 0.62 1.41 -1.17 0.02 0.00 0.00 175.30 176.19 2nxt s LEU 90 N -0.74 4.32 -0.15 2.53 2.96 0.11 -1.02 118.68 126.69 2nxt s LEU 90 Ca 0.20 2.12 0.03 0.00 -0.22 0.00 0.00 54.13 56.26 2nxt s LEU 90 Cb -0.15 -3.56 -0.11 0.00 0.50 0.00 0.00 46.19 42.87 2nxt s LEU 90 CO 0.09 -0.72 -0.10 0.00 -1.32 0.00 0.00 176.35 174.30 2nxt n ILE 91 N 4.67 0.87 -3.45 6.68 3.06 -0.22 -4.49 119.36 126.48 2nxt n ILE 91 Ca 0.13 -0.38 -0.11 0.00 -2.50 0.00 0.00 62.75 59.90 2nxt n ILE 91 Cb 0.44 -0.96 -0.02 0.00 0.54 0.00 0.00 39.64 39.63 2nxt n ILE 91 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2nxt s GLN 92 N -2.31 1.11 0.20 9.51 1.03 -1.21 -1.18 119.66 126.81 2nxt s GLN 92 Ca -0.17 -0.41 0.07 0.00 0.04 0.00 0.00 55.36 54.89 2nxt s GLN 92 Cb 0.05 0.51 -0.05 0.00 0.03 0.00 0.00 33.01 33.55 2nxt s GLN 92 CO 0.39 -0.48 -0.14 -0.59 -2.54 0.00 0.00 175.29 171.92 2nxt s PHE 93 N -3.51 1.67 0.30 9.60 -0.12 -0.33 -0.65 117.98 124.93 2nxt s PHE 93 Ca 0.03 -0.59 -0.16 0.00 -0.05 0.00 0.00 56.93 56.16 2nxt s PHE 93 Cb -0.01 -0.78 0.02 0.00 -0.63 0.00 0.00 43.02 41.62 2nxt s PHE 93 CO -0.11 0.34 0.65 -3.38 -0.05 0.00 0.00 175.22 172.66 2nxt s HIS 94 N -2.98 0.14 0.28 3.49 -3.43 -0.77 -0.82 115.29 111.20 2nxt s HIS 94 Ca 0.22 -0.60 0.08 0.00 -0.80 0.00 0.00 55.06 53.95 2nxt s HIS 94 Cb -0.01 0.52 -0.06 0.00 -1.43 0.00 0.00 32.58 31.61 2nxt s HIS 94 CO 0.06 -1.24 -0.10 -0.06 -2.00 0.00 0.00 174.74 171.41 2nxt s PHE 95 N -3.52 2.03 -0.04 0.38 0.40 -1.26 -0.52 117.98 115.46 2nxt s PHE 95 Ca 0.17 -0.59 0.06 0.00 -0.60 0.00 0.00 56.93 55.97 2nxt s PHE 95 Cb -0.04 -1.09 -0.01 0.00 0.51 0.00 0.00 43.02 42.39 2nxt s PHE 95 CO 0.10 0.41 -0.22 -1.01 0.70 0.00 0.00 175.22 175.20 2nxt s HIS 96 N -2.87 2.05 0.24 0.36 3.76 -0.01 -4.76 115.29 114.06 2nxt s HIS 96 Ca 0.29 -0.51 -0.12 0.00 -0.15 0.00 0.00 55.06 54.57 2nxt s HIS 96 Cb 0.02 -1.34 -0.01 0.00 1.11 0.00 0.00 32.58 32.36 2nxt s HIS 96 CO 0.12 -0.13 0.44 1.67 -0.85 0.00 0.00 174.74 176.00 2nxt s TRP 97 N -0.26 0.42 0.48 1.40 -2.14 -1.22 -0.86 118.94 116.77 2nxt s TRP 97 Ca 0.02 -0.77 0.08 0.00 2.66 0.00 0.00 56.10 58.09 2nxt s TRP 97 Cb -0.11 0.12 0.02 0.00 -3.10 0.00 0.00 33.47 30.40 2nxt s TRP 97 CO 0.01 -0.95 0.52 0.20 -2.66 0.00 0.00 176.95 174.07 2nxt s GLY 98 N -3.02 2.06 0.26 3.67 0.00 -1.17 -0.78 107.32 108.34 2nxt s GLY 98 Ca 0.23 -1.77 0.25 0.00 0.00 0.00 0.00 44.72 43.43 2nxt s GLY 98 CO 0.08 -1.72 1.62 1.48 0.00 0.00 0.00 173.10 174.57 2nxt h SER 99 N 0.70 0.00 -5.05 1.64 4.64 -1.89 -3.39 113.55 110.20 2nxt h SER 99 Ca -0.37 -0.03 -0.16 0.00 -0.47 0.00 0.00 61.79 60.76 2nxt h SER 99 Cb 1.28 0.00 -0.17 0.00 -0.31 0.00 0.00 62.40 63.20 2nxt h SER 99 CO 0.51 0.01 -0.69 -0.76 -0.87 0.00 0.00 176.83 175.04 2nxt s LEU 100 N -5.03 2.41 0.55 5.97 1.43 -1.26 -5.06 118.68 117.69 2nxt s LEU 100 Ca 0.08 -0.84 0.32 0.00 -1.03 0.00 0.00 54.13 52.67 2nxt s LEU 100 Cb 0.10 0.11 1.57 0.00 0.03 0.00 0.00 46.19 48.00 2nxt s LEU 100 CO 0.65 -0.47 2.08 0.44 0.23 0.00 0.00 176.35 179.27 2nxt h ASP 101 N 3.62 0.00 0.21 2.29 3.32 -1.92 -2.75 116.42 121.18 2nxt h ASP 101 Ca -0.34 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.71 2nxt h ASP 101 Cb 1.17 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.72 2nxt h ASP 101 CO 0.57 0.07 0.00 0.61 -1.72 0.00 0.00 179.24 178.78 2nxt n GLY 102 N -0.46 -0.77 3.53 2.75 0.00 -1.26 -3.57 105.19 105.41 2nxt n GLY 102 Ca -0.01 -0.10 -0.09 0.00 0.00 0.00 0.00 46.02 45.82 2nxt n GLY 102 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2nxt s GLN 103 N -2.36 1.40 0.00 1.61 -2.07 -1.04 -4.70 119.66 112.51 2nxt s GLN 103 Ca 0.21 -0.99 0.00 0.00 -1.82 0.00 0.00 55.36 52.76 2nxt s GLN 103 Cb 0.12 0.49 0.00 0.00 -1.09 0.00 0.00 33.01 32.54 2nxt s GLN 103 CO 0.25 -0.59 0.00 0.41 -1.32 0.00 0.00 175.29 174.05 2nxt n GLY 104 N -0.34 1.31 3.79 2.60 0.00 -1.06 -3.18 105.19 108.31 2nxt n GLY 104 Ca -0.08 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.59 2nxt n GLY 104 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2nxt s SER 105 N 0.00 6.38 -0.14 1.61 0.15 -0.48 -3.39 113.70 117.83 2nxt s SER 105 Ca 0.00 2.04 -0.11 0.00 0.70 0.00 0.00 55.95 58.58 2nxt s SER 105 Cb 0.00 -2.58 -0.07 0.00 -1.71 0.00 0.00 66.02 61.67 2nxt s SER 105 CO 0.00 -0.76 -0.00 -0.33 1.20 0.00 0.00 173.24 173.35 2nxt h GLU 106 N 1.88 0.00 -7.15 5.44 5.08 -1.91 -3.46 114.58 114.46 2nxt h GLU 106 Ca -0.49 0.00 -0.51 0.00 -1.00 0.00 0.00 59.36 57.36 2nxt h GLU 106 Cb 1.23 0.00 0.10 0.00 0.50 0.00 0.00 28.75 30.58 2nxt h GLU 106 CO 0.60 0.25 0.41 -1.01 -1.00 0.00 0.00 179.01 178.26 2nxt s HIS 107 N -2.11 2.52 0.20 4.33 3.76 -1.26 -4.20 115.29 118.53 2nxt s HIS 107 Ca -0.14 1.55 0.06 0.00 -0.15 0.00 0.00 55.06 56.38 2nxt s HIS 107 Cb 0.02 -3.29 -0.05 0.00 1.11 0.00 0.00 32.58 30.37 2nxt s HIS 107 CO 0.27 -1.86 -0.10 0.95 -0.85 0.00 0.00 174.74 173.15 2nxt s THR 108 N -2.03 1.49 -0.23 1.30 -4.23 -1.16 -4.69 115.64 106.09 2nxt s THR 108 Ca 0.71 -2.14 0.01 0.00 -1.18 0.00 0.00 61.69 59.09 2nxt s THR 108 Cb -0.24 -2.08 0.05 0.00 1.34 0.00 0.00 72.50 71.57 2nxt s THR 108 CO 0.37 -0.56 -0.08 -0.69 -0.54 0.00 0.00 174.62 173.12 2nxt s VAL 109 N -3.13 1.64 -1.56 2.29 1.01 -0.65 -0.29 120.40 119.72 2nxt s VAL 109 Ca 0.23 -1.21 -0.13 0.00 0.00 0.00 0.00 61.98 60.87 2nxt s VAL 109 Cb 0.02 -1.83 0.09 0.00 0.00 0.00 0.00 36.38 34.66 2nxt s VAL 109 CO 0.06 -0.01 0.83 0.47 0.00 0.00 0.00 175.10 176.45 2nxt n ASP 110 N 4.65 -3.49 0.00 3.32 8.00 0.32 -0.89 116.55 128.46 2nxt n ASP 110 Ca -0.13 -0.88 0.00 0.00 0.71 0.00 0.00 54.79 54.49 2nxt n ASP 110 Cb 0.45 -3.44 0.00 0.00 -0.02 0.00 0.00 41.12 38.10 2nxt n ASP 110 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2nxt n LYS 111 N -4.52 -0.01 -2.39 -1.24 4.76 -1.26 -4.99 118.16 108.50 2nxt n LYS 111 Ca -0.02 0.00 -0.42 0.00 -2.87 0.00 0.00 58.31 55.00 2nxt n LYS 111 Cb 0.55 -3.28 -0.03 0.00 -1.84 0.00 0.00 35.03 30.42 2nxt n LYS 111 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 2nxt s LYS 112 N -0.39 4.41 -0.10 1.97 2.20 -0.07 -5.00 119.74 122.76 2nxt s LYS 112 Ca 0.00 1.81 -0.14 0.00 -0.36 0.00 0.00 55.97 57.28 2nxt s LYS 112 Cb 0.00 -3.36 -0.05 0.00 -1.51 0.00 0.00 37.83 32.92 2nxt s LYS 112 CO 0.00 -0.30 0.33 0.15 -0.36 0.00 0.00 175.35 175.17 2nxt s LYS 113 N 1.18 4.04 0.53 4.03 1.02 -1.26 -1.63 119.74 127.64 2nxt s LYS 113 Ca 0.59 0.20 0.00 0.00 0.02 0.00 0.00 55.97 56.79 2nxt s LYS 113 Cb -0.30 -3.33 0.02 0.00 -0.52 0.00 0.00 37.83 33.71 2nxt s LYS 113 CO 0.29 0.46 0.76 0.71 -0.92 0.00 0.00 175.35 176.65 2nxt s TYR 114 N -0.24 2.98 0.29 3.18 2.02 -1.26 -4.67 117.35 119.65 2nxt s TYR 114 Ca 0.20 0.11 0.18 0.00 -0.37 0.00 0.00 57.07 57.18 2nxt s TYR 114 Cb -0.14 -2.65 0.80 0.00 -0.40 0.00 0.00 41.96 39.57 2nxt s TYR 114 CO 0.08 -0.75 1.82 0.00 -1.57 0.00 0.00 175.55 175.12 2nxt h ALA 115 N 0.12 1.18 -2.63 3.71 0.00 -1.44 -1.20 119.26 119.00 2nxt h ALA 115 Ca -0.43 -0.32 0.13 0.00 0.00 0.00 0.00 54.91 54.28 2nxt h ALA 115 Cb 1.28 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.96 2nxt h ALA 115 CO 0.54 0.44 0.39 0.00 0.00 0.00 0.00 179.25 180.62 2nxt s ALA 116 N -3.91 -1.43 -0.10 0.00 0.00 -1.10 -3.03 121.76 112.18 2nxt s ALA 116 Ca -0.02 -0.13 -0.06 0.00 0.00 0.00 0.00 51.96 51.76 2nxt s ALA 116 Cb 0.13 0.72 0.04 0.00 0.00 0.00 0.00 23.12 24.01 2nxt s ALA 116 CO 0.69 -1.04 0.25 -2.00 0.00 0.00 0.00 175.76 173.65 2nxt s GLU 117 N -3.33 0.21 -0.13 0.00 2.12 -0.04 -0.93 118.70 116.60 2nxt s GLU 117 Ca 0.13 0.51 -0.13 0.00 0.36 0.00 0.00 54.97 55.84 2nxt s GLU 117 Cb -0.03 -0.10 -0.05 0.00 0.26 0.00 0.00 34.13 34.21 2nxt s GLU 117 CO 0.05 -0.15 0.28 -1.17 -0.54 0.00 0.00 175.26 173.73 2nxt s LEU 118 N 1.15 4.30 -0.21 2.70 2.96 0.14 -0.83 118.68 128.89 2nxt s LEU 118 Ca -0.08 0.55 0.00 0.00 -0.22 0.00 0.00 54.13 54.38 2nxt s LEU 118 Cb -0.09 -2.34 0.02 0.00 0.50 0.00 0.00 46.19 44.28 2nxt s LEU 118 CO -0.08 0.19 -0.13 -1.00 -1.32 0.00 0.00 176.35 174.01 2nxt s HIS 119 N -0.00 2.94 -0.37 5.38 3.76 0.32 -0.96 115.29 126.35 2nxt s HIS 119 Ca 0.17 -1.63 -0.15 0.00 -0.15 0.00 0.00 55.06 53.30 2nxt s HIS 119 Cb -0.13 -1.98 0.00 0.00 1.11 0.00 0.00 32.58 31.58 2nxt s HIS 119 CO 0.05 -0.77 0.32 -0.51 -0.85 0.00 0.00 174.74 172.99 2nxt s LEU 120 N 1.30 4.72 -0.21 0.89 1.43 0.24 -1.84 118.68 125.21 2nxt s LEU 120 Ca 0.02 -0.54 -0.12 0.00 -1.03 0.00 0.00 54.13 52.46 2nxt s LEU 120 Cb -0.15 -2.24 -0.05 0.00 0.03 0.00 0.00 46.19 43.78 2nxt s LEU 120 CO -0.09 -0.38 0.22 -0.69 0.23 0.00 0.00 176.35 175.64 2nxt s VAL 121 N 1.87 5.34 0.09 -1.59 1.01 0.17 -1.30 120.40 125.98 2nxt s VAL 121 Ca 0.08 0.34 0.06 0.00 0.00 0.00 0.00 61.98 62.46 2nxt s VAL 121 Cb -0.18 -3.55 -0.03 0.00 0.00 0.00 0.00 36.38 32.62 2nxt s VAL 121 CO 0.11 0.37 -0.16 -1.00 0.00 0.00 0.00 175.10 174.42 2nxt s HIS 122 N 0.78 1.36 0.07 5.22 3.76 -0.20 -1.06 115.29 125.22 2nxt s HIS 122 Ca 0.11 -0.47 0.08 0.00 -0.15 0.00 0.00 55.06 54.64 2nxt s HIS 122 Cb -0.13 -0.75 -0.03 0.00 1.11 0.00 0.00 32.58 32.78 2nxt s HIS 122 CO 0.03 0.10 -0.22 1.67 -0.85 0.00 0.00 174.74 175.47 2nxt s TRP 123 N -1.39 1.89 -0.15 1.40 1.48 -0.19 -0.73 118.94 121.25 2nxt s TRP 123 Ca 0.01 -0.39 -0.29 0.00 -1.06 0.00 0.00 56.10 54.37 2nxt s TRP 123 Cb -0.09 -1.09 -0.03 0.00 -1.16 0.00 0.00 33.47 31.10 2nxt s TRP 123 CO 0.03 0.15 1.46 1.21 -4.06 0.00 0.00 176.95 175.74 2nxt s ASN 124 N -1.47 6.73 0.21 -2.66 3.84 0.65 -0.73 114.94 121.50 2nxt s ASN 124 Ca 0.08 1.83 0.20 0.00 0.21 0.00 0.00 52.86 55.19 2nxt s ASN 124 Cb -0.09 -2.54 0.89 0.00 -0.55 0.00 0.00 41.25 38.96 2nxt s ASN 124 CO 0.03 -0.93 1.62 0.35 -2.79 0.00 0.00 177.10 175.39 2nxt n THR 125 N 5.65 0.94 0.31 -5.21 -2.24 -0.32 -1.62 114.28 111.79 2nxt n THR 125 Ca 0.16 0.31 0.12 0.00 -2.27 0.00 0.00 64.05 62.37 2nxt n THR 125 Cb 0.44 -1.22 0.54 0.00 -2.10 0.00 0.00 70.33 67.99 2nxt n THR 125 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 2nxt n LYS 126 N -2.07 0.19 -0.07 -0.78 2.85 -1.26 -2.15 118.16 114.86 2nxt n LYS 126 Ca 0.02 0.51 0.12 0.00 -1.05 0.00 0.00 58.31 57.90 2nxt n LYS 126 Cb 0.18 -1.92 0.14 0.00 -0.65 0.00 0.00 35.03 32.78 2nxt n LYS 126 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2nxt n TYR 127 N -2.28 0.19 0.00 5.58 4.01 -0.64 -5.00 117.16 119.02 2nxt n TYR 127 Ca 0.01 -0.10 0.00 0.00 -0.16 0.00 0.00 57.90 57.65 2nxt n TYR 127 Cb 0.17 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.20 2nxt n TYR 127 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2nxt n GLY 128 N 1.40 1.64 3.50 2.72 0.00 -0.91 -4.51 105.19 109.02 2nxt n GLY 128 Ca 0.16 -0.25 -0.09 0.00 0.00 0.00 0.00 46.02 45.83 2nxt n GLY 128 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2nxt s ASP 129 N 0.00 -0.14 0.23 1.61 1.47 -1.26 -5.05 116.67 113.53 2nxt s ASP 129 Ca 0.00 -0.69 -0.08 0.00 1.18 0.00 0.00 52.55 52.96 2nxt s ASP 129 Cb 0.00 0.55 0.22 0.00 -0.34 0.00 0.00 42.92 43.35 2nxt s ASP 129 CO 0.00 -1.04 1.91 0.15 0.68 0.00 0.00 175.17 176.87 2nxt h PHE 130 N 2.30 1.14 -0.01 2.11 3.57 -1.95 -1.13 116.94 122.97 2nxt h PHE 130 Ca -0.29 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.19 2nxt h PHE 130 Cb 1.25 -0.38 -0.01 0.00 2.79 0.00 0.00 35.95 39.60 2nxt h PHE 130 CO 0.38 0.71 -0.26 0.78 -2.23 0.00 0.00 178.31 177.69 2nxt h GLY 131 N 1.22 0.01 1.45 2.40 0.00 -1.97 -1.56 103.07 104.63 2nxt h GLY 131 Ca 0.34 -0.01 -0.27 0.00 0.00 0.00 0.00 47.33 47.39 2nxt h GLY 131 CO -0.08 0.01 -1.16 0.50 0.00 0.00 0.00 176.54 175.81 2nxt h LYS 132 N 0.01 0.45 -0.69 4.80 1.79 -1.75 -3.34 116.57 117.85 2nxt h LYS 132 Ca -0.00 -0.61 -0.03 0.00 -2.18 0.00 0.00 60.65 57.83 2nxt h LYS 132 Cb 0.47 0.20 -0.03 0.00 -1.58 0.00 0.00 32.23 31.29 2nxt h LYS 132 CO 0.03 1.25 0.30 0.00 -1.08 0.00 0.00 179.45 179.96 2nxt h ALA 133 N 0.51 1.24 0.00 3.86 0.00 -0.49 -2.04 119.26 122.34 2nxt h ALA 133 Ca -0.14 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2nxt h ALA 133 Cb 1.84 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 19.35 2nxt h ALA 133 CO 0.21 0.57 0.00 1.33 0.00 0.00 0.00 179.25 181.36 2nxt n VAL 134 N -4.32 0.91 0.37 0.00 0.24 -0.65 -1.57 118.33 113.31 2nxt n VAL 134 Ca 0.06 0.23 0.08 0.00 -2.04 0.00 0.00 64.34 62.67 2nxt n VAL 134 Cb 0.15 -1.00 0.23 0.00 -1.47 0.00 0.00 33.84 31.75 2nxt n VAL 134 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2nxt n GLN 135 N -1.42 2.21 -4.64 7.34 6.02 -0.76 -4.65 117.38 121.48 2nxt n GLN 135 Ca 0.04 -1.83 -0.26 0.00 -0.01 0.00 0.00 57.00 54.94 2nxt n GLN 135 Cb 0.14 -1.41 -0.14 0.00 1.02 0.00 0.00 30.24 29.85 2nxt n GLN 135 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2nxt s GLN 136 N -1.34 1.43 0.53 -1.09 -1.52 -0.61 -5.03 119.66 112.03 2nxt s GLN 136 Ca 0.34 -1.02 0.28 0.00 -1.95 0.00 0.00 55.36 53.02 2nxt s GLN 136 Cb 0.18 -1.60 1.50 0.00 -0.22 0.00 0.00 33.01 32.88 2nxt s GLN 136 CO 0.23 0.40 2.09 -1.35 -0.25 0.00 0.00 175.29 176.41 2nxt h PRO 137 N 4.71 0.00 -0.55 2.91 0.11 -1.86 -2.33 132.00 134.99 2nxt h PRO 137 Ca -0.44 0.00 -0.37 0.00 0.11 0.00 0.00 66.00 65.29 2nxt h PRO 137 Cb 1.16 0.00 -0.25 0.00 0.11 0.00 0.00 31.00 32.02 2nxt h PRO 137 CO 0.43 0.10 -0.35 -0.40 -0.21 0.00 0.00 178.00 177.57 2nxt n ASP 138 N -3.60 4.05 0.08 -2.05 5.75 -1.26 -4.24 116.55 115.28 2nxt n ASP 138 Ca -0.02 -3.80 -0.10 0.00 -0.01 0.00 0.00 54.79 50.87 2nxt n ASP 138 Cb 0.23 -0.54 -0.07 0.00 -1.03 0.00 0.00 41.12 39.71 2nxt n ASP 138 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 2nxt h GLY 139 N 1.63 0.17 -3.42 6.12 0.00 -1.09 -3.43 103.07 103.06 2nxt h GLY 139 Ca 0.30 -0.37 -0.54 0.00 0.00 0.00 0.00 47.33 46.71 2nxt h GLY 139 CO 0.64 0.33 -0.79 1.08 0.00 0.00 0.00 176.54 177.79 2nxt s LEU 140 N -7.13 2.41 -0.09 3.11 1.43 -0.04 -0.26 118.68 118.11 2nxt s LEU 140 Ca -0.02 -0.83 0.00 0.00 -1.03 0.00 0.00 54.13 52.25 2nxt s LEU 140 Cb 0.09 -0.88 0.02 0.00 0.03 0.00 0.00 46.19 45.45 2nxt s LEU 140 CO 0.84 -0.00 -0.08 0.00 0.23 0.00 0.00 176.35 177.34 2nxt s ALA 141 N -1.86 1.24 -0.17 4.21 0.00 0.09 -0.67 121.76 124.60 2nxt s ALA 141 Ca 0.15 -0.46 0.00 0.00 0.00 0.00 0.00 51.96 51.65 2nxt s ALA 141 Cb -0.07 -0.78 0.00 0.00 0.00 0.00 0.00 23.12 22.27 2nxt s ALA 141 CO 0.07 -0.26 -0.16 0.08 0.00 0.00 0.00 175.76 175.49 2nxt s VAL 142 N 1.40 2.56 -0.33 0.00 1.01 -0.76 -1.03 120.40 123.25 2nxt s VAL 142 Ca -0.01 -0.79 -0.21 0.00 0.00 0.00 0.00 61.98 60.97 2nxt s VAL 142 Cb -0.13 -2.09 -0.00 0.00 0.00 0.00 0.00 36.38 34.16 2nxt s VAL 142 CO -0.04 0.51 0.65 -0.22 0.00 0.00 0.00 175.10 176.00 2nxt s LEU 143 N 1.00 4.18 -0.14 3.92 2.96 -0.42 -1.28 118.68 128.91 2nxt s LEU 143 Ca -0.02 0.33 -0.04 0.00 -0.22 0.00 0.00 54.13 54.17 2nxt s LEU 143 Cb -0.15 -2.83 -0.03 0.00 0.50 0.00 0.00 46.19 43.67 2nxt s LEU 143 CO -0.03 -0.55 0.02 -0.83 -1.32 0.00 0.00 176.35 173.63 2nxt s GLY 144 N 1.71 1.85 -0.07 7.98 0.00 0.28 -0.60 107.32 118.48 2nxt s GLY 144 Ca 0.26 -0.78 0.00 0.00 0.00 0.00 0.00 44.72 44.20 2nxt s GLY 144 CO 0.13 -0.22 -0.05 -0.42 0.00 0.00 0.00 173.10 172.54 2nxt s ILE 145 N -0.15 0.68 0.40 0.90 1.01 -0.14 -0.79 121.20 123.11 2nxt s ILE 145 Ca 0.05 -0.15 -0.24 0.00 0.00 0.00 0.00 60.65 60.32 2nxt s ILE 145 Cb -0.12 -0.71 -0.09 0.00 0.01 0.00 0.00 42.46 41.54 2nxt s ILE 145 CO 0.02 0.28 1.02 -0.36 0.00 0.00 0.00 174.94 175.90 2nxt s PHE 146 N 1.27 3.33 -0.13 3.97 0.08 -1.26 -0.68 117.98 124.55 2nxt s PHE 146 Ca -0.05 1.66 0.01 0.00 0.12 0.00 0.00 56.93 58.67 2nxt s PHE 146 Cb -0.14 -3.06 -0.01 0.00 -0.57 0.00 0.00 43.02 39.25 2nxt s PHE 146 CO -0.02 -0.44 -0.16 -0.51 -0.10 0.00 0.00 175.22 173.99 2nxt s LEU 147 N -2.66 2.55 0.25 -0.37 1.02 -0.11 -0.81 118.68 118.55 2nxt s LEU 147 Ca 0.58 -0.39 0.11 0.00 0.02 0.00 0.00 54.13 54.44 2nxt s LEU 147 Cb -0.20 -1.56 -0.05 0.00 0.02 0.00 0.00 46.19 44.41 2nxt s LEU 147 CO 0.25 0.16 -0.13 -1.59 0.02 0.00 0.00 176.35 175.05 2nxt s LYS 148 N 0.39 1.89 -0.15 1.70 -2.85 -0.39 -1.93 119.74 118.40 2nxt s LYS 148 Ca -0.12 -1.57 -0.18 0.00 -1.00 0.00 0.00 55.97 53.10 2nxt s LYS 148 Cb -0.16 -1.95 -0.04 0.00 -2.06 0.00 0.00 37.83 33.62 2nxt s LYS 148 CO 0.06 0.36 0.47 0.08 0.10 0.00 0.00 175.35 176.43 2nxt s VAL 149 N -2.24 5.17 0.00 1.79 1.01 -1.26 -0.89 120.40 123.98 2nxt s VAL 149 Ca 0.28 0.91 0.00 0.00 0.00 0.00 0.00 61.98 63.18 2nxt s VAL 149 Cb -0.06 -3.81 0.00 0.00 0.00 0.00 0.00 36.38 32.51 2nxt s VAL 149 CO 0.16 0.27 0.00 0.61 0.00 0.00 0.00 175.10 176.14 2nxt n GLY 150 N 3.54 -0.05 3.74 4.51 0.00 0.58 -4.90 105.19 112.61 2nxt n GLY 150 Ca -0.07 0.55 -0.33 0.00 0.00 0.00 0.00 46.02 46.17 2nxt n GLY 150 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2nxt s SER 151 N 2.00 4.51 0.55 1.61 1.04 -1.26 -4.14 113.70 118.02 2nxt s SER 151 Ca 0.00 2.12 -0.19 0.00 0.48 0.00 0.00 55.95 58.35 2nxt s SER 151 Cb 0.00 -2.56 -0.05 0.00 0.10 0.00 0.00 66.02 63.50 2nxt s SER 151 CO 0.00 -2.04 1.15 0.00 0.98 0.00 0.00 173.24 173.33 2nxt s ALA 152 N -2.31 2.67 -0.51 5.32 0.00 -1.26 -2.25 121.76 123.40 2nxt s ALA 152 Ca 0.69 0.88 -0.16 0.00 0.00 0.00 0.00 51.96 53.36 2nxt s ALA 152 Cb -0.23 -3.39 0.09 0.00 0.00 0.00 0.00 23.12 19.60 2nxt s ALA 152 CO 0.46 -0.87 0.49 0.21 0.00 0.00 0.00 175.76 176.05 2nxt s LYS 153 N -3.27 3.01 0.32 0.00 2.47 -1.15 -4.80 119.74 116.32 2nxt s LYS 153 Ca 0.74 -1.42 0.03 0.00 -1.56 0.00 0.00 55.97 53.76 2nxt s LYS 153 Cb -0.26 -4.20 0.62 0.00 -1.46 0.00 0.00 37.83 32.53 2nxt s LYS 153 CO 0.29 -1.21 1.89 -1.35 0.16 0.00 0.00 175.35 175.14 2nxt h PRO 154 N 8.87 0.89 0.00 4.03 0.11 -1.91 -1.32 132.00 142.67 2nxt h PRO 154 Ca -0.29 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.77 2nxt h PRO 154 Cb 1.10 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 32.01 2nxt h PRO 154 CO 0.97 0.59 0.00 0.41 -0.21 0.00 0.00 178.00 179.76 2nxt n GLY 155 N -1.40 -1.04 0.07 -0.55 0.00 -1.26 -1.91 105.19 99.10 2nxt n GLY 155 Ca 0.15 0.03 0.12 0.00 0.00 0.00 0.00 46.02 46.31 2nxt n GLY 155 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2nxt h LEU 156 N 0.00 0.00 -1.04 0.99 5.85 -1.46 -3.41 115.31 116.25 2nxt h LEU 156 Ca 0.00 -0.20 -0.09 0.00 0.84 0.00 0.00 57.88 58.43 2nxt h LEU 156 Cb 0.24 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 2nxt h LEU 156 CO 0.00 0.10 -0.36 -0.61 -0.34 0.00 0.00 178.44 177.23 2nxt h GLN 157 N 0.00 0.23 -0.29 1.25 5.75 -1.42 -1.13 115.11 119.50 2nxt h GLN 157 Ca 0.00 -0.10 -0.02 0.00 -0.15 0.00 0.00 58.65 58.38 2nxt h GLN 157 Cb 0.79 -0.01 -0.02 0.00 1.07 0.00 0.00 27.48 29.32 2nxt h GLN 157 CO 0.00 0.56 0.07 -0.22 -2.65 0.00 0.00 178.83 176.60 2nxt h LYS 158 N 0.20 0.41 0.12 1.69 3.64 -1.78 0.07 116.57 120.92 2nxt h LYS 158 Ca 0.02 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.34 2nxt h LYS 158 Cb 0.73 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.47 2nxt h LYS 158 CO 0.06 0.38 -0.06 0.28 -2.27 0.00 0.00 179.45 177.84 2nxt h VAL 159 N 0.41 1.04 -0.86 2.00 2.07 -1.52 -3.04 116.25 116.35 2nxt h VAL 159 Ca 0.10 -0.69 0.18 0.00 0.82 0.00 0.00 66.70 67.12 2nxt h VAL 159 Cb 0.16 1.47 -0.11 0.00 -1.52 0.00 0.00 31.29 31.29 2nxt h VAL 159 CO -0.00 0.16 0.40 0.58 0.02 0.00 0.00 177.57 178.73 2nxt h VAL 160 N -0.49 0.59 0.00 2.57 2.07 -0.85 -2.40 116.25 117.75 2nxt h VAL 160 Ca -0.02 -0.17 -0.05 0.00 0.82 0.00 0.00 66.70 67.29 2nxt h VAL 160 Cb 0.39 0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 30.21 2nxt h VAL 160 CO 0.03 0.09 -0.22 0.44 0.02 0.00 0.00 177.57 177.93 2nxt h ASP 161 N 0.49 0.00 0.57 0.57 3.32 -0.95 -2.69 116.42 117.73 2nxt h ASP 161 Ca 0.51 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.56 2nxt h ASP 161 Cb 0.86 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.41 2nxt h ASP 161 CO -0.45 0.22 -0.17 0.55 -1.72 0.00 0.00 179.24 177.66 2nxt n VAL 162 N -3.24 0.00 0.25 -1.35 3.14 -0.91 -4.21 118.33 112.02 2nxt n VAL 162 Ca 0.02 -0.03 0.10 0.00 -2.96 0.00 0.00 64.34 61.46 2nxt n VAL 162 Cb 0.52 -0.12 0.66 0.00 -1.06 0.00 0.00 33.84 33.84 2nxt n VAL 162 CO 0.00 0.00 0.00 -0.07 -6.46 0.00 0.00 176.83 170.30 2nxt h LEU 163 N 0.28 0.00 -2.26 6.55 3.38 -1.43 -0.37 115.31 121.46 2nxt h LEU 163 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 2nxt h LEU 163 Cb 0.43 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.18 2nxt h LEU 163 CO 0.00 0.12 -0.04 0.44 0.09 0.00 0.00 178.44 179.05 2nxt h ASP 164 N 0.00 0.00 0.57 -0.43 3.32 -1.78 -1.73 116.42 116.37 2nxt h ASP 164 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2nxt h ASP 164 Cb 0.25 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.80 2nxt h ASP 164 CO 0.02 0.04 -0.25 -1.54 -1.72 0.00 0.00 179.24 175.78 2nxt n SER 165 N -3.91 0.42 -2.52 6.45 3.41 -0.15 -3.95 113.62 113.36 2nxt n SER 165 Ca -0.03 -0.20 -0.16 0.00 -0.26 0.00 0.00 58.87 58.22 2nxt n SER 165 Cb 0.12 -0.03 0.02 0.00 -0.26 0.00 0.00 64.21 64.06 2nxt n SER 165 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 2nxt n ILE 166 N -1.28 1.77 -0.08 -1.33 -5.35 -0.66 -4.75 119.36 107.68 2nxt n ILE 166 Ca 0.09 -3.88 -0.03 0.00 -0.27 0.00 0.00 62.75 58.66 2nxt n ILE 166 Cb 0.32 -0.20 0.21 0.00 -1.74 0.00 0.00 39.64 38.23 2nxt n ILE 166 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 2nxt h LYS 167 N 2.66 0.72 -6.36 6.28 3.64 -1.66 -3.42 116.57 118.43 2nxt h LYS 167 Ca 0.11 -0.17 -0.62 0.00 -1.27 0.00 0.00 60.65 58.70 2nxt h LYS 167 Cb 1.16 -0.10 -0.15 0.00 -0.41 0.00 0.00 32.23 32.73 2nxt h LYS 167 CO 0.62 0.71 -0.78 0.95 -2.27 0.00 0.00 179.45 178.68 2nxt s THR 168 N -5.04 2.48 0.10 1.00 -4.23 -1.26 -0.53 115.64 108.16 2nxt s THR 168 Ca -0.09 -2.25 -0.36 0.00 -1.18 0.00 0.00 61.69 57.81 2nxt s THR 168 Cb 0.15 -2.26 -0.15 0.00 1.34 0.00 0.00 72.50 71.58 2nxt s THR 168 CO 0.79 -0.29 1.47 1.17 -0.54 0.00 0.00 174.62 177.22 2nxt n LYS 169 N -0.31 1.61 0.00 3.99 4.81 -0.00 -2.04 118.16 126.22 2nxt n LYS 169 Ca -0.08 0.58 0.00 0.00 -0.87 0.00 0.00 58.31 57.94 2nxt n LYS 169 Cb 0.58 -2.28 0.00 0.00 0.02 0.00 0.00 35.03 33.35 2nxt n LYS 169 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2nxt n GLY 170 N 3.02 0.81 3.75 3.14 0.00 0.59 -4.55 105.19 111.95 2nxt n GLY 170 Ca 0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.80 2nxt n GLY 170 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2nxt s LYS 171 N -0.75 4.73 0.19 1.61 -0.14 -0.86 -4.89 119.74 119.63 2nxt s LYS 171 Ca 0.00 1.60 0.03 0.00 -1.36 0.00 0.00 55.97 56.23 2nxt s LYS 171 Cb 0.00 -3.28 -0.05 0.00 -1.68 0.00 0.00 37.83 32.82 2nxt s LYS 171 CO 0.00 0.31 -0.01 -1.54 -0.76 0.00 0.00 175.35 173.35 2nxt s SER 172 N -0.69 1.52 -0.02 2.83 1.04 -1.26 -1.04 113.70 116.08 2nxt s SER 172 Ca 0.44 -1.18 -0.11 0.00 0.48 0.00 0.00 55.95 55.59 2nxt s SER 172 Cb -0.27 0.06 0.01 0.00 0.10 0.00 0.00 66.02 65.92 2nxt s SER 172 CO 0.34 -0.52 0.23 0.00 0.98 0.00 0.00 173.24 174.27 2nxt s ALA 173 N -3.53 -0.57 0.36 5.32 0.00 -0.41 -4.93 121.76 118.00 2nxt s ALA 173 Ca 0.25 0.21 -0.28 0.00 0.00 0.00 0.00 51.96 52.14 2nxt s ALA 173 Cb 0.06 0.00 -0.11 0.00 0.00 0.00 0.00 23.12 23.06 2nxt s ALA 173 CO 0.06 -0.21 1.43 -0.25 0.00 0.00 0.00 175.76 176.78 2nxt n ASP 174 N 1.64 3.48 -2.96 0.00 8.00 -1.26 -1.11 116.55 124.35 2nxt n ASP 174 Ca -0.20 1.22 -0.15 0.00 0.71 0.00 0.00 54.79 56.36 2nxt n ASP 174 Cb 0.56 -1.58 0.00 0.00 -0.02 0.00 0.00 41.12 40.09 2nxt n ASP 174 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 2nxt n PHE 175 N 0.46 -1.82 -2.85 1.24 7.35 -0.36 -4.71 117.46 116.76 2nxt n PHE 175 Ca 0.03 -2.68 -0.25 0.00 -0.76 0.00 0.00 57.45 53.78 2nxt n PHE 175 Cb 0.38 0.66 0.00 0.00 0.35 0.00 0.00 39.48 40.88 2nxt n PHE 175 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 2nxt s THR 176 N -0.39 4.53 -1.66 -2.13 -4.23 -1.26 -3.25 115.64 107.26 2nxt s THR 176 Ca 0.33 -0.15 0.00 0.00 -1.18 0.00 0.00 61.69 60.68 2nxt s THR 176 Cb 0.23 -3.70 0.00 0.00 1.34 0.00 0.00 72.50 70.37 2nxt s THR 176 CO -0.15 -0.60 0.00 0.59 -0.54 0.00 0.00 174.62 173.92 2nxt n ASN 177 N -2.16 -5.49 -4.76 3.99 4.13 -1.26 -4.97 115.26 104.75 2nxt n ASN 177 Ca 0.00 0.02 -0.38 0.00 1.68 0.00 0.00 54.58 55.89 2nxt n ASN 177 Cb 0.56 -4.54 -0.06 0.00 -1.54 0.00 0.00 39.78 34.20 2nxt n ASN 177 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 2nxt s PHE 178 N -2.94 3.63 -0.45 3.10 5.36 -1.26 -5.02 117.98 120.41 2nxt s PHE 178 Ca 0.00 1.07 -0.12 0.00 -0.96 0.00 0.00 56.93 56.92 2nxt s PHE 178 Cb 0.00 -2.54 0.08 0.00 -0.34 0.00 0.00 43.02 40.21 2nxt s PHE 178 CO 0.00 0.34 0.33 0.34 -1.46 0.00 0.00 175.22 174.77 2nxt s ASP 179 N -0.06 5.89 0.00 6.13 -1.08 -1.26 -4.44 116.67 121.85 2nxt s ASP 179 Ca 0.28 -1.42 0.15 0.00 -0.52 0.00 0.00 52.55 51.04 2nxt s ASP 179 Cb -0.17 -2.09 0.66 0.00 -1.46 0.00 0.00 42.92 39.86 2nxt s ASP 179 CO 0.14 -0.60 1.48 -0.81 0.52 0.00 0.00 175.17 175.91 2nxt n PRO 180 N 5.06 0.02 0.30 4.34 -0.04 -1.26 -2.17 135.00 141.25 2nxt n PRO 180 Ca -0.11 0.23 0.17 0.00 -0.04 0.00 0.00 63.50 63.75 2nxt n PRO 180 Cb 0.43 -1.50 0.97 0.00 -0.04 0.00 0.00 33.50 33.36 2nxt n PRO 180 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2nxt h ARG 181 N 0.00 0.00 0.00 0.54 3.08 -1.92 -1.85 114.38 114.23 2nxt h ARG 181 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2nxt h ARG 181 Cb 0.25 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.30 2nxt h ARG 181 CO 0.00 0.02 0.00 0.41 -1.07 0.00 0.00 179.97 179.33 2nxt n GLY 182 N -1.07 -0.73 0.83 0.04 0.00 -0.92 -2.60 105.19 100.74 2nxt n GLY 182 Ca -0.03 -0.14 0.10 0.00 0.00 0.00 0.00 46.02 45.96 2nxt n GLY 182 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2nxt n LEU 183 N -0.99 2.73 -4.87 0.99 4.77 -0.70 -4.03 117.00 114.91 2nxt n LEU 183 Ca 0.17 -1.00 -0.34 0.00 -0.03 0.00 0.00 56.01 54.82 2nxt n LEU 183 Cb 0.08 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.11 2nxt n LEU 183 CO 0.13 0.47 0.13 -0.76 -1.33 0.00 0.00 177.39 176.02 2nxt s LEU 184 N -1.76 4.31 1.01 2.23 1.43 -1.07 -4.93 118.68 119.91 2nxt s LEU 184 Ca 0.24 0.86 -0.16 0.00 -1.03 0.00 0.00 54.13 54.04 2nxt s LEU 184 Cb 0.17 -3.19 0.21 0.00 0.03 0.00 0.00 46.19 43.42 2nxt s LEU 184 CO 0.27 0.11 1.23 -2.16 0.23 0.00 0.00 176.35 176.03 2nxt s PRO 185 N -2.13 0.26 0.09 1.29 0.04 -1.26 -4.99 135.00 128.29 2nxt s PRO 185 Ca 0.37 -0.20 -0.19 0.00 0.04 0.00 0.00 61.00 61.03 2nxt s PRO 185 Cb -0.14 -1.78 -0.08 0.00 0.04 0.00 0.00 34.50 32.54 2nxt s PRO 185 CO 0.19 -2.70 1.53 1.49 0.04 0.00 0.00 177.00 177.55 2nxt h GLU 186 N -1.85 0.42 -6.06 4.56 4.81 -1.92 -3.44 114.58 111.10 2nxt h GLU 186 Ca -0.45 -0.13 -0.60 0.00 -0.13 0.00 0.00 59.36 58.05 2nxt h GLU 186 Cb 1.27 -0.04 -0.05 0.00 0.63 0.00 0.00 28.75 30.56 2nxt h GLU 186 CO 0.41 0.58 -0.19 0.45 -0.73 0.00 0.00 179.01 179.53 2nxt s SER 187 N -5.90 6.80 -0.24 1.04 0.15 -1.26 -4.99 113.70 109.30 2nxt s SER 187 Ca -0.14 0.96 0.14 0.00 0.70 0.00 0.00 55.95 57.61 2nxt s SER 187 Cb 0.07 -2.25 0.81 0.00 -1.71 0.00 0.00 66.02 62.95 2nxt s SER 187 CO 0.74 0.28 1.74 0.18 1.20 0.00 0.00 173.24 177.39 2nxt n LEU 188 N 1.60 5.68 -4.76 3.45 4.77 -1.26 -4.70 117.00 121.77 2nxt n LEU 188 Ca -0.12 -2.95 -0.41 0.00 -0.03 0.00 0.00 56.01 52.50 2nxt n LEU 188 Cb 0.52 -0.68 0.00 0.00 -2.33 0.00 0.00 43.42 40.93 2nxt n LEU 188 CO 0.39 0.64 1.10 0.47 -1.33 0.00 0.00 177.39 178.65 2nxt n ASP 189 N 0.55 3.61 -3.94 -1.43 8.00 -1.26 -4.81 116.55 117.27 2nxt n ASP 189 Ca 0.28 1.21 -0.10 0.00 0.71 0.00 0.00 54.79 56.89 2nxt n ASP 189 Cb 1.19 -1.60 -0.07 0.00 -0.02 0.00 0.00 41.12 40.62 2nxt n ASP 189 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 2nxt s TYR 190 N -1.13 0.35 0.11 1.24 -0.85 -1.26 -1.09 117.35 114.73 2nxt s TYR 190 Ca 0.54 -0.71 0.06 0.00 -0.52 0.00 0.00 57.07 56.44 2nxt s TYR 190 Cb -0.48 -0.00 -0.04 0.00 0.38 0.00 0.00 41.96 41.82 2nxt s TYR 190 CO 0.63 -0.76 -0.02 -1.58 -1.52 0.00 0.00 175.55 172.30 2nxt s TRP 191 N -3.96 2.93 -0.01 -3.49 0.51 -0.06 -0.88 118.94 113.97 2nxt s TRP 191 Ca 0.17 -0.06 -0.04 0.00 -2.12 0.00 0.00 56.10 54.05 2nxt s TRP 191 Cb 0.03 -1.50 0.00 0.00 -0.81 0.00 0.00 33.47 31.19 2nxt s TRP 191 CO 0.01 0.48 0.08 -0.08 -0.51 0.00 0.00 176.95 176.92 2nxt s THR 192 N -1.36 0.05 0.17 2.01 -1.32 0.33 -0.69 115.64 114.84 2nxt s THR 192 Ca 0.25 -0.44 -0.23 0.00 -1.21 0.00 0.00 61.69 60.06 2nxt s THR 192 Cb -0.11 -0.27 0.06 0.00 -1.51 0.00 0.00 72.50 70.67 2nxt s THR 192 CO 0.18 -0.24 0.64 -0.72 -2.21 0.00 0.00 174.62 172.27 2nxt s TYR 193 N -0.78 -0.46 -0.03 9.09 1.13 -1.06 -1.47 117.35 123.78 2nxt s TYR 193 Ca -0.09 0.21 -0.24 0.00 -1.41 0.00 0.00 57.07 55.54 2nxt s TYR 193 Cb -0.05 0.59 -0.04 0.00 -1.10 0.00 0.00 41.96 41.35 2nxt s TYR 193 CO 0.00 -0.91 0.73 -1.25 -2.51 0.00 0.00 175.55 171.62 2nxt s PRO 194 N -3.74 4.45 0.00 -3.49 0.04 -1.26 -1.25 135.00 129.74 2nxt s PRO 194 Ca 0.03 0.95 0.00 0.00 0.04 0.00 0.00 61.00 62.03 2nxt s PRO 194 Cb -0.02 -3.42 0.00 0.00 0.04 0.00 0.00 34.50 31.10 2nxt s PRO 194 CO -0.09 0.14 0.00 0.41 0.04 0.00 0.00 177.00 177.50 2nxt n GLY 195 N 2.84 4.46 3.19 0.56 0.00 0.59 -4.82 105.19 112.02 2nxt n GLY 195 Ca -0.02 -0.52 -0.12 0.00 0.00 0.00 0.00 46.02 45.37 2nxt n GLY 195 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2nxt s SER 196 N 1.59 0.21 0.59 1.61 0.15 -1.14 -2.28 113.70 114.43 2nxt s SER 196 Ca 0.00 -1.35 -0.20 0.00 0.70 0.00 0.00 55.95 55.10 2nxt s SER 196 Cb 0.00 0.36 -0.04 0.00 -1.71 0.00 0.00 66.02 64.63 2nxt s SER 196 CO 0.00 -0.81 1.27 0.18 1.20 0.00 0.00 173.24 175.08 2nxt n LEU 197 N -0.24 5.41 -0.90 3.45 4.77 -0.39 -4.51 117.00 124.59 2nxt n LEU 197 Ca 0.00 0.90 0.10 0.00 -0.03 0.00 0.00 56.01 56.98 2nxt n LEU 197 Cb 0.65 -1.54 0.14 0.00 -2.33 0.00 0.00 43.42 40.35 2nxt n LEU 197 CO 0.33 -0.94 0.61 0.35 -1.33 0.00 0.00 177.39 176.41 2nxt n THR 198 N -1.46 0.29 -4.39 -5.08 -2.24 -1.26 -4.40 114.28 95.74 2nxt n THR 198 Ca 0.13 -0.65 -0.24 0.00 -2.27 0.00 0.00 64.05 61.03 2nxt n THR 198 Cb 0.46 1.15 -0.11 0.00 -2.10 0.00 0.00 70.33 69.73 2nxt n THR 198 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2nxt s THR 199 N -1.47 2.10 0.25 4.28 -4.23 -1.26 -4.67 115.64 110.65 2nxt s THR 199 Ca 0.29 -2.05 -0.30 0.00 -1.18 0.00 0.00 61.69 58.45 2nxt s THR 199 Cb 0.18 -2.02 -0.15 0.00 1.34 0.00 0.00 72.50 71.85 2nxt s THR 199 CO 0.26 -0.27 1.06 -2.65 -0.54 0.00 0.00 174.62 172.48 2nxt n PRO 200 N 0.12 1.29 -0.10 3.99 -0.02 -1.26 -1.02 135.00 137.99 2nxt n PRO 200 Ca -0.11 0.45 0.03 0.00 -2.02 0.00 0.00 63.50 61.85 2nxt n PRO 200 Cb 0.57 -1.87 0.08 0.00 -0.02 0.00 0.00 33.50 32.26 2nxt n PRO 200 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2nxt n PRO 201 N 1.12 1.47 -2.37 0.52 -0.04 -1.26 -5.00 135.00 129.43 2nxt n PRO 201 Ca 0.12 -0.65 -0.18 0.00 -0.04 0.00 0.00 63.50 62.74 2nxt n PRO 201 Cb 0.29 -1.20 -0.01 0.00 -0.04 0.00 0.00 33.50 32.55 2nxt n PRO 201 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2nxt n LEU 202 N 0.03 -1.87 -4.77 1.53 4.77 -0.19 -4.90 117.00 111.60 2nxt n LEU 202 Ca 0.06 -0.03 -0.38 0.00 -0.03 0.00 0.00 56.01 55.63 2nxt n LEU 202 Cb 0.19 -2.66 -0.01 0.00 -2.33 0.00 0.00 43.42 38.61 2nxt n LEU 202 CO 0.04 -0.18 0.87 -0.76 -1.33 0.00 0.00 177.39 176.04 2nxt s LEU 203 N -5.33 4.10 -1.24 2.23 1.43 -1.26 -4.41 118.68 114.19 2nxt s LEU 203 Ca 0.01 2.42 -0.08 0.00 -1.03 0.00 0.00 54.13 55.45 2nxt s LEU 203 Cb -0.00 -4.11 0.20 0.00 0.03 0.00 0.00 46.19 42.30 2nxt s LEU 203 CO 0.01 -0.87 1.81 -0.62 0.23 0.00 0.00 176.35 176.91 2nxt n GLU 204 N -0.23 3.83 0.00 1.70 1.02 -1.26 -1.27 120.64 124.44 2nxt n GLU 204 Ca 0.06 -3.74 0.00 0.00 -0.02 0.00 0.00 57.16 53.46 2nxt n GLU 204 Cb 0.46 -2.83 0.00 0.00 -0.02 0.00 0.00 31.44 29.05 2nxt n GLU 204 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2nxt s VAL 206 N -0.50 3.65 -0.37 0.00 1.01 -0.97 -0.86 120.40 122.36 2nxt s VAL 206 Ca 0.00 -0.45 -0.21 0.00 0.00 0.00 0.00 61.98 61.32 2nxt s VAL 206 Cb 0.00 -2.57 0.01 0.00 0.00 0.00 0.00 36.38 33.81 2nxt s VAL 206 CO 0.00 0.51 0.66 -0.89 0.00 0.00 0.00 175.10 175.39 2nxt s THR 207 N 0.25 4.85 0.08 3.92 2.01 0.15 -0.30 115.64 126.60 2nxt s THR 207 Ca -0.05 0.57 -0.24 0.00 0.31 0.00 0.00 61.69 62.28 2nxt s THR 207 Cb -0.14 -4.12 -0.06 0.00 0.01 0.00 0.00 72.50 68.18 2nxt s THR 207 CO 0.04 -0.38 0.73 0.26 -0.69 0.00 0.00 174.62 174.58 2nxt s TRP 208 N 2.80 3.80 -0.27 4.92 0.52 -0.38 -1.82 118.94 128.51 2nxt s TRP 208 Ca 0.25 1.48 -0.01 0.00 0.02 0.00 0.00 56.10 57.85 2nxt s TRP 208 Cb -0.14 -2.75 0.08 0.00 -1.15 0.00 0.00 33.47 29.51 2nxt s TRP 208 CO 0.16 0.40 0.05 0.42 0.02 0.00 0.00 176.95 177.99 2nxt s ILE 209 N -0.55 1.03 -0.25 2.03 1.01 -0.40 -2.55 121.20 121.51 2nxt s ILE 209 Ca 0.36 -1.23 -0.06 0.00 0.00 0.00 0.00 60.65 59.72 2nxt s ILE 209 Cb -0.21 -1.62 -0.02 0.00 0.01 0.00 0.00 42.46 40.63 2nxt s ILE 209 CO 0.23 -0.44 0.05 -0.69 0.00 0.00 0.00 174.94 174.09 2nxt s VAL 210 N 1.58 4.04 0.32 2.92 1.01 0.14 -0.56 120.40 129.85 2nxt s VAL 210 Ca 0.04 -0.36 -0.28 0.00 0.00 0.00 0.00 61.98 61.39 2nxt s VAL 210 Cb -0.18 -2.92 -0.09 0.00 0.00 0.00 0.00 36.38 33.19 2nxt s VAL 210 CO -0.16 0.30 1.10 -0.76 0.00 0.00 0.00 175.10 175.58 2nxt s LEU 211 N 1.56 4.40 0.18 3.92 1.43 0.03 -0.88 118.68 129.33 2nxt s LEU 211 Ca 0.05 2.23 -0.03 0.00 -1.03 0.00 0.00 54.13 55.36 2nxt s LEU 211 Cb -0.15 -3.81 0.09 0.00 0.03 0.00 0.00 46.19 42.34 2nxt s LEU 211 CO 0.02 -0.30 1.48 0.50 0.23 0.00 0.00 176.35 178.27 2nxt h LYS 212 N 3.34 0.52 -5.71 1.70 3.64 -1.44 -3.43 116.57 115.19 2nxt h LYS 212 Ca -0.47 -0.36 -0.59 0.00 -1.27 0.00 0.00 60.65 57.96 2nxt h LYS 212 Cb 1.22 0.05 -0.09 0.00 -0.41 0.00 0.00 32.23 33.00 2nxt h LYS 212 CO 0.65 0.97 0.21 -2.00 -2.27 0.00 0.00 179.45 177.02 2nxt s GLU 213 N -3.88 4.21 0.72 1.90 2.12 -1.26 -5.01 118.70 117.51 2nxt s GLU 213 Ca -0.07 0.72 -0.11 0.00 0.36 0.00 0.00 54.97 55.87 2nxt s GLU 213 Cb 0.11 -3.59 0.02 0.00 0.26 0.00 0.00 34.13 30.93 2nxt s GLU 213 CO 0.84 -0.30 1.07 -1.25 -0.54 0.00 0.00 175.26 175.08 2nxt s PRO 214 N 2.12 2.71 0.21 4.30 0.04 -1.26 -4.65 135.00 138.46 2nxt s PRO 214 Ca 0.31 0.96 0.03 0.00 0.04 0.00 0.00 61.00 62.34 2nxt s PRO 214 Cb -0.16 -1.96 -0.03 0.00 0.04 0.00 0.00 34.50 32.38 2nxt s PRO 214 CO 0.10 -1.26 0.34 0.96 0.04 0.00 0.00 177.00 177.19 2nxt s ILE 215 N -3.03 5.27 -0.18 0.56 -4.36 0.01 -4.87 121.20 114.60 2nxt s ILE 215 Ca 0.59 -0.77 -0.03 0.00 -0.26 0.00 0.00 60.65 60.17 2nxt s ILE 215 Cb -0.15 -3.80 -0.02 0.00 1.25 0.00 0.00 42.46 39.75 2nxt s ILE 215 CO 0.55 -0.23 -0.05 -0.94 0.24 0.00 0.00 174.94 174.51 2nxt s SER 216 N -3.60 4.46 0.29 4.36 1.04 -1.26 -1.26 113.70 117.73 2nxt s SER 216 Ca 0.35 -0.28 0.10 0.00 0.48 0.00 0.00 55.95 56.60 2nxt s SER 216 Cb -0.10 -1.74 -0.05 0.00 0.10 0.00 0.00 66.02 64.23 2nxt s SER 216 CO 0.29 0.08 -0.05 0.68 0.98 0.00 0.00 173.24 175.22 2nxt s VAL 217 N 0.89 2.98 0.53 5.02 -7.23 -0.07 -2.92 120.40 119.60 2nxt s VAL 217 Ca -0.01 -2.06 -0.04 0.00 -1.81 0.00 0.00 61.98 58.06 2nxt s VAL 217 Cb -0.15 -2.69 -0.00 0.00 0.56 0.00 0.00 36.38 34.11 2nxt s VAL 217 CO 0.01 -0.34 0.82 -0.94 -0.31 0.00 0.00 175.10 174.34 2nxt s SER 218 N -3.64 5.75 0.39 4.85 1.04 -1.00 -0.31 113.70 120.79 2nxt s SER 218 Ca 0.32 0.62 0.06 0.00 0.48 0.00 0.00 55.95 57.43 2nxt s SER 218 Cb -0.04 -1.73 0.80 0.00 0.10 0.00 0.00 66.02 65.14 2nxt s SER 218 CO 0.18 -0.89 2.03 0.77 0.98 0.00 0.00 173.24 176.31 2nxt h SER 219 N 0.05 0.51 -0.15 7.02 4.64 -1.91 -1.75 113.55 121.96 2nxt h SER 219 Ca -0.46 -0.02 -0.12 0.00 -0.47 0.00 0.00 61.79 60.71 2nxt h SER 219 Cb 1.25 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 63.20 2nxt h SER 219 CO 0.60 0.40 -0.33 -0.33 -0.87 0.00 0.00 176.83 176.30 2nxt h GLU 220 N 0.59 0.65 -0.07 4.77 3.07 -1.95 -1.15 114.58 120.49 2nxt h GLU 220 Ca 0.16 -0.30 -0.00 0.00 -0.50 0.00 0.00 59.36 58.72 2nxt h GLU 220 Cb -0.02 -0.01 -0.00 0.00 -0.84 0.00 0.00 28.75 27.87 2nxt h GLU 220 CO -0.03 0.89 0.03 1.96 -1.40 0.00 0.00 179.01 180.46 2nxt h GLN 221 N 0.55 0.09 -0.03 2.33 4.20 -1.72 -2.51 115.11 118.02 2nxt h GLN 221 Ca 0.06 -0.01 -0.10 0.00 0.06 0.00 0.00 58.65 58.66 2nxt h GLN 221 Cb 0.82 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.57 2nxt h GLN 221 CO 0.07 0.16 -0.45 -0.39 -0.67 0.00 0.00 178.83 177.56 2nxt h VAL 222 N 0.00 1.32 -0.29 -0.54 -1.51 -1.22 -2.51 116.25 111.50 2nxt h VAL 222 Ca 0.02 -1.55 -0.03 0.00 -1.23 0.00 0.00 66.70 63.91 2nxt h VAL 222 Cb 0.10 1.81 -0.02 0.00 -2.13 0.00 0.00 31.29 31.05 2nxt h VAL 222 CO -0.00 0.45 0.05 -0.07 -1.23 0.00 0.00 177.57 176.76 2nxt h LEU 223 N 0.05 0.39 -0.89 4.19 -0.00 -1.07 -1.80 115.31 116.18 2nxt h LEU 223 Ca 0.00 -0.05 -0.11 0.00 -0.00 0.00 0.00 57.88 57.72 2nxt h LEU 223 Cb 0.81 -0.10 -0.01 0.00 -0.00 0.00 0.00 40.66 41.36 2nxt h LEU 223 CO 0.06 0.42 -0.40 0.11 -0.00 0.00 0.00 178.44 178.63 2nxt h LYS 224 N 0.42 0.31 -0.99 1.13 1.57 -1.00 -2.40 116.57 115.61 2nxt h LYS 224 Ca 0.10 -0.15 0.06 0.00 -1.87 0.00 0.00 60.65 58.79 2nxt h LYS 224 Cb 0.21 -0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.45 2nxt h LYS 224 CO 0.00 0.66 0.64 0.74 -0.57 0.00 0.00 179.45 180.93 2nxt h PHE 225 N 0.26 1.19 0.00 -1.35 -1.00 -1.18 -2.52 116.94 112.32 2nxt h PHE 225 Ca 0.02 0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.83 2nxt h PHE 225 Cb 0.83 -0.39 0.00 0.00 3.61 0.00 0.00 35.95 40.00 2nxt h PHE 225 CO 0.02 0.63 0.00 0.54 -1.61 0.00 0.00 178.31 177.89 2nxt n ARG 226 N -4.49 0.62 0.00 1.51 1.74 -0.91 -2.40 116.66 112.73 2nxt n ARG 226 Ca 0.15 0.02 0.12 0.00 -0.77 0.00 0.00 57.85 57.37 2nxt n ARG 226 Cb 0.17 -1.50 0.22 0.00 -1.02 0.00 0.00 32.46 30.33 2nxt n ARG 226 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2nxt n LYS 227 N -1.12 0.29 -0.85 5.56 5.02 -0.95 -4.52 118.16 121.59 2nxt n LYS 227 Ca 0.16 -0.19 -0.29 0.00 -2.02 0.00 0.00 58.31 55.97 2nxt n LYS 227 Cb 0.13 -1.50 0.19 0.00 -0.02 0.00 0.00 35.03 33.83 2nxt n LYS 227 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2nxt s LEU 228 N -2.84 1.85 0.03 -0.35 1.43 -1.01 -4.86 118.68 112.93 2nxt s LEU 228 Ca 0.15 1.65 0.08 0.00 -1.03 0.00 0.00 54.13 54.97 2nxt s LEU 228 Cb 0.18 -3.86 -0.02 0.00 0.03 0.00 0.00 46.19 42.51 2nxt s LEU 228 CO 0.67 -3.34 -0.24 0.20 0.23 0.00 0.00 176.35 173.87 2nxt s ASN 229 N -2.93 2.82 0.21 2.29 0.02 0.31 -0.31 114.94 117.36 2nxt s ASN 229 Ca 0.66 -0.52 0.06 0.00 -1.02 0.00 0.00 52.86 52.05 2nxt s ASN 229 Cb -0.22 -0.27 0.15 0.00 0.02 0.00 0.00 41.25 40.94 2nxt s ASN 229 CO 0.60 0.24 1.49 -0.26 0.02 0.00 0.00 177.10 179.18 2nxt h PHE 230 N 5.04 0.15 -4.42 2.20 0.04 -1.22 -3.36 116.94 115.36 2nxt h PHE 230 Ca -0.44 -0.07 -0.48 0.00 2.80 0.00 0.00 57.97 59.78 2nxt h PHE 230 Cb 1.14 -0.02 0.08 0.00 2.20 0.00 0.00 35.95 39.36 2nxt h PHE 230 CO 0.46 0.81 0.39 0.54 -0.60 0.00 0.00 178.31 179.90 2nxt s ASN 231 N -6.86 5.13 0.65 2.17 4.22 -1.26 -4.38 114.94 114.60 2nxt s ASN 231 Ca -0.02 0.95 -0.11 0.00 -2.14 0.00 0.00 52.86 51.54 2nxt s ASN 231 Cb 0.11 -1.66 -0.02 0.00 1.28 0.00 0.00 41.25 40.96 2nxt s ASN 231 CO 0.80 -1.51 1.05 -0.83 -2.04 0.00 0.00 177.10 174.56 2nxt s GLY 232 N -4.43 1.66 0.31 0.45 0.00 -1.26 -0.82 107.32 103.22 2nxt s GLY 232 Ca 0.59 -0.10 -0.30 0.00 0.00 0.00 0.00 44.72 44.92 2nxt s GLY 232 CO 0.50 0.20 1.56 -2.21 0.00 0.00 0.00 173.10 173.15 2nxt n GLU 233 N -2.88 2.68 -1.00 2.90 2.13 -1.26 -2.02 120.64 121.19 2nxt n GLU 233 Ca 0.06 0.95 0.00 0.00 0.66 0.00 0.00 57.16 58.83 2nxt n GLU 233 Cb 0.54 -2.71 0.00 0.00 0.27 0.00 0.00 31.44 29.54 2nxt n GLU 233 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2nxt n GLY 234 N 1.72 0.42 3.84 8.31 0.00 -1.26 -5.03 105.19 113.18 2nxt n GLY 234 Ca 0.07 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.87 2nxt n GLY 234 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2nxt s GLU 235 N -0.34 2.86 0.32 1.61 2.02 -0.86 -5.08 118.70 119.24 2nxt s GLU 235 Ca 0.00 -1.14 -0.29 0.00 0.02 0.00 0.00 54.97 53.56 2nxt s GLU 235 Cb 0.00 -2.54 -0.12 0.00 0.10 0.00 0.00 34.13 31.57 2nxt s GLU 235 CO 0.00 0.28 1.54 -2.30 0.02 0.00 0.00 175.26 174.81 2nxt n PRO 236 N -1.26 2.64 -2.42 0.39 -0.02 -1.26 -4.88 135.00 128.19 2nxt n PRO 236 Ca -0.06 0.93 -0.42 0.00 -2.02 0.00 0.00 63.50 61.94 2nxt n PRO 236 Cb 0.59 -2.69 -0.03 0.00 -0.02 0.00 0.00 33.50 31.35 2nxt n PRO 236 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 2nxt s GLU 237 N -1.02 4.42 -0.19 -0.52 2.12 -1.26 -4.73 118.70 117.52 2nxt s GLU 237 Ca 0.61 1.77 -0.02 0.00 0.36 0.00 0.00 54.97 57.69 2nxt s GLU 237 Cb -0.50 -3.37 0.06 0.00 0.26 0.00 0.00 34.13 30.58 2nxt s GLU 237 CO 0.54 -0.28 -0.00 -1.21 -0.54 0.00 0.00 175.26 173.76 2nxt s GLU 238 N 1.19 1.00 0.33 4.30 2.02 -1.26 -5.05 118.70 121.23 2nxt s GLU 238 Ca 0.59 -0.55 -0.29 0.00 0.02 0.00 0.00 54.97 54.74 2nxt s GLU 238 Cb -0.29 -2.16 -0.10 0.00 0.10 0.00 0.00 34.13 31.67 2nxt s GLU 238 CO 0.29 -0.59 1.40 -0.51 0.02 0.00 0.00 175.26 175.86 2nxt s LEU 239 N 1.72 4.38 -0.84 1.80 1.43 -1.26 -0.81 118.68 125.10 2nxt s LEU 239 Ca -0.02 2.81 -0.25 0.00 -1.03 0.00 0.00 54.13 55.64 2nxt s LEU 239 Cb -0.17 -3.65 0.05 0.00 0.03 0.00 0.00 46.19 42.45 2nxt s LEU 239 CO -0.07 -0.68 1.30 -0.32 0.23 0.00 0.00 176.35 176.81 2nxt s MET 240 N -1.59 3.35 0.05 1.70 -2.45 0.57 -4.59 119.30 116.34 2nxt s MET 240 Ca 0.52 -0.69 -0.06 0.00 -1.25 0.00 0.00 55.69 54.22 2nxt s MET 240 Cb -0.42 -4.64 -0.01 0.00 1.25 0.00 0.00 34.83 31.00 2nxt s MET 240 CO 0.54 -2.12 0.12 0.14 1.05 0.00 0.00 175.02 174.75 2nxt s VAL 241 N 5.16 0.14 -1.29 10.11 -7.23 -1.26 -4.47 120.40 121.55 2nxt s VAL 241 Ca 0.38 -1.14 -0.04 0.00 -1.81 0.00 0.00 61.98 59.36 2nxt s VAL 241 Cb -0.06 -1.04 0.01 0.00 0.56 0.00 0.00 36.38 35.85 2nxt s VAL 241 CO 0.04 -0.63 1.06 0.47 -0.31 0.00 0.00 175.10 175.74 2nxt n ASP 242 N 0.54 -3.97 -2.52 4.85 8.00 0.04 -4.84 116.55 118.64 2nxt n ASP 242 Ca -0.18 -0.60 -0.32 0.00 0.71 0.00 0.00 54.79 54.40 2nxt n ASP 242 Cb 0.59 -4.98 0.02 0.00 -0.02 0.00 0.00 41.12 36.74 2nxt n ASP 242 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 2nxt n ASN 243 N -3.07 7.13 -4.36 -2.24 6.94 -1.10 -4.92 115.26 113.65 2nxt n ASN 243 Ca -0.15 -3.54 -0.32 0.00 -0.02 0.00 0.00 54.58 50.55 2nxt n ASN 243 Cb 0.62 -1.09 -0.15 0.00 -2.36 0.00 0.00 39.78 36.79 2nxt n ASN 243 CO 0.00 0.00 0.00 -1.66 -1.03 0.00 0.00 177.26 174.57 2nxt s TRP 244 N -3.05 2.46 0.08 -2.53 1.48 -1.26 -4.62 118.94 111.49 2nxt s TRP 244 Ca 0.54 -0.38 -0.26 0.00 -1.06 0.00 0.00 56.10 54.94 2nxt s TRP 244 Cb 0.41 -1.55 -0.06 0.00 -1.16 0.00 0.00 33.47 31.11 2nxt s TRP 244 CO -0.21 0.01 0.81 0.50 -4.06 0.00 0.00 176.95 174.00 2nxt s ARG 245 N -0.60 4.55 0.90 3.25 3.52 -1.26 -4.97 118.95 124.35 2nxt s ARG 245 Ca 0.09 1.17 -0.12 0.00 -0.13 0.00 0.00 55.73 56.74 2nxt s ARG 245 Cb -0.11 -3.35 0.13 0.00 -1.56 0.00 0.00 34.95 30.06 2nxt s ARG 245 CO -0.00 0.30 1.12 -1.25 -0.81 0.00 0.00 175.30 174.66 2nxt s PRO 246 N -0.18 1.24 0.37 5.12 0.04 -1.26 -4.60 135.00 135.74 2nxt s PRO 246 Ca 0.40 0.43 -0.28 0.00 0.04 0.00 0.00 61.00 61.59 2nxt s PRO 246 Cb -0.21 -1.84 -0.11 0.00 0.04 0.00 0.00 34.50 32.38 2nxt s PRO 246 CO 0.25 -2.16 1.50 0.00 0.04 0.00 0.00 177.00 176.63 2nxt n ALA 247 N -3.76 2.42 -2.81 8.56 0.00 -1.26 -4.34 120.51 119.32 2nxt n ALA 247 Ca 0.06 0.34 -0.22 0.00 0.00 0.00 0.00 53.44 53.62 2nxt n ALA 247 Cb 0.58 -2.43 -0.05 0.00 0.00 0.00 0.00 19.45 17.56 2nxt n ALA 247 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2nxt s GLN 248 N -2.04 2.89 0.34 0.00 -1.52 0.31 -4.94 119.66 114.71 2nxt s GLN 248 Ca 0.54 -1.07 -0.29 0.00 -1.95 0.00 0.00 55.36 52.59 2nxt s GLN 248 Cb -0.47 -2.54 -0.11 0.00 -0.22 0.00 0.00 33.01 29.66 2nxt s GLN 248 CO 0.63 0.40 1.44 -2.14 -0.25 0.00 0.00 175.29 175.38 2nxt s PRO 249 N -3.79 4.20 0.29 2.91 0.02 -1.26 -4.56 135.00 132.80 2nxt s PRO 249 Ca 0.33 2.45 0.09 0.00 0.02 0.00 0.00 61.00 63.88 2nxt s PRO 249 Cb -0.08 -3.02 0.44 0.00 0.02 0.00 0.00 34.50 31.86 2nxt s PRO 249 CO 0.25 -0.43 1.67 1.25 -0.33 0.00 0.00 177.00 179.40 2nxt h LEU 250 N 3.48 0.11 0.00 -5.54 5.85 -1.94 -3.43 115.31 113.83 2nxt h LEU 250 Ca -0.49 -0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.17 2nxt h LEU 250 Cb 1.23 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.23 2nxt h LEU 250 CO 0.67 0.61 0.00 0.29 -0.34 0.00 0.00 178.44 179.67 2nxt n LYS 251 N -3.93 0.00 -2.32 1.25 5.02 -1.26 -3.26 118.16 113.65 2nxt n LYS 251 Ca -0.02 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 55.86 2nxt n LYS 251 Cb 0.54 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.55 2nxt n LYS 251 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2nxt n ASN 252 N 1.23 6.75 -4.02 4.39 4.05 -1.26 -4.89 115.26 121.51 2nxt n ASN 252 Ca 0.00 -3.24 -0.12 0.00 0.45 0.00 0.00 54.58 51.67 2nxt n ASN 252 Cb 0.00 -1.36 -0.12 0.00 1.23 0.00 0.00 39.78 39.53 2nxt n ASN 252 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 177.26 174.08 2nxt s ARG 253 N -1.27 0.43 -0.12 1.20 0.52 -1.20 -5.11 118.95 113.39 2nxt s ARG 253 Ca 0.44 -0.59 0.00 0.00 -0.52 0.00 0.00 55.73 55.06 2nxt s ARG 253 Cb 0.14 -0.19 -0.01 0.00 0.52 0.00 0.00 34.95 35.40 2nxt s ARG 253 CO -0.04 0.03 -0.15 -0.65 0.02 0.00 0.00 175.30 174.52 2nxt s GLN 254 N -1.25 3.33 -0.02 3.54 -0.21 -1.26 -5.03 119.66 118.76 2nxt s GLN 254 Ca -0.09 -0.71 -0.22 0.00 0.02 0.00 0.00 55.36 54.35 2nxt s GLN 254 Cb -0.08 -2.58 -0.05 0.00 1.00 0.00 0.00 33.01 31.30 2nxt s GLN 254 CO -0.00 0.21 0.67 0.42 -2.12 0.00 0.00 175.29 174.47 2nxt s ILE 255 N 0.34 4.94 0.08 1.08 1.01 -1.26 -4.75 121.20 122.63 2nxt s ILE 255 Ca -0.12 1.39 0.04 0.00 0.00 0.00 0.00 60.65 61.96 2nxt s ILE 255 Cb -0.16 -4.01 -0.04 0.00 0.01 0.00 0.00 42.46 38.26 2nxt s ILE 255 CO 0.06 0.34 0.02 -0.54 0.00 0.00 0.00 174.94 174.82 2nxt s LYS 256 N 0.26 2.64 -0.01 2.79 1.02 -0.54 -1.72 119.74 124.18 2nxt s LYS 256 Ca 0.35 -0.79 0.04 0.00 0.02 0.00 0.00 55.97 55.60 2nxt s LYS 256 Cb -0.18 -2.59 -0.03 0.00 -0.52 0.00 0.00 37.83 34.50 2nxt s LYS 256 CO 0.18 0.55 -0.13 0.00 -0.92 0.00 0.00 175.35 175.03 2nxt s ALA 257 N -1.31 2.74 -1.68 5.17 0.00 0.20 -0.51 121.76 126.36 2nxt s ALA 257 Ca 0.26 -1.05 0.29 0.00 0.00 0.00 0.00 51.96 51.46 2nxt s ALA 257 Cb -0.12 -0.95 1.19 0.00 0.00 0.00 0.00 23.12 23.25 2nxt s ALA 257 CO 0.18 0.57 1.84 -1.13 0.00 0.00 0.00 175.76 177.23 2nxt n SER 258 N 1.92 0.53 -4.13 0.00 3.41 -0.06 -1.15 113.62 114.14 2nxt n SER 258 Ca -0.16 -0.62 -0.09 0.00 -0.26 0.00 0.00 58.87 57.73 2nxt n SER 258 Cb 0.52 -0.05 -0.10 0.00 -0.26 0.00 0.00 64.21 64.32 2nxt n SER 258 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 2nxt s PHE 259 N -2.46 0.77 -0.11 7.33 -0.71 -1.26 -4.88 117.98 116.66 2nxt s PHE 259 Ca 0.29 -1.18 0.01 0.00 -1.04 0.00 0.00 56.93 55.01 2nxt s PHE 259 Cb 0.20 -0.45 0.01 0.00 -1.21 0.00 0.00 43.02 41.57 2nxt s PHE 259 CO 0.47 -0.49 0.53 0.36 -1.34 0.00 0.00 175.22 174.75