#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yrn n SER 2 N 0.00 1.26 -3.56 1.61 3.41 -1.26 -5.13 113.62 109.94 2yrn n SER 2 Ca 0.00 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.51 2yrn n SER 2 Cb 0.00 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 63.93 2yrn n SER 2 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2yrn s SER 3 N -4.16 -0.45 0.00 4.04 0.15 -1.26 -5.12 113.70 106.91 2yrn s SER 3 Ca 0.00 -0.18 0.00 0.00 0.70 0.00 0.00 55.95 56.47 2yrn s SER 3 Cb 0.00 0.61 0.00 0.00 -1.71 0.00 0.00 66.02 64.92 2yrn s SER 3 CO 0.00 -1.03 0.00 0.61 1.20 0.00 0.00 173.24 174.02 2yrn n GLY 4 N -0.39 0.44 3.55 9.45 0.00 -1.26 -4.95 105.19 112.04 2yrn n GLY 4 Ca -0.12 -1.23 -0.42 0.00 0.00 0.00 0.00 46.02 44.24 2yrn n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yrn s SER 5 N -4.00 6.36 -0.18 1.61 0.01 -1.26 -4.89 113.70 111.34 2yrn s SER 5 Ca 0.00 -0.07 -0.06 0.00 1.31 0.00 0.00 55.95 57.12 2yrn s SER 5 Cb 0.00 -2.30 -0.09 0.00 0.21 0.00 0.00 66.02 63.84 2yrn s SER 5 CO 0.00 -0.61 -0.22 -1.54 0.41 0.00 0.00 173.24 171.28 2yrn n SER 6 N 6.00 1.66 -0.36 2.44 3.41 -1.26 -5.06 113.62 120.45 2yrn n SER 6 Ca -0.03 0.14 0.00 0.00 -0.26 0.00 0.00 58.87 58.73 2yrn n SER 6 Cb 0.48 -0.47 0.00 0.00 -0.26 0.00 0.00 64.21 63.96 2yrn n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2yrn n GLY 7 N 2.06 0.55 3.59 5.00 0.00 -1.26 -5.10 105.19 110.03 2yrn n GLY 7 Ca -0.35 -0.61 -0.34 0.00 0.00 0.00 0.00 46.02 44.72 2yrn n GLY 7 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2yrn s LYS 8 N -2.24 3.24 -0.59 1.61 2.20 -1.26 -5.07 119.74 117.62 2yrn s LYS 8 Ca 0.00 -0.47 -0.25 0.00 -0.36 0.00 0.00 55.97 54.89 2yrn s LYS 8 Cb 0.00 -2.82 0.04 0.00 -1.51 0.00 0.00 37.83 33.54 2yrn s LYS 8 CO 0.00 0.51 1.03 -0.98 -0.36 0.00 0.00 175.35 175.54 2yrn s ARG 9 N -0.36 3.32 -0.02 4.03 1.70 -1.26 -5.00 118.95 121.37 2yrn s ARG 9 Ca 0.06 -0.24 -0.02 0.00 -0.47 0.00 0.00 55.73 55.06 2yrn s ARG 9 Cb -0.12 -4.08 0.00 0.00 -0.57 0.00 0.00 34.95 30.18 2yrn s ARG 9 CO 0.02 -1.63 0.05 0.21 -1.08 0.00 0.00 175.30 172.87 2yrn s LYS 10 N 4.33 0.07 -0.37 3.89 2.20 -1.26 -5.11 119.74 123.48 2yrn s LYS 10 Ca 0.32 0.06 -0.28 0.00 -0.36 0.00 0.00 55.97 55.70 2yrn s LYS 10 Cb -0.12 0.03 -0.01 0.00 -1.51 0.00 0.00 37.83 36.22 2yrn s LYS 10 CO 0.19 -0.01 1.71 -1.25 -0.36 0.00 0.00 175.35 175.63 2yrn s PRO 11 N -0.01 3.34 -0.03 4.03 0.04 -1.26 -4.99 135.00 136.13 2yrn s PRO 11 Ca -0.00 1.25 0.04 0.00 0.04 0.00 0.00 61.00 62.33 2yrn s PRO 11 Cb -0.01 -4.17 -0.01 0.00 0.04 0.00 0.00 34.50 30.36 2yrn s PRO 11 CO 0.00 -1.85 -0.15 0.54 0.04 0.00 0.00 177.00 175.58 2yrn s VAL 12 N 6.70 1.24 -0.03 -0.36 0.11 -1.26 -5.03 120.40 121.77 2yrn s VAL 12 Ca 0.74 -0.64 0.12 0.00 -2.93 0.00 0.00 61.98 59.27 2yrn s VAL 12 Cb -0.20 -1.05 -0.23 0.00 -1.53 0.00 0.00 36.38 33.37 2yrn s VAL 12 CO 0.32 0.36 0.73 0.40 -3.33 0.00 0.00 175.10 173.58 2yrn h ILE 13 N 5.03 0.94 -5.66 7.04 5.03 -2.04 -3.49 117.51 124.37 2yrn h ILE 13 Ca -0.34 -2.78 -0.33 0.00 -0.12 0.00 0.00 64.86 61.28 2yrn h ILE 13 Cb 1.16 2.47 0.17 0.00 -3.03 0.00 0.00 36.82 37.59 2yrn h ILE 13 CO 0.48 0.54 -0.77 1.41 -0.68 0.00 0.00 178.15 179.14 2yrn n HIS 14 N -3.08 -2.23 -0.95 1.37 8.25 -1.26 -4.90 115.22 112.43 2yrn n HIS 14 Ca -0.15 0.94 -0.33 0.00 -0.26 0.00 0.00 57.72 57.92 2yrn n HIS 14 Cb 1.04 -5.09 0.03 0.00 1.12 0.00 0.00 29.99 27.09 2yrn n HIS 14 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2yrn n GLY 15 N -1.17 -3.98 0.31 -1.41 0.00 -1.26 -3.22 105.19 94.44 2yrn n GLY 15 Ca -0.27 -0.62 -0.04 0.00 0.00 0.00 0.00 46.02 45.09 2yrn n GLY 15 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2yrn n LEU 16 N 3.00 -0.63 -0.28 0.99 4.77 -1.26 0.16 117.00 123.74 2yrn n LEU 16 Ca -0.00 1.35 -0.05 0.00 -0.03 0.00 0.00 56.01 57.27 2yrn n LEU 16 Cb 0.49 -0.25 0.06 0.00 -2.33 0.00 0.00 43.42 41.39 2yrn n LEU 16 CO 0.48 -1.16 1.09 -0.33 -1.33 0.00 0.00 177.39 176.14 2yrn h GLU 17 N 0.00 1.09 -0.12 3.23 3.07 -2.02 -2.14 114.58 117.69 2yrn h GLU 17 Ca 0.20 -0.15 -0.02 0.00 -0.50 0.00 0.00 59.36 58.89 2yrn h GLU 17 Cb 0.40 -0.20 -0.01 0.00 -0.84 0.00 0.00 28.75 28.10 2yrn h GLU 17 CO -0.74 0.84 -0.01 -0.44 -1.40 0.00 0.00 179.01 177.25 2yrn h ASP 18 N 1.07 0.15 -0.57 1.42 5.19 0.13 -2.38 116.42 121.42 2yrn h ASP 18 Ca 0.26 -0.01 -0.05 0.00 -0.62 0.00 0.00 57.03 56.61 2yrn h ASP 18 Cb 0.09 -0.04 -0.02 0.00 0.18 0.00 0.00 39.33 39.54 2yrn h ASP 18 CO -0.04 0.20 0.16 1.56 -3.12 0.00 0.00 179.24 178.00 2yrn h GLN 19 N 0.17 0.90 -0.93 3.56 4.20 0.56 -2.84 115.11 120.72 2yrn h GLN 19 Ca 0.04 -0.21 0.26 0.00 0.06 0.00 0.00 58.65 58.80 2yrn h GLN 19 Cb 0.14 -0.12 -0.14 0.00 0.30 0.00 0.00 27.48 27.66 2yrn h GLN 19 CO 0.00 0.83 0.42 -0.22 -0.67 0.00 0.00 178.83 179.19 2yrn h LYS 20 N 0.81 0.33 0.34 1.46 3.64 -1.31 -0.70 116.57 121.14 2yrn h LYS 20 Ca 0.18 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.53 2yrn h LYS 20 Cb 0.31 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.06 2yrn h LYS 20 CO -0.00 0.22 -0.16 -0.09 -2.27 0.00 0.00 179.45 177.14 2yrn h ARG 21 N 0.34 -0.44 -0.94 1.90 2.43 -1.59 -0.50 114.38 115.58 2yrn h ARG 21 Ca 0.62 0.03 0.16 0.00 -0.81 0.00 0.00 59.98 59.98 2yrn h ARG 21 Cb 1.27 0.10 -0.16 0.00 -0.42 0.00 0.00 29.97 30.75 2yrn h ARG 21 CO -0.58 -0.16 -0.32 0.82 -1.51 0.00 0.00 179.97 178.22 2yrn h ILE 22 N -0.69 0.04 -0.05 1.20 2.04 -1.09 0.42 117.51 119.38 2yrn h ILE 22 Ca -0.05 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.80 2yrn h ILE 22 Cb 0.48 0.04 -0.00 0.00 -0.74 0.00 0.00 36.82 36.60 2yrn h ILE 22 CO 0.08 0.00 -0.03 1.88 0.00 0.00 0.00 178.15 180.08 2yrn h TYR 23 N -0.02 0.12 -0.93 1.37 0.05 -1.43 -2.09 116.97 114.03 2yrn h TYR 23 Ca 0.38 -0.03 0.20 0.00 0.05 0.00 0.00 58.73 59.33 2yrn h TYR 23 Cb 0.63 -0.03 -0.18 0.00 1.01 0.00 0.00 36.73 38.17 2yrn h TYR 23 CO -0.80 0.50 -0.17 1.15 -1.05 0.00 0.00 178.16 177.80 2yrn h THR 24 N -0.30 0.07 -0.12 -2.88 2.02 0.75 0.55 112.91 113.00 2yrn h THR 24 Ca 0.01 -0.00 -0.20 0.00 0.77 0.00 0.00 66.41 66.99 2yrn h THR 24 Cb 0.47 0.07 0.00 0.00 -1.74 0.00 0.00 68.15 66.95 2yrn h THR 24 CO 0.01 0.00 -0.74 -0.78 0.37 0.00 0.00 175.52 174.38 2yrn h ASP 25 N 0.01 0.72 -0.83 4.18 3.58 -1.22 -2.75 116.42 120.11 2yrn h ASP 25 Ca 0.48 -0.46 0.06 0.00 0.42 0.00 0.00 57.03 57.53 2yrn h ASP 25 Cb 0.79 -0.21 -0.06 0.00 1.72 0.00 0.00 39.33 41.57 2yrn h ASP 25 CO -0.94 1.23 0.51 -0.25 -2.88 0.00 0.00 179.24 176.92 2yrn h TRP 26 N 0.42 0.94 -0.29 0.28 7.01 0.67 -2.21 115.95 122.76 2yrn h TRP 26 Ca -0.04 0.03 -0.17 0.00 2.11 0.00 0.00 58.89 60.82 2yrn h TRP 26 Cb 1.34 -0.30 -0.00 0.00 -2.10 0.00 0.00 29.16 28.10 2yrn h TRP 26 CO 0.06 0.47 -0.50 0.00 -2.79 0.00 0.00 178.44 175.69 2yrn h ALA 27 N 1.40 0.45 -0.65 2.65 0.00 -0.72 -3.22 119.26 119.17 2yrn h ALA 27 Ca 0.37 -0.49 0.14 0.00 0.00 0.00 0.00 54.91 54.92 2yrn h ALA 27 Cb 0.19 -0.08 -0.10 0.00 0.00 0.00 0.00 17.79 17.79 2yrn h ALA 27 CO -0.18 0.63 0.08 -0.91 0.00 0.00 0.00 179.25 178.88 2yrn h ASN 28 N 0.63 -0.12 -1.08 0.00 -0.26 -1.10 0.11 115.58 113.76 2yrn h ASN 28 Ca 0.02 0.14 0.31 0.00 -0.56 0.00 0.00 56.30 56.22 2yrn h ASN 28 Cb 1.10 0.22 -0.12 0.00 -1.06 0.00 0.00 38.32 38.46 2yrn h ASN 28 CO 0.11 -0.06 0.66 -0.74 -1.06 0.00 0.00 177.43 176.34 2yrn h HIS 29 N 0.20 0.77 0.00 1.19 -0.00 -1.48 1.36 115.15 117.18 2yrn h HIS 29 Ca 0.35 0.03 -0.06 0.00 -0.00 0.00 0.00 60.37 60.70 2yrn h HIS 29 Cb 0.57 -0.21 -0.01 0.00 -0.00 0.00 0.00 27.41 27.76 2yrn h HIS 29 CO -0.31 -0.07 -0.26 1.88 -0.00 0.00 0.00 177.93 179.17 2yrn h TYR 30 N 0.34 0.00 0.02 5.26 0.05 -0.94 -2.79 116.97 118.92 2yrn h TYR 30 Ca 0.69 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 59.47 2yrn h TYR 30 Cb 1.73 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.47 2yrn h TYR 30 CO -0.01 0.26 -0.01 -0.07 -1.05 0.00 0.00 178.16 177.29 2yrn h LEU 31 N 0.00 -0.03 -0.22 3.88 3.38 0.22 -3.21 115.31 119.33 2yrn h LEU 31 Ca -0.00 -0.27 0.03 0.00 0.09 0.00 0.00 57.88 57.73 2yrn h LEU 31 Cb 1.18 0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.91 2yrn h LEU 31 CO 0.03 0.60 0.06 0.00 0.09 0.00 0.00 178.44 179.23 2yrn h ALA 32 N -0.72 0.24 -0.99 1.53 0.00 -0.80 -1.35 119.26 117.17 2yrn h ALA 32 Ca -0.00 0.03 0.23 0.00 0.00 0.00 0.00 54.91 55.17 2yrn h ALA 32 Cb 0.29 0.03 -0.09 0.00 0.00 0.00 0.00 17.79 18.02 2yrn h ALA 32 CO 0.00 -0.36 0.63 1.57 0.00 0.00 0.00 179.25 181.10 2yrn h LYS 33 N 0.16 0.49 -1.13 0.00 2.10 -1.66 0.38 116.57 116.92 2yrn h LYS 33 Ca 0.10 -0.03 -0.33 0.00 -2.00 0.00 0.00 60.65 58.39 2yrn h LYS 33 Cb 0.08 -0.11 -0.18 0.00 -0.90 0.00 0.00 32.23 31.12 2yrn h LYS 33 CO -0.12 0.33 0.43 0.43 -2.00 0.00 0.00 179.45 178.52 2yrn n SER 34 N -4.64 4.45 -3.82 7.07 7.64 -0.75 -4.88 113.62 118.69 2yrn n SER 34 Ca 0.23 -3.03 -0.37 0.00 1.01 0.00 0.00 58.87 56.71 2yrn n SER 34 Cb 0.74 -0.80 0.04 0.00 -1.01 0.00 0.00 64.21 63.17 2yrn n SER 34 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2yrn n GLY 35 N -0.30 -0.94 2.91 0.23 0.00 0.13 -4.94 105.19 102.28 2yrn n GLY 35 Ca 0.36 0.41 -0.29 0.00 0.00 0.00 0.00 46.02 46.50 2yrn n GLY 35 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2yrn s HIS 36 N -3.49 3.15 0.00 1.61 5.04 -0.58 -5.00 115.29 116.02 2yrn s HIS 36 Ca 0.49 -3.14 0.00 0.00 -1.54 0.00 0.00 55.06 50.86 2yrn s HIS 36 Cb -0.21 -2.68 0.00 0.00 0.04 0.00 0.00 32.58 29.74 2yrn s HIS 36 CO 0.90 -0.69 0.69 1.63 -2.34 0.00 0.00 174.74 174.93 2yrn n LYS 37 N 2.83 0.00 -1.14 2.88 4.76 -1.26 -4.24 118.16 121.98 2yrn n LYS 37 Ca 0.10 0.69 -0.36 0.00 -2.87 0.00 0.00 58.31 55.87 2yrn n LYS 37 Cb 0.33 -1.15 0.01 0.00 -1.84 0.00 0.00 35.03 32.38 2yrn n LYS 37 CO 0.00 0.00 0.00 -2.13 -1.37 0.00 0.00 177.40 173.90 2yrn n ARG 38 N -1.98 0.00 -4.23 1.97 0.63 -1.26 -4.94 116.66 106.85 2yrn n ARG 38 Ca 0.00 0.00 -0.23 0.00 -0.92 0.00 0.00 57.85 56.70 2yrn n ARG 38 Cb 0.00 -0.92 -0.07 0.00 0.45 0.00 0.00 32.46 31.92 2yrn n ARG 38 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 2yrn n LEU 39 N 2.31 0.00 -4.56 6.15 4.77 -1.26 -4.84 117.00 119.57 2yrn n LEU 39 Ca 0.07 -2.93 -0.40 0.00 -0.03 0.00 0.00 56.01 52.73 2yrn n LEU 39 Cb 0.43 1.03 -0.10 0.00 -2.33 0.00 0.00 43.42 42.45 2yrn n LEU 39 CO 0.50 -0.46 -0.09 -0.63 -1.33 0.00 0.00 177.39 175.38 2yrn s ILE 40 N -3.02 5.26 -0.09 -0.08 1.01 -1.26 -4.98 121.20 118.05 2yrn s ILE 40 Ca 0.21 0.02 -0.05 0.00 0.00 0.00 0.00 60.65 60.82 2yrn s ILE 40 Cb 0.01 -3.68 -0.02 0.00 0.01 0.00 0.00 42.46 38.79 2yrn s ILE 40 CO 0.15 0.07 -0.10 0.03 0.00 0.00 0.00 174.94 175.09 2yrn h ARG 41 N 8.42 0.00 -4.36 2.79 3.08 -2.00 -3.45 114.38 118.86 2yrn h ARG 41 Ca -0.32 0.00 -0.68 0.00 0.07 0.00 0.00 59.98 59.04 2yrn h ARG 41 Cb 1.17 0.00 -0.36 0.00 0.08 0.00 0.00 29.97 30.85 2yrn h ARG 41 CO 0.62 0.00 -0.57 -0.51 -1.07 0.00 0.00 179.97 178.44 2yrn s ASP 42 N -5.01 5.10 0.61 7.04 1.01 -1.26 -4.94 116.67 119.21 2yrn s ASP 42 Ca -0.09 -2.22 0.26 0.00 0.71 0.00 0.00 52.55 51.22 2yrn s ASP 42 Cb 0.01 -1.78 0.93 0.00 1.01 0.00 0.00 42.92 43.09 2yrn s ASP 42 CO 0.13 -0.47 1.34 0.25 0.21 0.00 0.00 175.17 176.62 2yrn h LEU 43 N 7.74 0.00 0.07 1.23 5.85 -1.87 1.84 115.31 130.17 2yrn h LEU 43 Ca -0.09 0.00 -0.27 0.00 0.84 0.00 0.00 57.88 58.36 2yrn h LEU 43 Cb 1.02 0.00 0.03 0.00 0.37 0.00 0.00 40.66 42.08 2yrn h LEU 43 CO 0.66 0.00 -1.11 1.56 -0.34 0.00 0.00 178.44 179.21 2yrn h GLN 44 N 0.00 0.62 0.05 1.25 4.20 -1.92 -3.27 115.11 116.04 2yrn h GLN 44 Ca 0.45 -0.77 -0.15 0.00 0.06 0.00 0.00 58.65 58.25 2yrn h GLN 44 Cb 2.77 0.24 -0.00 0.00 0.30 0.00 0.00 27.48 30.79 2yrn h GLN 44 CO -0.00 1.34 -0.75 1.96 -0.67 0.00 0.00 178.83 180.70 2yrn h GLN 45 N 0.25 0.11 0.00 1.46 1.08 0.23 -3.31 115.11 114.93 2yrn h GLN 45 Ca -0.16 -0.19 0.00 0.00 -1.45 0.00 0.00 58.65 56.85 2yrn h GLN 45 Cb 1.78 0.07 0.00 0.00 -0.05 0.00 0.00 27.48 29.28 2yrn h GLN 45 CO 0.21 1.09 0.54 0.38 -0.95 0.00 0.00 178.83 180.10 2yrn h ASP 46 N -0.73 0.00 -0.79 1.46 2.03 -0.52 0.56 116.42 118.44 2yrn h ASP 46 Ca -0.17 0.00 -0.57 0.00 -0.73 0.00 0.00 57.03 55.56 2yrn h ASP 46 Cb 1.36 0.00 -0.39 0.00 -0.83 0.00 0.00 39.33 39.47 2yrn h ASP 46 CO -0.01 0.00 -0.42 1.33 -1.03 0.00 0.00 179.24 179.12 2yrn n VAL 47 N -2.60 2.78 -0.08 4.15 0.24 -1.23 -3.43 118.33 118.15 2yrn n VAL 47 Ca -0.01 -3.89 -0.10 0.00 -2.04 0.00 0.00 64.34 58.30 2yrn n VAL 47 Cb 0.57 -1.12 -0.15 0.00 -1.47 0.00 0.00 33.84 31.67 2yrn n VAL 47 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 2yrn n THR 48 N -0.77 1.45 0.30 3.34 -2.24 0.20 -4.16 114.28 112.39 2yrn n THR 48 Ca 0.48 -0.84 0.08 0.00 -2.27 0.00 0.00 64.05 61.50 2yrn n THR 48 Cb 0.90 -0.63 -0.12 0.00 -2.10 0.00 0.00 70.33 68.38 2yrn n THR 48 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2yrn n ASP 49 N -2.84 0.93 0.00 3.42 9.92 -1.26 -4.63 116.55 122.10 2yrn n ASP 49 Ca -0.29 -0.34 0.00 0.00 -0.53 0.00 0.00 54.79 53.63 2yrn n ASP 49 Cb 1.13 1.50 0.00 0.00 -0.64 0.00 0.00 41.12 43.10 2yrn n ASP 49 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2yrn n GLY 50 N 1.47 2.93 0.39 0.44 0.00 -1.26 -4.40 105.19 104.77 2yrn n GLY 50 Ca -0.01 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.85 2yrn n GLY 50 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2yrn h VAL 51 N 0.00 0.09 -0.34 1.61 2.07 -1.92 -2.21 116.25 115.55 2yrn h VAL 51 Ca 0.00 -0.26 -0.03 0.00 0.82 0.00 0.00 66.70 67.23 2yrn h VAL 51 Cb 0.00 0.12 -0.02 0.00 -1.52 0.00 0.00 31.29 29.88 2yrn h VAL 51 CO 0.00 0.01 0.08 0.25 0.02 0.00 0.00 177.57 177.93 2yrn h LEU 52 N -1.20 0.45 -0.32 2.57 6.46 -1.90 -2.45 115.31 118.93 2yrn h LEU 52 Ca -0.10 -0.06 0.02 0.00 -0.12 0.00 0.00 57.88 57.62 2yrn h LEU 52 Cb 0.76 -0.12 -0.02 0.00 -0.73 0.00 0.00 40.66 40.55 2yrn h LEU 52 CO 0.16 0.46 0.17 0.25 -0.62 0.00 0.00 178.44 178.87 2yrn h LEU 53 N 0.49 0.27 -0.50 2.25 5.85 -1.57 -2.73 115.31 119.37 2yrn h LEU 53 Ca 0.12 0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.80 2yrn h LEU 53 Cb 0.20 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.16 2yrn h LEU 53 CO -0.00 0.20 0.12 0.00 -0.34 0.00 0.00 178.44 178.41 2yrn h ALA 54 N 1.16 0.66 -1.60 1.25 0.00 -1.07 -2.83 119.26 116.82 2yrn h ALA 54 Ca 0.13 -0.21 0.46 0.00 0.00 0.00 0.00 54.91 55.29 2yrn h ALA 54 Cb 0.03 -0.19 -0.06 0.00 0.00 0.00 0.00 17.79 17.56 2yrn h ALA 54 CO -0.08 0.35 1.19 1.04 0.00 0.00 0.00 179.25 181.75 2yrn n GLN 55 N -4.46 0.00 -0.11 0.00 6.02 -0.95 0.41 117.38 118.30 2yrn n GLN 55 Ca 0.01 0.90 -0.22 0.00 -0.01 0.00 0.00 57.00 57.69 2yrn n GLN 55 Cb 0.22 -2.10 -0.10 0.00 1.02 0.00 0.00 30.24 29.28 2yrn n GLN 55 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 2yrn n ILE 56 N -3.55 1.53 -0.03 5.09 -0.00 -1.08 -3.98 119.36 117.35 2yrn n ILE 56 Ca 0.36 -0.08 -0.10 0.00 -0.00 0.00 0.00 62.75 62.92 2yrn n ILE 56 Cb 1.66 -2.04 -0.04 0.00 -0.00 0.00 0.00 39.64 39.23 2yrn n ILE 56 CO 0.00 0.00 0.00 0.40 -0.00 0.00 0.00 176.55 176.95 2yrn h ILE 57 N -1.00 0.25 -0.81 1.39 2.04 0.03 0.16 117.51 119.56 2yrn h ILE 57 Ca -0.40 0.00 0.21 0.00 1.00 0.00 0.00 64.86 65.67 2yrn h ILE 57 Cb 1.31 0.25 -0.04 0.00 -0.74 0.00 0.00 36.82 37.60 2yrn h ILE 57 CO -0.24 0.00 0.56 1.56 0.00 0.00 0.00 178.15 180.03 2yrn h GLN 58 N -0.38 0.15 0.03 2.37 4.20 -1.08 0.45 115.11 120.84 2yrn h GLN 58 Ca 0.11 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.81 2yrn h GLN 58 Cb 0.56 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.31 2yrn h GLN 58 CO -0.40 0.10 -0.01 0.28 -0.67 0.00 0.00 178.83 178.12 2yrn h VAL 59 N 0.15 0.00 -0.86 -0.54 2.07 -0.95 0.20 116.25 116.32 2yrn h VAL 59 Ca 0.40 -0.13 0.23 0.00 0.82 0.00 0.00 66.70 68.02 2yrn h VAL 59 Cb 1.34 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 31.06 2yrn h VAL 59 CO -0.07 0.00 0.60 1.62 0.02 0.00 0.00 177.57 179.75 2yrn h VAL 60 N -0.17 0.61 0.00 2.57 3.04 -0.67 0.62 116.25 122.24 2yrn h VAL 60 Ca -0.00 -0.04 0.00 0.00 -1.01 0.00 0.00 66.70 65.64 2yrn h VAL 60 Cb 0.03 0.47 0.00 0.00 -2.01 0.00 0.00 31.29 29.78 2yrn h VAL 60 CO 0.01 0.02 -0.74 0.00 -1.01 0.00 0.00 177.57 175.85 2yrn h ALA 61 N 1.59 0.51 -4.07 3.17 0.00 -0.22 -3.48 119.26 116.76 2yrn h ALA 61 Ca 0.42 0.00 -0.41 0.00 0.00 0.00 0.00 54.91 54.93 2yrn h ALA 61 Cb 1.47 0.00 0.03 0.00 0.00 0.00 0.00 17.79 19.29 2yrn h ALA 61 CO -0.06 0.00 -0.58 0.09 0.00 0.00 0.00 179.25 178.69 2yrn n ASN 62 N -2.11 -5.99 -4.17 0.00 3.02 0.21 -4.98 115.26 101.25 2yrn n ASN 62 Ca 0.03 -0.21 -0.10 0.00 -0.03 0.00 0.00 54.58 54.27 2yrn n ASN 62 Cb 0.45 -4.89 -0.10 0.00 -0.61 0.00 0.00 39.78 34.63 2yrn n ASN 62 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 2yrn s GLU 63 N -5.52 0.89 -0.09 3.52 2.56 0.36 -5.00 118.70 115.43 2yrn s GLU 63 Ca 0.21 -1.39 0.00 0.00 0.00 0.00 0.00 54.97 53.80 2yrn s GLU 63 Cb -0.10 -0.01 -0.03 0.00 2.00 0.00 0.00 34.13 36.00 2yrn s GLU 63 CO 0.27 -0.13 -0.08 0.21 -0.56 0.00 0.00 175.26 174.96 2yrn s LYS 64 N -3.93 2.94 -0.31 4.30 2.20 -1.26 -4.09 119.74 119.59 2yrn s LYS 64 Ca 0.17 -0.58 -0.14 0.00 -0.36 0.00 0.00 55.97 55.06 2yrn s LYS 64 Cb 0.07 -2.61 -0.03 0.00 -1.51 0.00 0.00 37.83 33.75 2yrn s LYS 64 CO -0.02 0.53 0.34 0.42 -0.36 0.00 0.00 175.35 176.26 2yrn s ILE 65 N -0.46 5.19 -0.51 5.43 1.01 -1.26 -4.94 121.20 125.67 2yrn s ILE 65 Ca 0.06 0.21 0.24 0.00 0.00 0.00 0.00 60.65 61.16 2yrn s ILE 65 Cb -0.12 -3.74 0.26 0.00 0.01 0.00 0.00 42.46 38.87 2yrn s ILE 65 CO 0.02 0.03 1.57 -0.33 0.00 0.00 0.00 174.94 176.23 2yrn h GLU 66 N 8.37 0.00 -1.44 2.79 5.08 -2.00 -3.29 114.58 124.09 2yrn h GLU 66 Ca -0.31 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 57.83 2yrn h GLU 66 Cb 1.16 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 30.31 2yrn h GLU 66 CO 0.66 0.00 0.28 -0.25 -1.00 0.00 0.00 179.01 178.69 2yrn n ASP 67 N -2.75 5.21 -4.14 1.42 8.00 -1.26 -4.77 116.55 118.26 2yrn n ASP 67 Ca 0.04 -2.77 -0.36 0.00 0.71 0.00 0.00 54.79 52.41 2yrn n ASP 67 Cb 0.50 -0.93 -0.12 0.00 -0.02 0.00 0.00 41.12 40.55 2yrn n ASP 67 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2yrn s ILE 68 N -1.48 3.23 0.30 0.53 -1.09 -1.24 -4.47 121.20 116.99 2yrn s ILE 68 Ca 0.21 -1.82 -0.01 0.00 -2.23 0.00 0.00 60.65 56.81 2yrn s ILE 68 Cb 0.17 -3.10 0.42 0.00 -1.58 0.00 0.00 42.46 38.37 2yrn s ILE 68 CO 0.01 -0.50 1.57 -1.13 -1.23 0.00 0.00 174.94 173.66 2yrn h ASN 69 N 8.04 -0.58 0.00 3.58 -1.24 -1.93 -3.45 115.58 120.01 2yrn h ASN 69 Ca -0.16 0.28 0.00 0.00 0.71 0.00 0.00 56.30 57.14 2yrn h ASN 69 Cb 1.05 0.51 0.00 0.00 0.73 0.00 0.00 38.32 40.62 2yrn h ASN 69 CO 0.64 -0.35 0.00 0.61 -1.29 0.00 0.00 177.43 177.05 2yrn n GLY 70 N -1.52 2.70 2.64 1.57 0.00 -1.26 -4.83 105.19 104.49 2yrn n GLY 70 Ca 0.21 -0.63 -0.28 0.00 0.00 0.00 0.00 46.02 45.32 2yrn n GLY 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2yrn s PRO 72 N -0.40 4.14 -0.20 0.00 0.04 -1.26 -4.89 135.00 132.43 2yrn s PRO 72 Ca 0.26 1.96 -0.10 0.00 0.04 0.00 0.00 61.00 63.16 2yrn s PRO 72 Cb -0.06 -3.93 -0.08 0.00 0.04 0.00 0.00 34.50 30.47 2yrn s PRO 72 CO -0.14 -0.87 -0.26 1.63 0.04 0.00 0.00 177.00 177.40 2yrn n LYS 73 N 7.06 0.43 -1.33 4.56 5.02 -1.26 -4.87 118.16 127.77 2yrn n LYS 73 Ca 0.16 0.19 -0.30 0.00 -2.02 0.00 0.00 58.31 56.35 2yrn n LYS 73 Cb 0.44 -1.22 0.13 0.00 -0.02 0.00 0.00 35.03 34.35 2yrn n LYS 73 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 2yrn s ASN 74 N -6.77 3.73 0.05 4.39 -0.87 -1.26 -4.97 114.94 109.25 2yrn s ASN 74 Ca -0.28 1.37 -0.22 0.00 -1.57 0.00 0.00 52.86 52.17 2yrn s ASN 74 Cb 0.10 -2.06 -0.13 0.00 -0.02 0.00 0.00 41.25 39.14 2yrn s ASN 74 CO 0.36 -2.46 1.50 -0.09 -2.57 0.00 0.00 177.10 173.84 2yrn h ARG 75 N -1.43 0.20 -0.11 -0.60 1.12 -2.03 -3.11 114.38 108.42 2yrn h ARG 75 Ca -0.49 -0.06 -0.15 0.00 -1.11 0.00 0.00 59.98 58.17 2yrn h ARG 75 Cb 1.29 -0.02 -0.01 0.00 -0.01 0.00 0.00 29.97 31.22 2yrn h ARG 75 CO 0.57 0.42 -0.58 0.77 -3.11 0.00 0.00 179.97 178.03 2yrn h SER 76 N -0.05 0.41 -0.86 -3.80 0.02 -2.02 -3.23 113.55 104.01 2yrn h SER 76 Ca 0.03 -0.23 0.18 0.00 -0.84 0.00 0.00 61.79 60.94 2yrn h SER 76 Cb 0.32 -0.12 -0.16 0.00 0.14 0.00 0.00 62.40 62.58 2yrn h SER 76 CO 0.00 0.90 -0.18 1.56 -1.14 0.00 0.00 176.83 177.97 2yrn h GLN 77 N 0.27 0.01 -0.50 3.45 1.08 -1.92 0.30 115.11 117.81 2yrn h GLN 77 Ca -0.00 -0.00 0.09 0.00 -1.45 0.00 0.00 58.65 57.29 2yrn h GLN 77 Cb 1.10 -0.00 -0.07 0.00 -0.05 0.00 0.00 27.48 28.45 2yrn h GLN 77 CO 0.10 0.01 0.08 0.52 -0.95 0.00 0.00 178.83 178.58 2yrn h MET 78 N 0.01 0.20 -0.73 1.46 2.86 -1.60 -2.76 114.93 114.37 2yrn h MET 78 Ca 0.43 -0.01 0.07 0.00 -2.06 0.00 0.00 59.70 58.12 2yrn h MET 78 Cb 0.68 -0.04 -0.09 0.00 0.06 0.00 0.00 31.60 32.21 2yrn h MET 78 CO -0.87 0.13 -0.43 -0.89 1.06 0.00 0.00 176.91 175.91 2yrn n ILE 79 N -5.14 -0.50 -0.38 -1.22 2.08 0.10 -0.64 119.36 113.67 2yrn n ILE 79 Ca 0.06 2.05 -0.07 0.00 0.56 0.00 0.00 62.75 65.34 2yrn n ILE 79 Cb 0.25 -2.56 -0.04 0.00 -0.75 0.00 0.00 39.64 36.54 2yrn n ILE 79 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 2yrn n GLU 80 N -4.69 -0.34 0.00 0.38 1.02 -1.04 -1.16 120.64 114.81 2yrn n GLU 80 Ca 0.01 1.41 0.00 0.00 -0.02 0.00 0.00 57.16 58.56 2yrn n GLU 80 Cb 0.19 -2.07 0.00 0.00 -0.02 0.00 0.00 31.44 29.54 2yrn n GLU 80 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2yrn n ASN 81 N -5.23 0.00 -0.34 1.62 4.13 0.19 0.38 115.26 116.01 2yrn n ASN 81 Ca 0.05 0.82 0.10 0.00 1.68 0.00 0.00 54.58 57.23 2yrn n ASN 81 Cb 0.29 -0.41 0.27 0.00 -1.54 0.00 0.00 39.78 38.40 2yrn n ASN 81 CO 0.00 0.00 0.00 0.40 0.28 0.00 0.00 177.26 177.94 2yrn h ILE 82 N 0.00 0.77 -0.45 2.41 2.04 -1.26 -1.20 117.51 119.82 2yrn h ILE 82 Ca 0.00 -0.27 0.08 0.00 1.00 0.00 0.00 64.86 65.67 2yrn h ILE 82 Cb 0.00 -0.09 -0.07 0.00 -0.74 0.00 0.00 36.82 35.92 2yrn h ILE 82 CO 0.00 0.14 0.05 -0.78 0.00 0.00 0.00 178.15 177.57 2yrn h ASP 83 N 0.79 -0.07 -0.31 1.72 3.58 0.15 -2.06 116.42 120.21 2yrn h ASP 83 Ca 0.53 0.09 0.07 0.00 0.42 0.00 0.00 57.03 58.14 2yrn h ASP 83 Cb 0.72 0.14 -0.07 0.00 1.72 0.00 0.00 39.33 41.84 2yrn h ASP 83 CO -0.35 -0.00 -0.14 0.00 -2.88 0.00 0.00 179.24 175.86 2yrn h ALA 84 N 1.37 0.11 -0.59 -0.78 0.00 0.58 -1.20 119.26 118.75 2yrn h ALA 84 Ca 0.22 0.12 0.08 0.00 0.00 0.00 0.00 54.91 55.34 2yrn h ALA 84 Cb 0.31 0.36 -0.07 0.00 0.00 0.00 0.00 17.79 18.39 2yrn h ALA 84 CO -0.33 -0.53 0.23 0.00 0.00 0.00 0.00 179.25 178.62 2yrn h LEU 86 N 0.42 -0.55 -1.13 0.00 3.38 -0.66 0.07 115.31 116.85 2yrn h LEU 86 Ca 0.29 0.05 -0.04 0.00 0.09 0.00 0.00 57.88 58.27 2yrn h LEU 86 Cb 0.33 0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.25 2yrn h LEU 86 CO -0.28 -0.30 0.14 0.78 0.09 0.00 0.00 178.44 178.87 2yrn h ASN 87 N -0.44 0.69 -0.38 -0.43 2.35 -0.81 -2.32 115.58 114.25 2yrn h ASN 87 Ca 0.00 -0.11 -0.01 0.00 -0.55 0.00 0.00 56.30 55.63 2yrn h ASN 87 Cb 0.41 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.59 2yrn h ASN 87 CO -0.05 0.68 0.18 0.15 -1.65 0.00 0.00 177.43 176.73 2yrn h PHE 88 N 0.73 0.55 0.15 1.19 3.04 0.18 -2.66 116.94 120.13 2yrn h PHE 88 Ca 0.17 -0.03 -0.01 0.00 3.98 0.00 0.00 57.97 62.08 2yrn h PHE 88 Cb 0.25 -0.17 0.00 0.00 2.56 0.00 0.00 35.95 38.59 2yrn h PHE 88 CO 0.01 0.46 -0.07 -0.07 -2.02 0.00 0.00 178.31 176.62 2yrn h LEU 89 N 0.48 -0.17 -0.59 0.59 3.38 -0.72 -2.89 115.31 115.39 2yrn h LEU 89 Ca 0.13 -0.06 0.11 0.00 0.09 0.00 0.00 57.88 58.15 2yrn h LEU 89 Cb 0.12 0.04 -0.12 0.00 0.09 0.00 0.00 40.66 40.80 2yrn h LEU 89 CO -0.02 -0.05 -0.24 0.00 0.09 0.00 0.00 178.44 178.22 2yrn h ALA 90 N 0.55 0.19 -0.60 1.53 0.00 -1.35 0.47 119.26 120.06 2yrn h ALA 90 Ca -0.02 0.20 0.14 0.00 0.00 0.00 0.00 54.91 55.24 2yrn h ALA 90 Cb 0.22 0.62 -0.03 0.00 0.00 0.00 0.00 17.79 18.60 2yrn h ALA 90 CO 0.03 -0.55 0.42 0.00 0.00 0.00 0.00 179.25 179.15 2yrn h ALA 91 N 1.31 2.33 0.00 0.00 0.00 -1.36 0.41 119.26 121.95 2yrn h ALA 91 Ca 0.27 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.16 2yrn h ALA 91 Cb 0.51 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2yrn h ALA 91 CO -0.65 -0.49 0.00 0.87 0.00 0.00 0.00 179.25 178.98 2yrn h LYS 92 N 0.17 0.00 0.00 0.00 1.79 0.12 -3.46 116.57 115.19 2yrn h LYS 92 Ca 0.29 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.76 2yrn h LYS 92 Cb 0.90 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.55 2yrn h LYS 92 CO -0.05 0.00 0.00 0.41 -1.08 0.00 0.00 179.45 178.73 2yrn n GLY 93 N 0.73 1.18 3.10 3.86 0.00 0.14 -5.11 105.19 109.10 2yrn n GLY 93 Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 2yrn n GLY 93 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2yrn s ILE 94 N -2.00 1.81 -0.16 -0.61 1.01 -1.06 -4.99 121.20 115.20 2yrn s ILE 94 Ca 0.00 -0.81 -0.29 0.00 0.00 0.00 0.00 60.65 59.55 2yrn s ILE 94 Cb 0.00 -1.64 -0.04 0.00 0.01 0.00 0.00 42.46 40.79 2yrn s ILE 94 CO 0.00 0.50 1.77 0.21 0.00 0.00 0.00 174.94 177.42 2yrn s ASN 95 N 1.10 6.27 -0.07 3.58 3.84 -1.26 -3.48 114.94 124.92 2yrn s ASN 95 Ca -0.02 1.90 0.11 0.00 0.21 0.00 0.00 52.86 55.06 2yrn s ASN 95 Cb -0.14 -2.53 -0.16 0.00 -0.55 0.00 0.00 41.25 37.87 2yrn s ASN 95 CO -0.06 -1.30 0.13 2.30 -2.79 0.00 0.00 177.10 175.38 2yrn n ILE 96 N 6.39 0.46 -1.40 -5.21 -5.35 -1.26 -4.97 119.36 108.01 2yrn n ILE 96 Ca 0.21 -0.40 -0.58 0.00 -0.27 0.00 0.00 62.75 61.71 2yrn n ILE 96 Cb 0.44 -0.33 -0.10 0.00 -1.74 0.00 0.00 39.64 37.92 2yrn n ILE 96 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2yrn n GLN 97 N -2.22 0.00 0.00 6.28 6.02 -1.26 -1.40 117.38 124.80 2yrn n GLN 97 Ca -0.12 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.87 2yrn n GLN 97 Cb 0.64 -1.34 0.00 0.00 1.02 0.00 0.00 30.24 30.56 2yrn n GLN 97 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2yrn n GLY 98 N 4.68 2.62 3.47 1.08 0.00 -1.26 -5.11 105.19 110.67 2yrn n GLY 98 Ca 0.35 -0.68 -0.30 0.00 0.00 0.00 0.00 46.02 45.40 2yrn n GLY 98 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2yrn s LEU 99 N 0.00 0.08 -0.26 0.99 1.43 -0.49 -5.06 118.68 115.37 2yrn s LEU 99 Ca 0.00 0.88 -0.02 0.00 -1.03 0.00 0.00 54.13 53.97 2yrn s LEU 99 Cb 0.00 -2.55 0.15 0.00 0.03 0.00 0.00 46.19 43.81 2yrn s LEU 99 CO 0.00 -4.54 0.41 -0.44 0.23 0.00 0.00 176.35 172.01 2yrn s SER 100 N -3.38 0.09 0.28 2.29 0.01 -1.26 -5.03 113.70 106.70 2yrn s SER 100 Ca 0.69 0.17 0.01 0.00 1.31 0.00 0.00 55.95 58.13 2yrn s SER 100 Cb -0.14 1.23 0.67 0.00 0.21 0.00 0.00 66.02 67.99 2yrn s SER 100 CO 0.58 -0.31 1.68 0.00 0.41 0.00 0.00 173.24 175.61 2yrn h ALA 101 N 8.16 1.29 0.30 1.44 0.00 -1.93 -0.82 119.26 127.70 2yrn h ALA 101 Ca -0.17 0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2yrn h ALA 101 Cb 1.15 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 19.14 2yrn h ALA 101 CO 0.27 -0.37 -0.23 1.49 0.00 0.00 0.00 179.25 180.40 2yrn h GLU 102 N 0.32 -0.52 -0.63 0.00 4.81 -1.96 -1.60 114.58 115.00 2yrn h GLU 102 Ca 0.53 0.04 0.12 0.00 -0.13 0.00 0.00 59.36 59.91 2yrn h GLU 102 Cb 1.00 0.12 -0.09 0.00 0.63 0.00 0.00 28.75 30.41 2yrn h GLU 102 CO -0.56 -0.35 0.16 0.93 -0.73 0.00 0.00 179.01 178.47 2yrn h GLU 103 N -0.54 0.29 -0.67 1.92 4.39 -1.61 -0.84 114.58 117.52 2yrn h GLU 103 Ca -0.02 -0.02 0.04 0.00 0.34 0.00 0.00 59.36 59.70 2yrn h GLU 103 Cb 0.48 -0.07 -0.05 0.00 -0.10 0.00 0.00 28.75 29.01 2yrn h GLU 103 CO -0.01 0.19 0.40 0.82 -1.16 0.00 0.00 179.01 179.25 2yrn h ILE 104 N 0.30 1.04 0.00 3.13 2.04 -1.00 -0.35 117.51 122.67 2yrn h ILE 104 Ca 0.33 -0.26 -0.01 0.00 1.00 0.00 0.00 64.86 65.92 2yrn h ILE 104 Cb 0.49 0.21 -0.00 0.00 -0.74 0.00 0.00 36.82 36.77 2yrn h ILE 104 CO -0.40 0.14 -0.06 -0.09 0.00 0.00 0.00 178.15 177.74 2yrn h ARG 105 N 0.76 0.00 0.00 2.37 2.43 -0.19 -1.01 114.38 118.74 2yrn h ARG 105 Ca 0.28 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.45 2yrn h ARG 105 Cb 0.09 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.64 2yrn h ARG 105 CO -0.14 0.06 -0.48 -0.91 -1.51 0.00 0.00 179.97 176.99 2yrn h ASN 106 N 0.00 0.00 -0.13 -3.80 2.35 -0.28 -3.44 115.58 110.27 2yrn h ASN 106 Ca -0.00 -0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.72 2yrn h ASN 106 Cb 0.23 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.60 2yrn h ASN 106 CO 0.01 0.02 0.00 0.61 -1.65 0.00 0.00 177.43 176.41 2yrn n GLY 107 N 1.19 1.22 3.55 2.83 0.00 -0.38 -5.01 105.19 108.58 2yrn n GLY 107 Ca 0.02 -0.34 -0.40 0.00 0.00 0.00 0.00 46.02 45.31 2yrn n GLY 107 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2yrn s ASN 108 N -2.41 5.98 0.09 1.61 3.84 -0.95 -4.88 114.94 118.23 2yrn s ASN 108 Ca 0.00 -0.46 -0.18 0.00 0.21 0.00 0.00 52.86 52.43 2yrn s ASN 108 Cb 0.00 -2.56 -0.04 0.00 -0.55 0.00 0.00 41.25 38.10 2yrn s ASN 108 CO 0.00 -1.94 1.17 -0.11 -2.79 0.00 0.00 177.10 173.42 2yrn n LEU 109 N 10.21 -0.61 -0.37 3.21 7.94 -1.26 0.15 117.00 136.28 2yrn n LEU 109 Ca 0.13 1.30 0.34 0.00 -1.11 0.00 0.00 56.01 56.68 2yrn n LEU 109 Cb 0.50 -0.27 0.61 0.00 0.53 0.00 0.00 43.42 44.79 2yrn n LEU 109 CO 0.70 -0.97 1.11 0.11 -1.11 0.00 0.00 177.39 177.22 2yrn h LYS 110 N 0.00 0.01 0.28 1.96 1.79 -1.96 0.11 116.57 118.76 2yrn h LYS 110 Ca 0.09 -0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.55 2yrn h LYS 110 Cb 0.24 -0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.89 2yrn h LYS 110 CO -0.54 0.01 -0.13 0.00 -1.08 0.00 0.00 179.45 177.70 2yrn h ALA 111 N 1.88 -0.54 -0.14 3.86 0.00 0.10 -3.19 119.26 121.23 2yrn h ALA 111 Ca 0.86 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 55.71 2yrn h ALA 111 Cb 2.42 0.14 -0.05 0.00 0.00 0.00 0.00 17.79 20.30 2yrn h ALA 111 CO -0.68 -0.51 -0.37 0.82 0.00 0.00 0.00 179.25 178.51 2yrn h ILE 112 N -0.73 0.00 -0.76 0.00 5.03 0.04 -1.44 117.51 119.64 2yrn h ILE 112 Ca -0.04 0.00 0.16 0.00 -0.12 0.00 0.00 64.86 64.86 2yrn h ILE 112 Cb 0.29 0.00 -0.14 0.00 -3.03 0.00 0.00 36.82 33.93 2yrn h ILE 112 CO 0.06 0.00 -0.16 0.18 -0.68 0.00 0.00 178.15 177.55 2yrn n LEU 113 N -4.52 -0.25 0.01 1.44 4.77 0.24 0.73 117.00 119.42 2yrn n LEU 113 Ca -0.04 1.31 -0.10 0.00 -0.03 0.00 0.00 56.01 57.16 2yrn n LEU 113 Cb 0.25 -0.41 -0.03 0.00 -2.33 0.00 0.00 43.42 40.90 2yrn n LEU 113 CO 0.04 -1.27 0.74 1.23 -1.33 0.00 0.00 177.39 176.80 2yrn h GLY 114 N 0.00 -0.16 0.23 -0.72 0.00 -1.25 0.43 103.07 101.60 2yrn h GLY 114 Ca 0.38 0.22 0.04 0.00 0.00 0.00 0.00 47.33 47.97 2yrn h GLY 114 CO -0.78 -0.17 -0.33 -2.00 0.00 0.00 0.00 176.54 173.26 2yrn h LEU 115 N -0.24 -1.02 -1.83 3.11 6.46 0.55 0.84 115.31 123.18 2yrn h LEU 115 Ca 0.09 0.14 0.00 0.00 -0.12 0.00 0.00 57.88 57.99 2yrn h LEU 115 Cb 0.37 0.41 0.00 0.00 -0.73 0.00 0.00 40.66 40.72 2yrn h LEU 115 CO -0.25 -0.39 0.00 -0.26 -0.62 0.00 0.00 178.44 176.93 2yrn h PHE 116 N -0.46 0.00 -0.06 1.25 0.04 -1.14 0.87 116.94 117.44 2yrn h PHE 116 Ca 0.07 0.00 -0.18 0.00 2.80 0.00 0.00 57.97 60.66 2yrn h PHE 116 Cb 0.57 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.71 2yrn h PHE 116 CO -0.38 0.00 -0.75 0.35 -0.60 0.00 0.00 178.31 176.94 2yrn h PHE 117 N 0.00 0.46 0.09 -0.55 3.04 0.22 -2.69 116.94 117.50 2yrn h PHE 117 Ca 0.00 -0.21 -0.37 0.00 3.98 0.00 0.00 57.97 61.37 2yrn h PHE 117 Cb 0.32 -0.07 -0.03 0.00 2.56 0.00 0.00 35.95 38.73 2yrn h PHE 117 CO 0.00 0.96 -2.10 -1.13 -2.02 0.00 0.00 178.31 174.03 2yrn n SER 118 N -3.80 2.08 -0.07 0.41 3.41 -0.48 -4.13 113.62 111.04 2yrn n SER 118 Ca -0.04 0.14 -0.08 0.00 -0.26 0.00 0.00 58.87 58.63 2yrn n SER 118 Cb 0.72 -0.76 -0.01 0.00 -0.26 0.00 0.00 64.21 63.90 2yrn n SER 118 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2yrn h LEU 119 N -0.00 0.08 -1.30 1.04 5.85 -0.95 -1.79 115.31 118.24 2yrn h LEU 119 Ca -0.46 0.03 0.17 0.00 0.84 0.00 0.00 57.88 58.46 2yrn h LEU 119 Cb 1.97 0.03 -0.08 0.00 0.37 0.00 0.00 40.66 42.95 2yrn h LEU 119 CO 0.03 0.08 0.59 -1.28 -0.34 0.00 0.00 178.44 177.52 2yrn h SER 120 N 0.21 0.60 0.04 1.25 0.87 -1.67 -1.46 113.55 113.38 2yrn h SER 120 Ca 0.13 0.05 -0.00 0.00 -1.23 0.00 0.00 61.79 60.74 2yrn h SER 120 Cb 0.10 -0.06 0.00 0.00 -0.44 0.00 0.00 62.40 62.00 2yrn h SER 120 CO -0.14 0.26 -0.02 0.03 -0.53 0.00 0.00 176.83 176.44 2yrn h ARG 121 N 0.61 -0.05 -1.39 2.24 3.08 -1.48 -2.47 114.38 114.92 2yrn h ARG 121 Ca 0.48 0.00 0.42 0.00 0.07 0.00 0.00 59.98 60.96 2yrn h ARG 121 Cb 0.91 0.01 -0.10 0.00 0.08 0.00 0.00 29.97 30.87 2yrn h ARG 121 CO -0.23 0.06 0.94 -0.92 -1.07 0.00 0.00 179.97 178.75 2yrn h TYR 122 N -0.15 0.33 -0.02 3.04 5.03 -1.02 0.43 116.97 124.62 2yrn h TYR 122 Ca -0.00 0.01 -0.04 0.00 2.58 0.00 0.00 58.73 61.28 2yrn h TYR 122 Cb 0.13 -0.09 0.00 0.00 1.55 0.00 0.00 36.73 38.33 2yrn h TYR 122 CO -0.04 -0.08 -0.14 -0.22 -1.32 0.00 0.00 178.16 176.35 2yrn h LYS 123 N 0.10 0.13 0.00 1.82 1.63 -1.42 -2.64 116.57 116.19 2yrn h LYS 123 Ca 0.76 -0.12 0.00 0.00 -0.85 0.00 0.00 60.65 60.44 2yrn h LYS 123 Cb 2.60 0.03 0.00 0.00 -0.60 0.00 0.00 32.23 34.25 2yrn h LYS 123 CO -0.23 0.80 0.00 0.00 -3.45 0.00 0.00 179.45 176.56 2yrn n GLN 124 N -4.61 0.83 -0.11 1.90 10.64 0.12 -3.41 117.38 122.74 2yrn n GLN 124 Ca -0.09 0.00 -0.24 0.00 -1.83 0.00 0.00 57.00 54.84 2yrn n GLN 124 Cb 0.42 -1.15 -0.08 0.00 -0.86 0.00 0.00 30.24 28.57 2yrn n GLN 124 CO 0.00 0.00 0.00 1.04 -1.83 0.00 0.00 177.06 176.27 2yrn n GLN 125 N -0.65 0.47 0.08 2.61 6.02 0.39 -4.42 117.38 121.88 2yrn n GLN 125 Ca 0.06 0.21 0.06 0.00 -0.01 0.00 0.00 57.00 57.31 2yrn n GLN 125 Cb 0.03 -1.29 0.29 0.00 1.02 0.00 0.00 30.24 30.28 2yrn n GLN 125 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2yrn n GLN 126 N -3.98 0.07 -1.29 -1.09 10.64 -1.00 -4.73 117.38 116.01 2yrn n GLN 126 Ca -0.44 0.55 -0.35 0.00 -1.83 0.00 0.00 57.00 54.93 2yrn n GLN 126 Cb 0.81 -1.71 0.11 0.00 -0.86 0.00 0.00 30.24 28.59 2yrn n GLN 126 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2yrn n GLN 127 N -1.86 0.44 -3.18 2.61 10.64 -1.24 -4.98 117.38 119.81 2yrn n GLN 127 Ca -0.00 0.22 -0.36 0.00 -1.83 0.00 0.00 57.00 55.02 2yrn n GLN 127 Cb 0.03 -2.39 -0.06 0.00 -0.86 0.00 0.00 30.24 26.96 2yrn n GLN 127 CO 0.00 0.00 0.00 1.14 -1.83 0.00 0.00 177.06 176.37 2yrn s GLN 128 N -3.75 4.19 0.00 2.61 0.00 -1.26 -5.10 119.66 116.34 2yrn s GLN 128 Ca 0.75 0.77 0.16 0.00 -0.00 0.00 0.00 55.36 57.03 2yrn s GLN 128 Cb -0.32 -2.95 0.93 0.00 0.00 0.00 0.00 33.01 30.67 2yrn s GLN 128 CO 0.49 0.45 1.34 -0.35 0.00 0.00 0.00 175.29 177.22