#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gfn s VAL 5 N 0.00 1.31 -0.27 7.28 1.01 -1.26 -5.12 120.40 123.35 2gfn s VAL 5 Ca 0.00 -1.00 -0.26 0.00 0.00 0.00 0.00 61.98 60.72 2gfn s VAL 5 Cb 0.00 -1.15 0.00 0.00 0.00 0.00 0.00 36.38 35.23 2gfn s VAL 5 CO 0.00 0.13 0.90 -0.62 0.00 0.00 0.00 175.10 175.51 2gfn s ASP 6 N -1.01 6.85 0.02 3.32 -1.08 -1.26 -4.92 116.67 118.59 2gfn s ASP 6 Ca 0.04 0.99 0.22 0.00 -0.52 0.00 0.00 52.55 53.29 2gfn s ASP 6 Cb -0.08 -2.47 -0.06 0.00 -1.46 0.00 0.00 42.92 38.86 2gfn s ASP 6 CO 0.01 -0.64 0.94 1.41 0.52 0.00 0.00 175.17 177.41 2gfn n HIS 7 N 6.28 0.12 -2.30 -5.34 8.25 -1.26 -4.82 115.22 116.15 2gfn n HIS 7 Ca 0.07 0.03 -0.39 0.00 -0.26 0.00 0.00 57.72 57.17 2gfn n HIS 7 Cb 0.47 -0.28 -0.03 0.00 1.12 0.00 0.00 29.99 31.27 2gfn n HIS 7 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2gfn s ASP 8 N -3.62 5.72 0.42 0.41 -1.08 -1.26 -4.86 116.67 112.41 2gfn s ASP 8 Ca 0.04 -0.11 0.10 0.00 -0.52 0.00 0.00 52.55 52.06 2gfn s ASP 8 Cb 0.15 -2.55 0.91 0.00 -1.46 0.00 0.00 42.92 39.98 2gfn s ASP 8 CO 0.83 -2.11 2.01 1.05 0.52 0.00 0.00 175.17 177.47 2gfn h GLU 9 N 12.37 0.28 -0.25 4.34 9.09 -1.99 0.21 114.58 138.63 2gfn h GLU 9 Ca -0.25 -0.04 -0.12 0.00 0.05 0.00 0.00 59.36 59.00 2gfn h GLU 9 Cb 1.10 -0.05 -0.00 0.00 -1.65 0.00 0.00 28.75 28.15 2gfn h GLU 9 CO 1.25 0.29 -0.33 -0.09 0.05 0.00 0.00 179.01 180.18 2gfn h ARG 10 N 0.27 0.66 -0.29 1.06 2.43 -1.99 -1.52 114.38 115.00 2gfn h ARG 10 Ca 0.07 -0.38 -0.07 0.00 -0.81 0.00 0.00 59.98 58.78 2gfn h ARG 10 Cb 0.16 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.73 2gfn h ARG 10 CO 0.00 0.99 -0.14 -0.09 -1.51 0.00 0.00 179.97 179.23 2gfn h ARG 11 N 0.38 0.49 -0.37 0.20 2.43 -1.74 -0.07 114.38 115.70 2gfn h ARG 11 Ca 0.03 -0.14 -0.02 0.00 -0.81 0.00 0.00 59.98 59.04 2gfn h ARG 11 Cb 0.91 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.39 2gfn h ARG 11 CO 0.08 0.62 0.17 0.00 -1.51 0.00 0.00 179.97 179.33 2gfn h ARG 12 N 0.45 0.53 -0.74 0.20 3.08 -0.91 0.07 114.38 117.06 2gfn h ARG 12 Ca 0.08 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 2gfn h ARG 12 Cb 0.51 -0.09 -0.04 0.00 0.08 0.00 0.00 29.97 30.43 2gfn h ARG 12 CO 0.03 0.49 0.43 0.00 -1.07 0.00 0.00 179.97 179.85 2gfn h ALA 13 N 1.02 0.95 -0.34 0.04 0.00 -0.64 -0.94 119.26 119.35 2gfn h ALA 13 Ca 0.12 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 2gfn h ALA 13 Cb 0.14 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 2gfn h ALA 13 CO -0.01 0.43 0.18 -0.07 0.00 0.00 0.00 179.25 179.78 2gfn h LEU 14 N 1.02 0.44 -1.10 0.00 3.38 -0.81 -0.92 115.31 117.31 2gfn h LEU 14 Ca 0.27 -0.11 -0.05 0.00 0.09 0.00 0.00 57.88 58.08 2gfn h LEU 14 Cb -0.01 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 2gfn h LEU 14 CO -0.05 0.42 0.09 0.00 0.09 0.00 0.00 178.44 178.99 2gfn h ALA 15 N 1.04 1.28 -0.68 1.53 0.00 -0.60 -1.36 119.26 120.47 2gfn h ALA 15 Ca 0.12 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 2gfn h ALA 15 Cb 0.09 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 2gfn h ALA 15 CO -0.02 0.50 0.27 -0.44 0.00 0.00 0.00 179.25 179.57 2gfn h ASP 16 N 0.70 0.94 -0.80 0.00 3.32 -0.95 -1.42 116.42 118.21 2gfn h ASP 16 Ca 0.15 -0.17 -0.01 0.00 0.02 0.00 0.00 57.03 57.02 2gfn h ASP 16 Cb 0.29 -0.24 -0.04 0.00 0.22 0.00 0.00 39.33 39.56 2gfn h ASP 16 CO 0.00 0.85 0.45 0.00 -1.72 0.00 0.00 179.24 178.83 2gfn h ALA 17 N 1.12 1.27 -0.17 3.45 0.00 -0.51 -0.48 119.26 123.93 2gfn h ALA 17 Ca 0.23 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2gfn h ALA 17 Cb 0.21 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 2gfn h ALA 17 CO -0.02 0.60 0.11 0.28 0.00 0.00 0.00 179.25 180.22 2gfn h VAL 18 N 1.13 1.04 -0.53 0.00 2.07 -0.68 -1.79 116.25 117.48 2gfn h VAL 18 Ca 0.29 -0.08 -0.02 0.00 0.82 0.00 0.00 66.70 67.71 2gfn h VAL 18 Cb 0.01 0.79 -0.02 0.00 -1.52 0.00 0.00 31.29 30.55 2gfn h VAL 18 CO -0.05 0.04 0.26 -0.07 0.02 0.00 0.00 177.57 177.78 2gfn h LEU 19 N 0.23 0.69 -0.60 2.57 3.38 -1.08 0.47 115.31 120.97 2gfn h LEU 19 Ca 0.06 -0.12 0.09 0.00 0.09 0.00 0.00 57.88 58.00 2gfn h LEU 19 Cb -0.02 -0.18 -0.07 0.00 0.09 0.00 0.00 40.66 40.48 2gfn h LEU 19 CO -0.02 0.62 0.23 0.00 0.09 0.00 0.00 178.44 179.37 2gfn h ALA 20 N 1.10 0.77 -0.65 1.53 0.00 -0.96 -0.32 119.26 120.73 2gfn h ALA 20 Ca 0.18 0.08 -0.08 0.00 0.00 0.00 0.00 54.91 55.09 2gfn h ALA 20 Cb 0.11 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 2gfn h ALA 20 CO -0.02 -0.18 0.11 1.25 0.00 0.00 0.00 179.25 180.41 2gfn h LEU 21 N 0.42 1.02 -0.26 0.00 5.85 -0.93 -2.00 115.31 119.41 2gfn h LEU 21 Ca 0.30 -0.26 -0.01 0.00 0.84 0.00 0.00 57.88 58.75 2gfn h LEU 21 Cb 0.35 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 2gfn h LEU 21 CO -0.29 1.02 0.12 0.40 -0.34 0.00 0.00 178.44 179.35 2gfn h ILE 22 N 0.99 1.15 -0.54 4.05 2.04 -0.30 0.19 117.51 125.08 2gfn h ILE 22 Ca 0.20 -0.44 0.02 0.00 1.00 0.00 0.00 64.86 65.64 2gfn h ILE 22 Cb 0.43 0.97 -0.03 0.00 -0.74 0.00 0.00 36.82 37.44 2gfn h ILE 22 CO 0.01 0.15 0.33 0.00 0.00 0.00 0.00 178.15 178.64 2gfn h ALA 23 N 0.98 0.69 0.00 1.87 0.00 -1.06 -1.66 119.26 120.08 2gfn h ALA 23 Ca 0.09 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.85 2gfn h ALA 23 Cb 0.13 -0.17 0.01 0.00 0.00 0.00 0.00 17.79 17.76 2gfn h ALA 23 CO -0.01 0.05 -0.51 -0.09 0.00 0.00 0.00 179.25 178.69 2gfn h ARG 24 N 0.65 0.34 0.00 0.00 2.43 -1.24 -3.41 114.38 113.15 2gfn h ARG 24 Ca 0.21 -0.37 0.00 0.00 -0.81 0.00 0.00 59.98 59.01 2gfn h ARG 24 Cb 0.01 0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.66 2gfn h ARG 24 CO -0.09 1.06 0.00 0.39 -1.51 0.00 0.00 179.97 179.82 2gfn n GLU 25 N -4.30 0.84 0.00 0.20 1.02 0.64 -5.09 120.64 113.96 2gfn n GLU 25 Ca -0.10 -0.20 0.00 0.00 -0.02 0.00 0.00 57.16 56.84 2gfn n GLU 25 Cb 0.63 -0.63 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 2gfn n GLU 25 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2gfn n GLY 26 N 0.18 -0.06 0.30 0.62 0.00 -0.62 -4.24 105.19 101.37 2gfn n GLY 26 Ca 0.00 -1.71 0.08 0.00 0.00 0.00 0.00 46.02 44.39 2gfn n GLY 26 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2gfn h ILE 27 N 0.00 1.00 -0.00 -0.61 2.04 -1.87 -2.02 117.51 116.04 2gfn h ILE 27 Ca 0.00 -0.09 -0.02 0.00 1.00 0.00 0.00 64.86 65.75 2gfn h ILE 27 Cb 0.00 0.71 -0.00 0.00 -0.74 0.00 0.00 36.82 36.79 2gfn h ILE 27 CO 0.00 0.05 -0.07 0.77 0.00 0.00 0.00 178.15 178.90 2gfn h SER 28 N 0.26 0.00 0.80 1.72 4.64 -1.97 -2.13 113.55 116.87 2gfn h SER 28 Ca 0.12 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 2gfn h SER 28 Cb 0.15 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 2gfn h SER 28 CO -0.02 0.07 0.00 0.00 -0.87 0.00 0.00 176.83 176.01 2gfn n ALA 29 N -2.53 1.76 -2.44 5.18 0.00 -0.76 -4.75 120.51 116.98 2gfn n ALA 29 Ca -0.03 0.04 -0.43 0.00 0.00 0.00 0.00 53.44 53.03 2gfn n ALA 29 Cb 0.15 -1.38 -0.02 0.00 0.00 0.00 0.00 19.45 18.20 2gfn n ALA 29 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2gfn s VAL 30 N -3.23 4.20 0.10 0.00 1.01 -0.80 -4.79 120.40 116.88 2gfn s VAL 30 Ca 0.06 1.39 -0.09 0.00 0.00 0.00 0.00 61.98 63.33 2gfn s VAL 30 Cb 0.10 -4.13 0.00 0.00 0.00 0.00 0.00 36.38 32.35 2gfn s VAL 30 CO 0.40 -0.38 0.21 0.42 0.00 0.00 0.00 175.10 175.76 2gfn s THR 31 N 4.10 0.13 0.32 3.92 -4.23 -1.26 -5.01 115.64 113.61 2gfn s THR 31 Ca 0.55 -1.14 0.00 0.00 -1.18 0.00 0.00 61.69 59.93 2gfn s THR 31 Cb -0.18 -1.35 0.25 0.00 1.34 0.00 0.00 72.50 72.56 2gfn s THR 31 CO 0.20 -0.60 1.97 0.74 -0.54 0.00 0.00 174.62 176.39 2gfn h THR 32 N 2.71 1.19 -0.44 3.99 2.02 -1.95 -0.76 112.91 119.67 2gfn h THR 32 Ca -0.34 -0.40 -0.12 0.00 0.77 0.00 0.00 66.41 66.33 2gfn h THR 32 Cb 1.21 0.22 -0.01 0.00 -1.74 0.00 0.00 68.15 67.83 2gfn h THR 32 CO 0.55 0.19 -0.19 0.03 0.37 0.00 0.00 175.52 176.47 2gfn h ARG 33 N 0.93 0.90 -0.30 6.66 3.08 -1.97 -0.36 114.38 123.31 2gfn h ARG 33 Ca 0.25 -0.38 -0.15 0.00 0.07 0.00 0.00 59.98 59.76 2gfn h ARG 33 Cb -0.05 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 29.96 2gfn h ARG 33 CO -0.05 1.03 -0.41 0.00 -1.07 0.00 0.00 179.97 179.48 2gfn h ALA 34 N 0.84 0.71 -0.26 0.04 0.00 -1.76 -1.59 119.26 117.23 2gfn h ALA 34 Ca 0.10 -0.45 -0.19 0.00 0.00 0.00 0.00 54.91 54.36 2gfn h ALA 34 Cb 0.75 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.43 2gfn h ALA 34 CO 0.06 0.66 -0.59 0.28 0.00 0.00 0.00 179.25 179.66 2gfn h VAL 35 N 0.60 1.28 -0.37 0.00 2.07 -1.08 0.13 116.25 118.89 2gfn h VAL 35 Ca 0.05 -1.78 0.05 0.00 0.82 0.00 0.00 66.70 65.84 2gfn h VAL 35 Cb 0.96 1.70 -0.05 0.00 -1.52 0.00 0.00 31.29 32.38 2gfn h VAL 35 CO 0.09 0.58 0.09 0.00 0.02 0.00 0.00 177.57 178.35 2gfn h ALA 36 N 0.68 0.41 -0.50 1.67 0.00 -1.03 0.33 119.26 120.82 2gfn h ALA 36 Ca 0.00 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 2gfn h ALA 36 Cb 1.20 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 2gfn h ALA 36 CO 0.13 -0.31 0.22 1.49 0.00 0.00 0.00 179.25 180.78 2gfn h GLU 37 N 0.23 0.74 -0.60 0.00 4.81 -1.12 0.09 114.58 118.71 2gfn h GLU 37 Ca 0.17 -0.12 -0.03 0.00 -0.13 0.00 0.00 59.36 59.25 2gfn h GLU 37 Cb 0.18 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.41 2gfn h GLU 37 CO -0.21 0.64 0.25 1.49 -0.73 0.00 0.00 179.01 180.45 2gfn h GLU 38 N 0.67 0.87 0.00 1.92 4.57 -0.67 -3.31 114.58 118.63 2gfn h GLU 38 Ca 0.17 -0.13 -0.24 0.00 -1.18 0.00 0.00 59.36 57.98 2gfn h GLU 38 Cb 0.16 -0.16 -0.04 0.00 -0.16 0.00 0.00 28.75 28.55 2gfn h GLU 38 CO -0.02 0.71 -2.02 -1.13 -1.18 0.00 0.00 179.01 175.37 2gfn n SER 39 N -4.33 0.27 0.00 1.04 3.41 0.08 -5.00 113.62 109.10 2gfn n SER 39 Ca 0.05 0.12 0.00 0.00 -0.26 0.00 0.00 58.87 58.78 2gfn n SER 39 Cb 0.16 0.94 0.00 0.00 -0.26 0.00 0.00 64.21 65.05 2gfn n SER 39 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2gfn n GLY 40 N 1.54 0.71 3.98 5.00 0.00 -0.00 -5.07 105.19 111.34 2gfn n GLY 40 Ca -0.20 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.62 2gfn n GLY 40 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2gfn s TRP 41 N -2.51 3.22 0.49 1.61 0.51 -1.23 -5.05 118.94 115.99 2gfn s TRP 41 Ca 0.00 -0.06 -0.14 0.00 -2.12 0.00 0.00 56.10 53.79 2gfn s TRP 41 Cb 0.00 -1.97 -0.07 0.00 -0.81 0.00 0.00 33.47 30.62 2gfn s TRP 41 CO 0.00 0.01 0.91 -1.54 -0.51 0.00 0.00 176.95 175.82 2gfn s SER 42 N -4.14 6.54 0.49 2.95 1.04 -1.26 -4.54 113.70 114.78 2gfn s SER 42 Ca 0.43 1.39 0.19 0.00 0.48 0.00 0.00 55.95 58.44 2gfn s SER 42 Cb -0.10 -2.43 1.23 0.00 0.10 0.00 0.00 66.02 64.82 2gfn s SER 42 CO 0.32 -0.55 2.02 0.71 0.98 0.00 0.00 173.24 176.72 2gfn h THR 43 N 0.83 0.85 -0.60 2.02 1.35 -1.93 -0.96 112.91 114.47 2gfn h THR 43 Ca -0.47 -0.05 0.05 0.00 -0.55 0.00 0.00 66.41 65.39 2gfn h THR 43 Cb 1.19 0.68 -0.05 0.00 -1.73 0.00 0.00 68.15 68.24 2gfn h THR 43 CO 0.62 0.03 0.33 1.23 -0.25 0.00 0.00 175.52 177.48 2gfn h GLY 44 N 0.16 0.86 0.78 5.82 0.00 -1.97 0.38 103.07 109.10 2gfn h GLY 44 Ca 0.21 -0.23 -0.00 0.00 0.00 0.00 0.00 47.33 47.30 2gfn h GLY 44 CO -0.03 0.15 -0.01 -2.08 0.00 0.00 0.00 176.54 174.58 2gfn h VAL 45 N 0.63 1.16 -0.56 4.60 2.07 -1.58 -2.46 116.25 120.10 2gfn h VAL 45 Ca 0.26 -0.50 -0.01 0.00 0.82 0.00 0.00 66.70 67.27 2gfn h VAL 45 Cb 0.14 1.50 -0.03 0.00 -1.52 0.00 0.00 31.29 31.38 2gfn h VAL 45 CO -0.16 0.13 0.32 -0.07 0.02 0.00 0.00 177.57 177.82 2gfn h LEU 46 N -0.23 0.69 -2.24 2.57 4.07 -1.13 -2.46 115.31 116.59 2gfn h LEU 46 Ca -0.00 -0.08 -0.01 0.00 0.08 0.00 0.00 57.88 57.88 2gfn h LEU 46 Cb 0.22 -0.17 -0.00 0.00 1.08 0.00 0.00 40.66 41.79 2gfn h LEU 46 CO 0.00 0.56 -0.03 0.78 -1.08 0.00 0.00 178.44 178.68 2gfn h ASN 47 N 0.76 0.00 0.54 -0.43 2.35 -0.19 0.29 115.58 118.90 2gfn h ASN 47 Ca 0.20 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.95 2gfn h ASN 47 Cb 0.01 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.38 2gfn h ASN 47 CO -0.04 0.03 -1.12 1.41 -1.65 0.00 0.00 177.43 176.06 2gfn n HIS 48 N -3.22 0.42 0.08 1.19 8.25 -0.93 -3.39 115.22 117.62 2gfn n HIS 48 Ca -0.02 0.12 -0.22 0.00 -0.26 0.00 0.00 57.72 57.35 2gfn n HIS 48 Cb 0.19 -0.59 -0.15 0.00 1.12 0.00 0.00 29.99 30.56 2gfn n HIS 48 CO 0.00 0.00 0.00 1.88 0.64 0.00 0.00 176.34 178.86 2gfn h TYR 49 N 0.00 0.72 0.00 4.41 0.05 -0.67 -3.47 116.97 118.00 2gfn h TYR 49 Ca 0.00 -0.53 0.00 0.00 0.05 0.00 0.00 58.73 58.25 2gfn h TYR 49 Cb 0.83 -0.03 0.00 0.00 1.01 0.00 0.00 36.73 38.54 2gfn h TYR 49 CO 0.00 1.61 0.00 1.19 -1.05 0.00 0.00 178.16 179.91 2gfn n PHE 50 N -3.59 -0.36 -3.93 4.88 3.72 0.88 -5.02 117.46 114.05 2gfn n PHE 50 Ca -0.22 0.06 -0.29 0.00 -0.05 0.00 0.00 57.45 56.95 2gfn n PHE 50 Cb 1.08 0.19 0.01 0.00 -0.94 0.00 0.00 39.48 39.82 2gfn n PHE 50 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2gfn n GLY 51 N 2.78 -0.42 3.63 1.37 0.00 -1.22 -4.85 105.19 106.48 2gfn n GLY 51 Ca 0.00 0.17 -0.04 0.00 0.00 0.00 0.00 46.02 46.15 2gfn n GLY 51 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2gfn s SER 52 N -3.60 -0.11 0.34 1.61 1.04 -1.26 -4.98 113.70 106.73 2gfn s SER 52 Ca 0.49 0.15 0.04 0.00 0.48 0.00 0.00 55.95 57.11 2gfn s SER 52 Cb -0.25 0.13 0.61 0.00 0.10 0.00 0.00 66.02 66.60 2gfn s SER 52 CO 0.85 -0.08 1.89 -0.09 0.98 0.00 0.00 173.24 176.78 2gfn h ARG 53 N 2.46 0.54 -0.48 4.02 2.43 -1.95 -2.54 114.38 118.87 2gfn h ARG 53 Ca -0.15 -0.11 0.05 0.00 -0.81 0.00 0.00 59.98 58.96 2gfn h ARG 53 Cb 1.18 -0.08 -0.05 0.00 -0.42 0.00 0.00 29.97 30.61 2gfn h ARG 53 CO 0.22 0.55 0.22 1.25 -1.51 0.00 0.00 179.97 180.70 2gfn h HIS 54 N 0.53 0.40 -0.30 2.20 2.76 -1.97 0.13 115.15 118.89 2gfn h HIS 54 Ca 0.12 0.02 -0.11 0.00 -2.20 0.00 0.00 60.37 58.20 2gfn h HIS 54 Cb 0.30 -0.11 -0.01 0.00 1.55 0.00 0.00 27.41 29.14 2gfn h HIS 54 CO 0.01 0.18 -0.26 0.93 -1.30 0.00 0.00 177.93 177.49 2gfn h GLU 55 N 0.43 0.60 -0.11 5.26 4.39 -1.82 0.03 114.58 123.37 2gfn h GLU 55 Ca 0.22 -0.24 -0.00 0.00 0.34 0.00 0.00 59.36 59.67 2gfn h GLU 55 Cb 0.16 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.78 2gfn h GLU 55 CO -0.17 0.81 0.06 1.25 -1.16 0.00 0.00 179.01 179.80 2gfn h LEU 56 N 0.53 0.13 -0.94 1.33 5.85 -0.98 -0.12 115.31 121.10 2gfn h LEU 56 Ca 0.07 -0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 2gfn h LEU 56 Cb 0.73 -0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.68 2gfn h LEU 56 CO 0.06 0.17 0.45 -0.07 -0.34 0.00 0.00 178.44 178.70 2gfn h LEU 57 N 0.09 1.08 -0.69 2.25 3.38 -0.61 -2.83 115.31 117.97 2gfn h LEU 57 Ca 0.04 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 57.86 2gfn h LEU 57 Cb 0.06 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.51 2gfn h LEU 57 CO -0.01 0.88 0.27 0.25 0.09 0.00 0.00 178.44 179.92 2gfn h LEU 58 N 1.20 0.96 -0.62 1.67 6.46 -0.73 -0.05 115.31 124.21 2gfn h LEU 58 Ca 0.30 -0.18 0.10 0.00 -0.12 0.00 0.00 57.88 57.98 2gfn h LEU 58 Cb 0.05 -0.25 -0.07 0.00 -0.73 0.00 0.00 40.66 39.66 2gfn h LEU 58 CO -0.04 0.88 0.22 0.00 -0.62 0.00 0.00 178.44 178.87 2gfn h ALA 59 N 1.12 0.79 -0.45 1.25 0.00 -0.86 -1.07 119.26 120.03 2gfn h ALA 59 Ca 0.23 0.09 -0.07 0.00 0.00 0.00 0.00 54.91 55.16 2gfn h ALA 59 Cb 0.22 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 2gfn h ALA 59 CO -0.02 -0.20 0.03 0.00 0.00 0.00 0.00 179.25 179.06 2gfn h ALA 60 N 1.43 0.61 -0.29 0.00 0.00 -1.06 -0.76 119.26 119.19 2gfn h ALA 60 Ca 0.31 -0.26 0.05 0.00 0.00 0.00 0.00 54.91 55.01 2gfn h ALA 60 Cb 0.40 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 2gfn h ALA 60 CO -0.32 0.38 0.02 1.25 0.00 0.00 0.00 179.25 180.58 2gfn h LEU 61 N 0.64 -0.06 -0.50 0.00 5.85 -0.66 -0.34 115.31 120.24 2gfn h LEU 61 Ca 0.13 0.06 -0.10 0.00 0.84 0.00 0.00 57.88 58.81 2gfn h LEU 61 Cb 0.46 0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.56 2gfn h LEU 61 CO 0.02 0.00 -0.09 0.03 -0.34 0.00 0.00 178.44 178.06 2gfn h ARG 62 N 0.12 0.93 -0.31 1.25 3.08 -0.93 -1.70 114.38 116.82 2gfn h ARG 62 Ca 0.14 -0.34 -0.01 0.00 0.07 0.00 0.00 59.98 59.84 2gfn h ARG 62 Cb 0.17 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.14 2gfn h ARG 62 CO -0.21 1.00 0.17 -0.09 -1.07 0.00 0.00 179.97 179.77 2gfn h ARG 63 N 0.79 0.43 -0.65 0.04 9.65 -0.92 -1.47 114.38 122.24 2gfn h ARG 63 Ca 0.13 -0.05 0.11 0.00 -1.10 0.00 0.00 59.98 59.07 2gfn h ARG 63 Cb 0.64 -0.08 -0.08 0.00 -1.39 0.00 0.00 29.97 29.05 2gfn h ARG 63 CO 0.04 0.36 0.25 0.00 2.80 0.00 0.00 179.97 183.42 2gfn h ALA 64 N 1.04 0.86 -0.99 2.80 0.00 -0.94 -1.50 119.26 120.53 2gfn h ALA 64 Ca 0.11 0.09 0.01 0.00 0.00 0.00 0.00 54.91 55.12 2gfn h ALA 64 Cb 0.06 0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.86 2gfn h ALA 64 CO -0.02 -0.19 0.66 0.78 0.00 0.00 0.00 179.25 180.48 2gfn h GLY 65 N 0.42 1.40 0.77 0.00 0.00 -1.00 -1.63 103.07 103.03 2gfn h GLY 65 Ca 0.33 -0.52 -0.03 0.00 0.00 0.00 0.00 47.33 47.12 2gfn h GLY 65 CO -0.33 0.51 -0.01 -0.55 0.00 0.00 0.00 176.54 176.15 2gfn h ASP 66 N 1.35 0.27 -0.88 0.19 3.32 -0.72 -1.27 116.42 118.68 2gfn h ASP 66 Ca 0.36 -0.33 0.03 0.00 0.02 0.00 0.00 57.03 57.11 2gfn h ASP 66 Cb -0.15 -0.07 -0.05 0.00 0.22 0.00 0.00 39.33 39.27 2gfn h ASP 66 CO -0.08 0.54 0.57 0.40 -1.72 0.00 0.00 179.24 178.95 2gfn h ILE 67 N -0.00 1.16 -0.57 0.35 2.04 -1.25 -2.01 117.51 117.23 2gfn h ILE 67 Ca 0.04 -0.38 0.04 0.00 1.00 0.00 0.00 64.86 65.55 2gfn h ILE 67 Cb 0.41 -0.06 -0.04 0.00 -0.74 0.00 0.00 36.82 36.39 2gfn h ILE 67 CO 0.01 0.20 0.33 -0.61 0.00 0.00 0.00 178.15 178.08 2gfn h GLN 68 N 1.12 0.62 -0.92 2.37 5.75 -1.12 -0.64 115.11 122.29 2gfn h GLN 68 Ca 0.34 -0.04 0.05 0.00 -0.15 0.00 0.00 58.65 58.86 2gfn h GLN 68 Cb -0.02 -0.14 -0.06 0.00 1.07 0.00 0.00 27.48 28.34 2gfn h GLN 68 CO -0.11 0.41 0.60 0.78 -2.65 0.00 0.00 178.83 177.86 2gfn h GLY 69 N 0.63 1.34 1.38 2.39 0.00 -0.88 -0.76 103.07 107.18 2gfn h GLY 69 Ca 0.24 -0.43 -0.09 0.00 0.00 0.00 0.00 47.33 47.04 2gfn h GLY 69 CO -0.13 0.34 -0.13 -0.55 0.00 0.00 0.00 176.54 176.08 2gfn h ASP 70 N 1.09 0.72 -0.54 0.19 3.32 -0.79 -2.30 116.42 118.12 2gfn h ASP 70 Ca 0.38 -0.22 0.00 0.00 0.02 0.00 0.00 57.03 57.22 2gfn h ASP 70 Cb 0.13 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.45 2gfn h ASP 70 CO -0.13 0.87 0.34 0.03 -1.72 0.00 0.00 179.24 178.63 2gfn h ARG 71 N 0.66 0.71 -0.20 3.56 2.47 -0.03 -1.34 114.38 120.22 2gfn h ARG 71 Ca 0.11 -0.05 0.03 0.00 -1.26 0.00 0.00 59.98 58.81 2gfn h ARG 71 Cb 0.59 -0.16 -0.03 0.00 -1.65 0.00 0.00 29.97 28.73 2gfn h ARG 71 CO 0.04 0.49 0.01 1.88 0.56 0.00 0.00 179.97 182.95 2gfn h TYR 72 N 0.72 0.00 -0.36 3.04 0.05 -1.04 -0.64 116.97 118.74 2gfn h TYR 72 Ca 0.19 0.01 0.08 0.00 0.05 0.00 0.00 58.73 59.07 2gfn h TYR 72 Cb -0.06 0.03 -0.08 0.00 1.01 0.00 0.00 36.73 37.63 2gfn h TYR 72 CO -0.03 -0.02 -0.18 0.00 -1.05 0.00 0.00 178.16 176.88 2gfn h ARG 73 N 0.08 -0.12 -0.68 4.88 3.08 -1.24 0.98 114.38 121.37 2gfn h ARG 73 Ca 0.09 0.01 0.02 0.00 0.07 0.00 0.00 59.98 60.17 2gfn h ARG 73 Cb 0.11 0.03 -0.04 0.00 0.08 0.00 0.00 29.97 30.15 2gfn h ARG 73 CO -0.15 -0.08 0.44 1.15 -1.07 0.00 0.00 179.97 180.26 2gfn h THR 74 N -0.12 1.13 -0.26 2.04 2.02 -0.84 -1.94 112.91 114.93 2gfn h THR 74 Ca 0.18 -0.30 -0.04 0.00 0.77 0.00 0.00 66.41 67.03 2gfn h THR 74 Cb 0.40 0.18 -0.01 0.00 -1.74 0.00 0.00 68.15 66.98 2gfn h THR 74 CO -0.44 0.16 0.02 0.40 0.37 0.00 0.00 175.52 176.03 2gfn h ILE 75 N 0.87 1.25 -0.00 3.11 2.04 -0.29 -2.99 117.51 121.50 2gfn h ILE 75 Ca 0.26 -0.86 -0.07 0.00 1.00 0.00 0.00 64.86 65.20 2gfn h ILE 75 Cb -0.04 1.30 -0.01 0.00 -0.74 0.00 0.00 36.82 37.33 2gfn h ILE 75 CO -0.08 0.27 -0.33 -0.07 0.00 0.00 0.00 178.15 177.93 2gfn h LEU 76 N 0.24 0.00 -1.67 1.44 4.07 -0.66 -3.09 115.31 115.63 2gfn h LEU 76 Ca 0.08 -0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.04 2gfn h LEU 76 Cb 0.38 -0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.12 2gfn h LEU 76 CO 0.01 0.33 0.00 0.47 -1.08 0.00 0.00 178.44 178.17 2gfn n ASP 77 N -4.14 2.48 -4.67 -0.43 9.92 -0.74 -4.92 116.55 114.04 2gfn n ASP 77 Ca -0.02 -1.90 -0.42 0.00 -0.53 0.00 0.00 54.79 51.92 2gfn n ASP 77 Cb 0.37 -0.23 -0.03 0.00 -0.64 0.00 0.00 41.12 40.60 2gfn n ASP 77 CO 0.00 0.00 0.00 -0.70 0.13 0.00 0.00 177.20 176.63 2gfn s GLU 78 N -1.54 4.24 0.09 -1.24 2.12 -1.14 -4.95 118.70 116.28 2gfn s GLU 78 Ca 0.34 1.93 -0.31 0.00 0.36 0.00 0.00 54.97 57.29 2gfn s GLU 78 Cb 0.19 -3.75 -0.09 0.00 0.26 0.00 0.00 34.13 30.74 2gfn s GLU 78 CO 0.26 -0.69 1.63 -2.00 -0.54 0.00 0.00 175.26 173.92 2gfn s GLU 79 N 3.18 4.20 0.00 4.30 2.12 -1.26 -2.86 118.70 128.38 2gfn s GLU 79 Ca 0.64 2.33 0.00 0.00 0.36 0.00 0.00 54.97 58.30 2gfn s GLU 79 Cb -0.29 -3.49 0.00 0.00 0.26 0.00 0.00 34.13 30.61 2gfn s GLU 79 CO 0.24 -0.70 0.00 0.41 -0.54 0.00 0.00 175.26 174.67 2gfn n GLY 80 N 3.93 2.40 3.75 -1.50 0.00 -1.26 -5.04 105.19 107.47 2gfn n GLY 80 Ca 0.15 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.77 2gfn n GLY 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gfn s ALA 81 N -2.37 3.40 0.49 4.61 0.00 -1.14 -5.05 121.76 121.70 2gfn s ALA 81 Ca 0.00 0.88 0.08 0.00 0.00 0.00 0.00 51.96 52.92 2gfn s ALA 81 Cb 0.00 -3.33 0.04 0.00 0.00 0.00 0.00 23.12 19.83 2gfn s ALA 81 CO 0.00 -0.17 0.67 0.20 0.00 0.00 0.00 175.76 176.46 2gfn s GLY 82 N -0.69 1.86 0.36 0.00 0.00 -1.26 -4.91 107.32 102.68 2gfn s GLY 82 Ca 0.46 -1.81 0.12 0.00 0.00 0.00 0.00 44.72 43.48 2gfn s GLY 82 CO 0.40 -1.52 1.82 -2.55 0.00 0.00 0.00 173.10 171.24 2gfn h PRO 83 N 0.42 0.58 0.04 2.90 0.11 -1.93 -0.79 132.00 133.32 2gfn h PRO 83 Ca -0.37 -0.03 -0.25 0.00 0.11 0.00 0.00 66.00 65.46 2gfn h PRO 83 Cb 1.28 -0.13 0.02 0.00 0.11 0.00 0.00 31.00 32.28 2gfn h PRO 83 CO 0.44 0.38 -1.01 0.82 -0.21 0.00 0.00 178.00 178.42 2gfn h ILE 84 N 0.60 1.32 -0.77 4.15 1.08 -1.95 -2.09 117.51 119.85 2gfn h ILE 84 Ca 0.52 -2.28 0.03 0.00 -0.39 0.00 0.00 64.86 62.74 2gfn h ILE 84 Cb 1.03 2.54 -0.05 0.00 -3.07 0.00 0.00 36.82 37.27 2gfn h ILE 84 CO -0.27 0.69 0.49 -0.33 -0.69 0.00 0.00 178.15 178.04 2gfn h GLU 85 N 0.24 0.94 -0.05 2.37 5.08 -1.78 -0.86 114.58 120.52 2gfn h GLU 85 Ca -0.14 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.17 2gfn h GLU 85 Cb 1.68 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 30.72 2gfn h GLU 85 CO 0.20 0.62 0.03 0.87 -1.00 0.00 0.00 179.01 179.73 2gfn h LYS 86 N 0.97 0.07 -0.92 2.33 1.57 -1.15 0.66 116.57 120.10 2gfn h LYS 86 Ca 0.30 -0.01 0.09 0.00 -1.87 0.00 0.00 60.65 59.17 2gfn h LYS 86 Cb -0.01 -0.01 -0.07 0.00 0.08 0.00 0.00 32.23 32.21 2gfn h LYS 86 CO -0.10 0.14 0.57 -0.07 -0.57 0.00 0.00 179.45 179.42 2gfn h LEU 87 N -0.02 0.86 -0.84 2.94 3.38 -1.22 0.31 115.31 120.73 2gfn h LEU 87 Ca 0.02 0.03 -0.07 0.00 0.09 0.00 0.00 57.88 57.95 2gfn h LEU 87 Cb 0.09 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 2gfn h LEU 87 CO -0.00 0.51 0.06 0.03 0.09 0.00 0.00 178.44 179.12 2gfn h ARG 88 N 0.97 0.93 -0.23 1.13 3.08 -0.80 -1.03 114.38 118.43 2gfn h ARG 88 Ca 0.43 -0.24 -0.20 0.00 0.07 0.00 0.00 59.98 60.04 2gfn h ARG 88 Cb 0.32 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.27 2gfn h ARG 88 CO -0.22 0.88 -0.62 -0.91 -1.07 0.00 0.00 179.97 178.03 2gfn h ASN 89 N 0.87 0.95 -0.33 7.04 2.35 -0.01 -0.37 115.58 126.09 2gfn h ASN 89 Ca 0.17 -0.57 0.02 0.00 -0.55 0.00 0.00 56.30 55.37 2gfn h ASN 89 Cb 0.43 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.50 2gfn h ASN 89 CO 0.01 1.35 0.18 0.40 -1.65 0.00 0.00 177.43 177.73 2gfn h ILE 90 N 0.59 1.02 -0.08 2.81 2.04 -0.37 -1.46 117.51 122.06 2gfn h ILE 90 Ca -0.01 -0.13 -0.00 0.00 1.00 0.00 0.00 64.86 65.71 2gfn h ILE 90 Cb 1.24 0.61 -0.00 0.00 -0.74 0.00 0.00 36.82 37.92 2gfn h ILE 90 CO 0.13 0.07 0.03 0.74 0.00 0.00 0.00 178.15 179.13 2gfn h THR 91 N 0.38 1.14 -0.96 -0.27 2.02 -1.05 -2.47 112.91 111.70 2gfn h THR 91 Ca 0.13 -0.40 0.15 0.00 0.77 0.00 0.00 66.41 67.06 2gfn h THR 91 Cb 0.01 1.26 -0.08 0.00 -1.74 0.00 0.00 68.15 67.60 2gfn h THR 91 CO -0.07 0.12 0.61 0.00 0.37 0.00 0.00 175.52 176.55 2gfn h ALA 92 N 0.88 1.71 0.00 6.16 0.00 -1.01 -2.27 119.26 124.72 2gfn h ALA 92 Ca 0.03 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2gfn h ALA 92 Cb 0.16 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2gfn h ALA 92 CO -0.00 0.02 0.00 -1.13 0.00 0.00 0.00 179.25 178.14 2gfn n SER 93 N -4.62 0.55 0.03 0.00 3.41 -0.56 -1.57 113.62 110.86 2gfn n SER 93 Ca 0.19 0.66 0.04 0.00 -0.26 0.00 0.00 58.87 59.51 2gfn n SER 93 Cb 0.46 -0.77 -0.08 0.00 -0.26 0.00 0.00 64.21 63.56 2gfn n SER 93 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 2gfn n ILE 94 N -2.13 0.81 -2.45 -1.33 2.08 -0.86 -4.92 119.36 110.57 2gfn n ILE 94 Ca 0.01 -0.63 -0.42 0.00 0.56 0.00 0.00 62.75 62.28 2gfn n ILE 94 Cb 0.18 -0.45 -0.03 0.00 -0.75 0.00 0.00 39.64 38.58 2gfn n ILE 94 CO 0.00 0.00 0.00 -0.76 0.56 0.00 0.00 176.55 176.35 2gfn s LEU 95 N -5.38 4.40 -1.12 1.39 1.43 -0.61 -4.89 118.68 113.90 2gfn s LEU 95 Ca -0.04 2.03 -0.17 0.00 -1.03 0.00 0.00 54.13 54.92 2gfn s LEU 95 Cb 0.10 -3.59 -0.06 0.00 0.03 0.00 0.00 46.19 42.67 2gfn s LEU 95 CO 0.83 -0.41 2.10 -0.81 0.23 0.00 0.00 176.35 178.29 2gfn n PRO 96 N 3.52 2.21 0.00 1.29 -0.04 -1.26 -4.55 135.00 136.17 2gfn n PRO 96 Ca 0.07 -2.20 0.06 0.00 -0.04 0.00 0.00 63.50 61.40 2gfn n PRO 96 Cb 0.46 -3.07 0.02 0.00 -0.04 0.00 0.00 33.50 30.87 2gfn n PRO 96 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2gfn n LEU 97 N 6.63 1.62 -4.18 1.53 4.77 -1.26 -4.56 117.00 121.54 2gfn n LEU 97 Ca 0.51 -0.85 -0.18 0.00 -0.03 0.00 0.00 56.01 55.47 2gfn n LEU 97 Cb 0.38 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.42 2gfn n LEU 97 CO 0.96 0.31 0.04 1.51 -1.33 0.00 0.00 177.39 178.88 2gfn s ASP 98 N -1.40 1.41 0.18 -1.43 1.47 -1.26 -5.02 116.67 110.61 2gfn s ASP 98 Ca 0.12 -1.66 -0.13 0.00 1.18 0.00 0.00 52.55 52.05 2gfn s ASP 98 Cb 0.10 0.63 0.10 0.00 -0.34 0.00 0.00 42.92 43.41 2gfn s ASP 98 CO 0.26 -1.22 1.82 -0.33 0.68 0.00 0.00 175.17 176.38 2gfn h GLU 99 N 2.08 0.64 -0.12 2.11 5.08 -1.97 0.29 114.58 122.69 2gfn h GLU 99 Ca -0.26 -0.04 0.04 0.00 -1.00 0.00 0.00 59.36 58.10 2gfn h GLU 99 Cb 1.23 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 30.30 2gfn h GLU 99 CO 0.37 0.42 -0.13 -0.09 -1.00 0.00 0.00 179.01 178.58 2gfn h ARG 100 N 0.66 -0.16 0.01 2.33 2.43 -1.97 -1.29 114.38 116.38 2gfn h ARG 100 Ca 0.21 0.01 -0.19 0.00 -0.81 0.00 0.00 59.98 59.20 2gfn h ARG 100 Cb -0.00 0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.56 2gfn h ARG 100 CO -0.08 -0.11 -0.90 0.00 -1.51 0.00 0.00 179.97 177.37 2gfn h ARG 101 N -0.17 0.05 -0.08 0.20 3.08 -1.82 -3.08 114.38 112.57 2gfn h ARG 101 Ca 0.09 -0.06 0.02 0.00 0.07 0.00 0.00 59.98 60.09 2gfn h ARG 101 Cb 0.29 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.35 2gfn h ARG 101 CO -0.22 0.91 -0.03 1.25 -1.07 0.00 0.00 179.97 180.81 2gfn h LEU 102 N 0.02 -0.10 -1.37 3.04 5.85 -0.29 -1.18 115.31 121.29 2gfn h LEU 102 Ca -0.02 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.73 2gfn h LEU 102 Cb 1.57 0.06 0.00 0.00 0.37 0.00 0.00 40.66 42.66 2gfn h LEU 102 CO 0.12 -0.04 0.00 0.00 -0.34 0.00 0.00 178.44 178.18 2gfn n ALA 103 N -2.23 1.25 0.00 1.25 0.00 -0.50 -1.47 120.51 118.81 2gfn n ALA 103 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.39 2gfn n ALA 103 Cb 0.08 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.53 2gfn n ALA 103 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2gfn n THR 105 N 0.66 0.00 -0.04 0.00 -1.04 -0.45 -0.69 114.28 112.72 2gfn n THR 105 Ca 0.00 0.00 -0.12 0.00 -2.04 0.00 0.00 64.05 61.89 2gfn n THR 105 Cb 0.02 0.00 -0.06 0.00 -1.82 0.00 0.00 70.33 68.47 2gfn n THR 105 CO 0.00 0.00 0.00 0.03 -0.64 0.00 0.00 175.07 174.46 2gfn h ARG 106 N 0.00 0.24 -0.25 -2.82 3.08 -1.51 0.04 114.38 113.16 2gfn h ARG 106 Ca 0.00 -0.07 -0.13 0.00 0.07 0.00 0.00 59.98 59.86 2gfn h ARG 106 Cb 0.00 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 2gfn h ARG 106 CO 0.00 0.44 -0.37 -0.24 -1.07 0.00 0.00 179.97 178.73 2gfn h VAL 107 N 0.00 1.29 -0.36 2.04 3.04 -1.17 -1.89 116.25 119.20 2gfn h VAL 107 Ca 0.04 -1.51 -0.07 0.00 -1.01 0.00 0.00 66.70 64.15 2gfn h VAL 107 Cb 0.32 1.51 -0.01 0.00 -2.01 0.00 0.00 31.29 31.09 2gfn h VAL 107 CO 0.00 0.48 -0.05 -0.26 -1.01 0.00 0.00 177.57 176.73 2gfn h PHE 108 N 0.47 0.74 -0.55 3.17 0.04 -1.77 -2.05 116.94 116.98 2gfn h PHE 108 Ca 0.05 -0.15 0.05 0.00 2.80 0.00 0.00 57.97 60.72 2gfn h PHE 108 Cb 0.86 -0.18 -0.05 0.00 2.20 0.00 0.00 35.95 38.77 2gfn h PHE 108 CO 0.03 0.80 0.27 1.25 -0.60 0.00 0.00 178.31 180.06 2gfn h LEU 109 N 0.46 0.37 -0.17 1.54 5.85 -0.88 0.36 115.31 122.85 2gfn h LEU 109 Ca 0.09 0.04 0.05 0.00 0.84 0.00 0.00 57.88 58.90 2gfn h LEU 109 Cb 0.54 -0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.49 2gfn h LEU 109 CO 0.03 0.25 -0.16 0.15 -0.34 0.00 0.00 178.44 178.37 2gfn h PHE 110 N 0.51 -0.41 0.00 1.25 3.57 -1.19 -2.13 116.94 118.55 2gfn h PHE 110 Ca 0.25 0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.70 2gfn h PHE 110 Cb 0.18 0.21 -0.01 0.00 2.79 0.00 0.00 35.95 39.12 2gfn h PHE 110 CO -0.11 -0.23 -0.34 0.74 -2.23 0.00 0.00 178.31 176.14 2gfn h PHE 111 N -0.18 0.00 -0.09 0.41 0.04 -0.92 -2.96 116.94 113.24 2gfn h PHE 111 Ca 0.11 0.00 0.04 0.00 2.80 0.00 0.00 57.97 60.92 2gfn h PHE 111 Cb 0.34 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 38.44 2gfn h PHE 111 CO -0.30 0.34 -0.24 1.88 -0.60 0.00 0.00 178.31 179.39 2gfn h TYR 112 N 0.00 -0.65 -0.60 -0.55 -1.99 0.33 -1.50 116.97 112.01 2gfn h TYR 112 Ca -0.00 0.03 -0.05 0.00 2.00 0.00 0.00 58.73 60.71 2gfn h TYR 112 Cb 0.90 0.30 -0.03 0.00 2.00 0.00 0.00 36.73 39.91 2gfn h TYR 112 CO 0.00 -0.33 0.19 0.00 -0.00 0.00 0.00 178.16 178.02 2gfn h ALA 113 N 0.58 1.21 0.62 3.88 0.00 -1.39 -2.81 119.26 121.36 2gfn h ALA 113 Ca 0.09 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 2gfn h ALA 113 Cb 0.46 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2gfn h ALA 113 CO -0.28 0.56 -0.33 1.49 0.00 0.00 0.00 179.25 180.69 2gfn h GLU 114 N 0.87 -0.85 -7.28 0.00 4.81 -1.34 -3.52 114.58 107.28 2gfn h GLU 114 Ca 0.20 0.06 -0.51 0.00 -0.13 0.00 0.00 59.36 58.98 2gfn h GLU 114 Cb 0.25 0.19 0.18 0.00 0.63 0.00 0.00 28.75 30.00 2gfn h GLU 114 CO -0.01 -0.57 0.24 0.20 -0.73 0.00 0.00 179.01 178.14 2gfn s GLY 115 N -2.09 1.67 -0.29 1.92 0.00 -0.58 -5.11 107.32 102.83 2gfn s GLY 115 Ca -0.17 0.40 -0.12 0.00 0.00 0.00 0.00 44.72 44.82 2gfn s GLY 115 CO 0.62 0.83 0.25 -1.08 0.00 0.00 0.00 173.10 173.72 2gfn s THR 120 N -2.73 5.27 -0.53 0.90 -1.32 -1.26 -5.07 115.64 110.90 2gfn s THR 120 Ca 0.65 0.19 -0.07 0.00 -1.21 0.00 0.00 61.69 61.25 2gfn s THR 120 Cb -0.21 -3.62 -0.21 0.00 -1.51 0.00 0.00 72.50 66.96 2gfn s THR 120 CO 0.58 0.17 3.40 0.00 -2.21 0.00 0.00 174.62 176.56 2gfn n ALA 121 N 5.15 6.77 0.64 11.08 0.00 -1.26 -4.76 120.51 138.14 2gfn n ALA 121 Ca -0.12 -2.40 0.12 0.00 0.00 0.00 0.00 53.44 51.04 2gfn n ALA 121 Cb 0.51 -2.66 0.28 0.00 0.00 0.00 0.00 19.45 17.58 2gfn n ALA 121 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 2gfn n ARG 122 N 2.82 0.25 -0.19 0.00 -4.01 -1.26 -3.86 116.66 110.40 2gfn n ARG 122 Ca 0.55 0.12 -0.09 0.00 -1.04 0.00 0.00 57.85 57.38 2gfn n ARG 122 Cb 0.69 -1.70 0.01 0.00 -3.04 0.00 0.00 32.46 28.42 2gfn n ARG 122 CO 0.00 0.00 0.00 0.78 -3.04 0.00 0.00 177.63 175.37 2gfn h GLY 123 N 4.58 0.95 1.00 2.89 0.00 -1.99 -0.74 103.07 109.76 2gfn h GLY 123 Ca 0.00 -0.64 -0.03 0.00 0.00 0.00 0.00 47.33 46.66 2gfn h GLY 123 CO 0.00 0.59 0.25 0.83 0.00 0.00 0.00 176.54 178.21 2gfn h GLU 124 N 0.77 0.93 -0.04 4.80 4.39 -1.94 -1.53 114.58 121.95 2gfn h GLU 124 Ca 0.16 -0.17 -0.00 0.00 0.34 0.00 0.00 59.36 59.69 2gfn h GLU 124 Cb 0.41 -0.15 -0.00 0.00 -0.10 0.00 0.00 28.75 28.91 2gfn h GLU 124 CO 0.01 0.78 0.02 0.82 -1.16 0.00 0.00 179.01 179.49 2gfn h ILE 125 N 0.87 1.09 -0.58 3.13 2.04 -1.64 -0.80 117.51 121.62 2gfn h ILE 125 Ca 0.21 -0.26 0.07 0.00 1.00 0.00 0.00 64.86 65.88 2gfn h ILE 125 Cb 0.20 1.18 -0.06 0.00 -0.74 0.00 0.00 36.82 37.40 2gfn h ILE 125 CO -0.02 0.07 0.25 0.00 0.00 0.00 0.00 178.15 178.46 2gfn h ALA 126 N 0.92 0.74 -0.83 1.87 0.00 -1.08 -0.73 119.26 120.15 2gfn h ALA 126 Ca 0.02 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 2gfn h ALA 126 Cb 0.10 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 2gfn h ALA 126 CO -0.00 -0.13 0.47 0.00 0.00 0.00 0.00 179.25 179.59 2gfn h ALA 127 N 1.36 1.06 -0.11 0.00 0.00 -1.11 0.65 119.26 121.12 2gfn h ALA 127 Ca 0.28 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 2gfn h ALA 127 Cb 0.27 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 2gfn h ALA 127 CO -0.24 0.56 0.03 0.35 0.00 0.00 0.00 179.25 179.95 2gfn h PHE 128 N 1.15 0.17 -0.73 0.00 3.57 -0.41 -1.89 116.94 118.81 2gfn h PHE 128 Ca 0.29 -0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.74 2gfn h PHE 128 Cb 0.01 -0.05 -0.03 0.00 2.79 0.00 0.00 35.95 38.66 2gfn h PHE 128 CO 0.00 0.31 0.33 -0.07 -2.23 0.00 0.00 178.31 176.65 2gfn h LEU 129 N -0.02 0.97 -0.62 0.59 3.38 -1.02 -2.34 115.31 116.26 2gfn h LEU 129 Ca 0.03 -0.15 -0.15 0.00 0.09 0.00 0.00 57.88 57.71 2gfn h LEU 129 Cb 0.22 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 2gfn h LEU 129 CO -0.00 0.85 -0.51 0.00 0.09 0.00 0.00 178.44 178.86 2gfn h ALA 130 N 1.16 0.80 -0.04 1.53 0.00 -0.71 0.09 119.26 122.08 2gfn h ALA 130 Ca 0.25 -0.49 -0.15 0.00 0.00 0.00 0.00 54.91 54.51 2gfn h ALA 130 Cb 0.15 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2gfn h ALA 130 CO -0.03 0.68 -0.66 0.00 0.00 0.00 0.00 179.25 179.24 2gfn h ARG 131 N 0.37 0.19 0.03 0.00 3.08 -1.27 -0.18 114.38 116.60 2gfn h ARG 131 Ca 0.01 -0.14 -0.00 0.00 0.07 0.00 0.00 59.98 59.92 2gfn h ARG 131 Cb 1.03 0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.10 2gfn h ARG 131 CO 0.09 0.78 -0.02 2.35 -1.07 0.00 0.00 179.97 182.11 2gfn h TRP 132 N 0.13 -0.04 -0.77 3.04 7.01 -1.19 -2.43 115.95 121.71 2gfn h TRP 132 Ca -0.01 -0.00 0.05 0.00 2.11 0.00 0.00 58.89 61.04 2gfn h TRP 132 Cb 1.19 0.01 -0.05 0.00 -2.10 0.00 0.00 29.16 28.21 2gfn h TRP 132 CO 0.02 0.48 0.50 0.00 -2.79 0.00 0.00 178.44 176.65 2gfn h ARG 133 N -0.59 0.84 -0.31 2.65 3.08 -0.97 -2.32 114.38 116.76 2gfn h ARG 133 Ca -0.00 -0.05 0.04 0.00 0.07 0.00 0.00 59.98 60.03 2gfn h ARG 133 Cb 0.54 -0.19 -0.03 0.00 0.08 0.00 0.00 29.97 30.36 2gfn h ARG 133 CO 0.01 0.55 0.10 0.78 -1.07 0.00 0.00 179.97 180.34 2gfn h GLY 134 N 0.86 0.39 1.68 0.04 0.00 -0.91 0.35 103.07 105.48 2gfn h GLY 134 Ca 0.32 -0.06 -0.21 0.00 0.00 0.00 0.00 47.33 47.39 2gfn h GLY 134 CO -0.11 0.02 -0.90 -0.39 0.00 0.00 0.00 176.54 175.17 2gfn h VAL 135 N 0.23 1.45 0.11 4.60 -1.51 -1.20 -2.49 116.25 117.45 2gfn h VAL 135 Ca 0.14 -2.53 -0.01 0.00 -1.23 0.00 0.00 66.70 63.07 2gfn h VAL 135 Cb 0.12 2.43 0.00 0.00 -2.13 0.00 0.00 31.29 31.71 2gfn h VAL 135 CO -0.15 0.75 -0.05 0.58 -1.23 0.00 0.00 177.57 177.46 2gfn h VAL 136 N 0.16 1.00 -0.49 7.19 2.07 -1.22 -2.90 116.25 122.06 2gfn h VAL 136 Ca -0.06 -0.42 0.07 0.00 0.82 0.00 0.00 66.70 67.12 2gfn h VAL 136 Cb 1.53 1.27 -0.06 0.00 -1.52 0.00 0.00 31.29 32.50 2gfn h VAL 136 CO 0.14 0.10 0.14 -0.09 0.02 0.00 0.00 177.57 177.89 2gfn h ARG 137 N -0.34 0.29 -0.76 1.57 2.43 -0.25 -0.07 114.38 117.26 2gfn h ARG 137 Ca -0.01 -0.02 0.13 0.00 -0.81 0.00 0.00 59.98 59.27 2gfn h ARG 137 Cb 0.28 -0.07 -0.09 0.00 -0.42 0.00 0.00 29.97 29.67 2gfn h ARG 137 CO 0.02 0.19 0.34 0.93 -1.51 0.00 0.00 179.97 179.94 2gfn h GLU 138 N 0.30 0.50 0.00 0.20 5.08 -1.45 -0.16 114.58 119.05 2gfn h GLU 138 Ca 0.24 -0.03 -0.17 0.00 -1.00 0.00 0.00 59.36 58.40 2gfn h GLU 138 Cb 0.28 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.40 2gfn h GLU 138 CO -0.27 0.33 -0.81 0.77 -1.00 0.00 0.00 179.01 178.03 2gfn h SER 139 N 0.52 0.00 -0.18 1.42 0.02 -1.12 0.49 113.55 114.70 2gfn h SER 139 Ca 0.40 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.33 2gfn h SER 139 Cb 0.56 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.09 2gfn h SER 139 CO -0.36 0.81 0.03 0.58 -1.14 0.00 0.00 176.83 176.75 2gfn h VAL 140 N 0.00 1.22 -0.74 2.27 2.07 -0.51 -0.13 116.25 120.43 2gfn h VAL 140 Ca -0.01 -0.72 -0.04 0.00 0.82 0.00 0.00 66.70 66.76 2gfn h VAL 140 Cb 1.52 1.36 -0.03 0.00 -1.52 0.00 0.00 31.29 32.62 2gfn h VAL 140 CO 0.11 0.22 0.31 0.58 0.02 0.00 0.00 177.57 178.81 2gfn h VAL 141 N 0.08 1.25 -0.62 2.57 2.07 -0.95 -0.05 116.25 120.60 2gfn h VAL 141 Ca 0.05 -0.76 -0.01 0.00 0.82 0.00 0.00 66.70 66.80 2gfn h VAL 141 Cb 0.31 0.37 -0.03 0.00 -1.52 0.00 0.00 31.29 30.41 2gfn h VAL 141 CO 0.00 0.31 0.36 0.00 0.02 0.00 0.00 177.57 178.26 2gfn h ALA 142 N 1.16 0.80 -0.59 1.67 0.00 -0.76 0.38 119.26 121.91 2gfn h ALA 142 Ca 0.25 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.99 2gfn h ALA 142 Cb 0.19 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 2gfn h ALA 142 CO -0.02 0.30 0.07 0.00 0.00 0.00 0.00 179.25 179.59 2gfn h ALA 143 N 1.17 1.02 -0.39 0.00 0.00 -0.49 -0.67 119.26 119.90 2gfn h ALA 143 Ca 0.22 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 2gfn h ALA 143 Cb 0.02 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 2gfn h ALA 143 CO -0.04 0.62 0.22 1.96 0.00 0.00 0.00 179.25 182.01 2gfn h GLN 144 N 0.90 0.54 -0.62 0.00 4.20 -0.67 -1.03 115.11 118.43 2gfn h GLN 144 Ca 0.18 -0.06 0.01 0.00 0.06 0.00 0.00 58.65 58.84 2gfn h GLN 144 Cb 0.43 -0.11 -0.03 0.00 0.30 0.00 0.00 27.48 28.07 2gfn h GLN 144 CO 0.01 0.43 0.41 0.00 -0.67 0.00 0.00 178.83 179.02 2gfn h ARG 145 N 0.51 0.81 0.00 1.46 3.08 -0.45 -0.15 114.38 119.64 2gfn h ARG 145 Ca 0.14 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.14 2gfn h ARG 145 Cb 0.04 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 29.91 2gfn h ARG 145 CO -0.02 0.54 0.00 0.39 -1.07 0.00 0.00 179.97 179.80 2gfn n GLU 146 N -4.44 0.18 -0.65 0.04 1.02 -0.30 -4.92 120.64 111.57 2gfn n GLU 146 Ca 0.06 0.28 0.00 0.00 -0.02 0.00 0.00 57.16 57.48 2gfn n GLU 146 Cb 0.05 -1.77 0.00 0.00 -0.02 0.00 0.00 31.44 29.70 2gfn n GLU 146 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2gfn n GLY 147 N 0.70 0.71 0.12 0.62 0.00 -0.07 -4.93 105.19 102.35 2gfn n GLY 147 Ca 0.04 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.09 2gfn n GLY 147 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2gfn h THR 148 N 0.00 0.57 -3.65 2.61 1.35 -1.46 -3.44 112.91 108.89 2gfn h THR 148 Ca 0.00 -1.91 -0.68 0.00 -0.55 0.00 0.00 66.41 63.27 2gfn h THR 148 Cb 0.00 2.14 -0.31 0.00 -1.73 0.00 0.00 68.15 68.26 2gfn h THR 148 CO 0.00 0.32 -0.85 -0.69 -0.25 0.00 0.00 175.52 174.05 2gfn s VAL 149 N -3.01 2.30 0.16 6.82 1.01 -1.09 -4.97 120.40 121.61 2gfn s VAL 149 Ca 0.01 -0.95 -0.34 0.00 0.00 0.00 0.00 61.98 60.70 2gfn s VAL 149 Cb 0.08 -1.88 -0.15 0.00 0.00 0.00 0.00 36.38 34.43 2gfn s VAL 149 CO 0.77 0.56 1.40 -0.24 0.00 0.00 0.00 175.10 177.59 2gfn n SER 150 N 3.21 2.28 0.00 3.32 2.88 -1.26 -4.18 113.62 119.88 2gfn n SER 150 Ca -0.18 1.12 0.15 0.00 -1.33 0.00 0.00 58.87 58.62 2gfn n SER 150 Cb 0.52 -1.32 0.83 0.00 -0.75 0.00 0.00 64.21 63.50 2gfn n SER 150 CO 0.00 0.00 0.00 1.07 -1.23 0.00 0.00 175.04 174.88 2gfn n THR 151 N 2.52 0.02 0.35 2.46 5.66 -1.26 -2.20 114.28 121.83 2gfn n THR 151 Ca 0.16 0.01 0.13 0.00 -3.05 0.00 0.00 64.05 61.29 2gfn n THR 151 Cb 0.26 -0.54 0.29 0.00 -1.55 0.00 0.00 70.33 68.79 2gfn n THR 151 CO 0.00 0.00 0.00 0.44 -3.05 0.00 0.00 175.07 172.46 2gfn h ASP 152 N 0.00 0.00 -3.71 1.09 3.32 -2.01 -3.45 116.42 111.66 2gfn h ASP 152 Ca 0.00 0.00 -0.50 0.00 0.02 0.00 0.00 57.03 56.55 2gfn h ASP 152 Cb 0.08 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.62 2gfn h ASP 152 CO 0.00 0.00 0.37 -0.76 -1.72 0.00 0.00 179.24 177.13 2gfn s LEU 153 N -5.66 4.60 -0.23 1.55 1.43 -0.93 -5.02 118.68 114.42 2gfn s LEU 153 Ca 0.08 1.94 -0.29 0.00 -1.03 0.00 0.00 54.13 54.83 2gfn s LEU 153 Cb 0.08 -3.61 -0.00 0.00 0.03 0.00 0.00 46.19 42.69 2gfn s LEU 153 CO 0.63 0.08 1.22 -0.62 0.23 0.00 0.00 176.35 177.89 2gfn s ASP 154 N -0.87 6.88 0.49 2.29 -1.08 -1.26 -4.93 116.67 118.19 2gfn s ASP 154 Ca 0.43 1.43 0.16 0.00 -0.52 0.00 0.00 52.55 54.05 2gfn s ASP 154 Cb -0.26 -2.54 1.16 0.00 -1.46 0.00 0.00 42.92 39.82 2gfn s ASP 154 CO 0.32 -0.86 2.08 0.00 0.52 0.00 0.00 175.17 177.23 2gfn h ALA 155 N 8.40 1.82 -0.42 3.66 0.00 -1.95 -1.33 119.26 129.45 2gfn h ALA 155 Ca -0.25 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.53 2gfn h ALA 155 Cb 1.09 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.85 2gfn h ALA 155 CO 1.00 0.11 0.06 -0.44 0.00 0.00 0.00 179.25 179.98 2gfn h ASP 156 N 0.00 0.67 -0.31 0.00 3.32 -1.96 -1.72 116.42 116.43 2gfn h ASP 156 Ca -0.00 -0.27 -0.14 0.00 0.02 0.00 0.00 57.03 56.64 2gfn h ASP 156 Cb 0.16 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 2gfn h ASP 156 CO 0.01 0.77 -0.32 0.00 -1.72 0.00 0.00 179.24 177.99 2gfn h ALA 157 N 0.93 0.73 -0.42 3.45 0.00 -1.81 -2.01 119.26 120.13 2gfn h ALA 157 Ca 0.13 -0.42 -0.00 0.00 0.00 0.00 0.00 54.91 54.61 2gfn h ALA 157 Cb 0.39 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 2gfn h ALA 157 CO 0.01 0.66 0.25 0.28 0.00 0.00 0.00 179.25 180.45 2gfn h VAL 158 N 0.70 1.13 -0.20 0.00 2.07 -1.20 -1.04 116.25 117.71 2gfn h VAL 158 Ca 0.07 -0.30 -0.02 0.00 0.82 0.00 0.00 66.70 67.28 2gfn h VAL 158 Cb 0.87 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 31.21 2gfn h VAL 158 CO 0.08 0.13 0.06 0.74 0.02 0.00 0.00 177.57 178.60 2gfn h THR 159 N 0.55 1.19 -0.74 2.57 2.02 -1.27 0.11 112.91 117.35 2gfn h THR 159 Ca 0.15 -0.59 0.01 0.00 0.77 0.00 0.00 66.41 66.74 2gfn h THR 159 Cb -0.01 1.20 -0.04 0.00 -1.74 0.00 0.00 68.15 67.57 2gfn h THR 159 CO -0.03 0.19 0.48 0.58 0.37 0.00 0.00 175.52 177.11 2gfn h VAL 160 N 0.15 1.19 -0.26 3.16 2.07 -1.24 -1.11 116.25 120.22 2gfn h VAL 160 Ca 0.07 -0.36 -0.02 0.00 0.82 0.00 0.00 66.70 67.21 2gfn h VAL 160 Cb 0.23 0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.11 2gfn h VAL 160 CO -0.00 0.19 0.10 0.00 0.02 0.00 0.00 177.57 177.88 2gfn h ALA 161 N 1.26 0.34 -0.44 1.67 0.00 -0.80 -1.34 119.26 119.95 2gfn h ALA 161 Ca 0.27 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 2gfn h ALA 161 Cb -0.10 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 2gfn h ALA 161 CO -0.06 -0.06 0.08 1.25 0.00 0.00 0.00 179.25 180.46 2gfn h LEU 162 N 0.27 0.69 -0.60 0.00 5.85 -0.38 -0.91 115.31 120.22 2gfn h LEU 162 Ca 0.09 -0.26 -0.06 0.00 0.84 0.00 0.00 57.88 58.49 2gfn h LEU 162 Cb 0.19 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.02 2gfn h LEU 162 CO -0.01 0.77 0.13 0.58 -0.34 0.00 0.00 178.44 179.57 2gfn h VAL 163 N 0.58 1.25 -0.38 1.05 2.07 -1.22 -0.07 116.25 119.54 2gfn h VAL 163 Ca 0.13 -0.95 -0.07 0.00 0.82 0.00 0.00 66.70 66.63 2gfn h VAL 163 Cb 0.37 0.71 -0.01 0.00 -1.52 0.00 0.00 31.29 30.84 2gfn h VAL 163 CO 0.01 0.35 -0.05 0.00 0.02 0.00 0.00 177.57 177.90 2gfn h ALA 164 N 1.03 0.51 -0.33 1.67 0.00 -1.04 -0.97 119.26 120.13 2gfn h ALA 164 Ca 0.19 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 2gfn h ALA 164 Cb 0.38 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 2gfn h ALA 164 CO 0.01 0.34 0.16 1.25 0.00 0.00 0.00 179.25 181.00 2gfn h LEU 165 N 0.51 0.44 -0.53 0.00 5.85 -0.99 -0.02 115.31 120.56 2gfn h LEU 165 Ca 0.10 -0.13 -0.04 0.00 0.84 0.00 0.00 57.88 58.65 2gfn h LEU 165 Cb 0.55 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.44 2gfn h LEU 165 CO 0.03 0.45 0.18 0.74 -0.34 0.00 0.00 178.44 179.49 2gfn h THR 166 N 0.40 1.23 -0.24 1.05 2.02 -0.89 -0.78 112.91 115.71 2gfn h THR 166 Ca 0.11 -0.77 -0.17 0.00 0.77 0.00 0.00 66.41 66.36 2gfn h THR 166 Cb 0.13 0.73 0.00 0.00 -1.74 0.00 0.00 68.15 67.26 2gfn h THR 166 CO -0.01 0.29 -0.50 -0.78 0.37 0.00 0.00 175.52 174.88 2gfn h ASP 167 N 0.73 0.86 -0.74 4.18 3.58 -1.03 0.24 116.42 124.24 2gfn h ASP 167 Ca 0.17 -0.55 0.09 0.00 0.42 0.00 0.00 57.03 57.17 2gfn h ASP 167 Cb 0.26 -0.25 -0.07 0.00 1.72 0.00 0.00 39.33 40.99 2gfn h ASP 167 CO -0.01 1.25 0.39 1.23 -2.88 0.00 0.00 179.24 179.22 2gfn h GLY 168 N 0.51 1.12 0.83 -0.78 0.00 -0.82 -0.13 103.07 103.79 2gfn h GLY 168 Ca 0.01 -0.25 -0.04 0.00 0.00 0.00 0.00 47.33 47.04 2gfn h GLY 168 CO 0.11 0.09 -0.02 1.41 0.00 0.00 0.00 176.54 178.13 2gfn h LEU 169 N 0.66 0.40 -0.55 3.11 3.38 -0.88 -1.00 115.31 120.42 2gfn h LEU 169 Ca 0.36 -0.33 0.01 0.00 0.09 0.00 0.00 57.88 58.01 2gfn h LEU 169 Cb 0.35 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 2gfn h LEU 169 CO -0.25 0.63 0.36 0.00 0.09 0.00 0.00 178.44 179.27 2gfn h ALA 170 N 0.78 0.71 -0.12 1.53 0.00 -0.67 0.19 119.26 121.68 2gfn h ALA 170 Ca 0.06 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 2gfn h ALA 170 Cb 0.44 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2gfn h ALA 170 CO 0.02 0.12 -0.28 -0.07 0.00 0.00 0.00 179.25 179.03 2gfn h LEU 171 N 0.73 0.45 -1.22 0.00 3.38 -0.95 -3.00 115.31 114.70 2gfn h LEU 171 Ca 0.21 -0.58 -0.03 0.00 0.09 0.00 0.00 57.88 57.57 2gfn h LEU 171 Cb -0.06 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 2gfn h LEU 171 CO -0.06 0.94 0.18 1.56 0.09 0.00 0.00 178.44 181.16 2gfn h GLN 172 N -0.03 0.72 -0.08 1.13 4.20 -1.17 -2.92 115.11 116.97 2gfn h GLN 172 Ca -0.00 -0.11 -0.02 0.00 0.06 0.00 0.00 58.65 58.58 2gfn h GLN 172 Cb 0.88 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 28.53 2gfn h GLN 172 CO 0.06 0.61 -0.03 0.00 -0.67 0.00 0.00 178.83 178.80 2gfn h ALA 173 N 1.49 1.81 -0.00 3.87 0.00 -0.81 0.32 119.26 125.94 2gfn h ALA 173 Ca 0.17 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2gfn h ALA 173 Cb 0.17 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2gfn h ALA 173 CO -0.01 0.15 -0.10 0.44 0.00 0.00 0.00 179.25 179.73 2gfn n ILE 174 N -4.44 0.00 -0.05 0.00 -5.35 -1.10 -3.54 119.36 104.89 2gfn n ILE 174 Ca -0.02 -0.01 -0.02 0.00 -0.27 0.00 0.00 62.75 62.43 2gfn n ILE 174 Cb 0.15 -0.33 -0.10 0.00 -1.74 0.00 0.00 39.64 37.63 2gfn n ILE 174 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 2gfn n LEU 175 N -1.41 0.00 -3.65 7.28 4.77 -0.54 -4.99 117.00 118.45 2gfn n LEU 175 Ca 0.08 0.00 -0.27 0.00 -0.03 0.00 0.00 56.01 55.79 2gfn n LEU 175 Cb 0.32 0.22 -0.16 0.00 -2.33 0.00 0.00 43.42 41.46 2gfn n LEU 175 CO 0.28 0.22 -0.34 -0.62 -1.33 0.00 0.00 177.39 175.59 2gfn s ASP 176 N -4.24 2.85 0.61 -1.43 -1.08 0.10 -5.01 116.67 108.46 2gfn s ASP 176 Ca -0.06 -0.86 0.35 0.00 -0.52 0.00 0.00 52.55 51.46 2gfn s ASP 176 Cb 0.05 -0.43 1.97 0.00 -1.46 0.00 0.00 42.92 43.05 2gfn s ASP 176 CO 0.52 -0.35 2.26 1.55 0.52 0.00 0.00 175.17 179.68 2gfn h PRO 177 N 8.33 0.00 -0.42 4.34 0.13 -1.84 -1.37 132.00 141.16 2gfn h PRO 177 Ca -0.16 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 65.01 2gfn h PRO 177 Cb 1.11 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.20 2gfn h PRO 177 CO 0.34 0.02 0.20 0.28 -0.23 0.00 0.00 178.00 178.61 2gfn h VAL 178 N 0.00 0.95 0.00 1.56 2.07 -1.94 0.77 116.25 119.66 2gfn h VAL 178 Ca -0.00 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 67.38 2gfn h VAL 178 Cb 0.06 0.51 0.00 0.00 -1.52 0.00 0.00 31.29 30.35 2gfn h VAL 178 CO 0.00 0.07 0.00 0.52 0.02 0.00 0.00 177.57 178.19 2gfn n VAL 179 N -4.94 1.41 0.00 2.57 0.31 -0.52 -1.99 118.33 115.18 2gfn n VAL 179 Ca 0.02 -0.27 0.00 0.00 -0.01 0.00 0.00 64.34 64.08 2gfn n VAL 179 Cb 0.12 -1.25 0.00 0.00 -0.91 0.00 0.00 33.84 31.80 2gfn n VAL 179 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 2gfn n LYS 181 N 1.20 0.00 -0.14 5.55 4.81 0.26 -1.24 118.16 128.60 2gfn n LYS 181 Ca 0.00 0.00 -0.04 0.00 -0.87 0.00 0.00 58.31 57.40 2gfn n LYS 181 Cb 0.43 0.00 0.03 0.00 0.02 0.00 0.00 35.03 35.51 2gfn n LYS 181 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2gfn h ALA 182 N 0.00 0.34 0.00 3.14 0.00 -1.65 -2.36 119.26 118.73 2gfn h ALA 182 Ca 0.00 0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2gfn h ALA 182 Cb 0.00 0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2gfn h ALA 182 CO 0.00 -0.43 0.00 0.44 0.00 0.00 0.00 179.25 179.26 2gfn n ILE 183 N -5.29 0.15 1.20 0.00 -5.35 -0.37 -2.87 119.36 106.83 2gfn n ILE 183 Ca 0.04 0.01 0.14 0.00 -0.27 0.00 0.00 62.75 62.67 2gfn n ILE 183 Cb 0.24 -0.57 0.61 0.00 -1.74 0.00 0.00 39.64 38.19 2gfn n ILE 183 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 2gfn n SER 184 N -1.56 0.15 -4.77 7.28 7.64 -0.89 -4.74 113.62 116.73 2gfn n SER 184 Ca 0.06 0.01 -0.41 0.00 1.01 0.00 0.00 58.87 59.55 2gfn n SER 184 Cb 0.33 -0.26 -0.01 0.00 -1.01 0.00 0.00 64.21 63.25 2gfn n SER 184 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2gfn s ALA 185 N -2.77 3.55 0.40 -0.43 0.00 -1.14 -4.92 121.76 116.45 2gfn s ALA 185 Ca 0.21 1.40 0.15 0.00 0.00 0.00 0.00 51.96 53.72 2gfn s ALA 185 Cb 0.19 -3.54 1.01 0.00 0.00 0.00 0.00 23.12 20.78 2gfn s ALA 185 CO 0.52 -0.83 1.85 1.49 0.00 0.00 0.00 175.76 178.80 2gfn h GLU 186 N 3.39 0.47 -0.56 0.00 4.81 -1.91 -2.45 114.58 118.33 2gfn h GLU 186 Ca -0.49 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.71 2gfn h GLU 186 Cb 1.23 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 30.50 2gfn h GLU 186 CO 0.66 0.31 0.00 -0.40 -0.73 0.00 0.00 179.01 178.85 2gfn n ASP 187 N -4.54 3.05 -0.05 1.04 5.68 -1.26 -4.60 116.55 115.86 2gfn n ASP 187 Ca 0.19 -2.08 -0.09 0.00 -0.50 0.00 0.00 54.79 52.30 2gfn n ASP 187 Cb 0.64 -0.39 -0.02 0.00 -1.14 0.00 0.00 41.12 40.20 2gfn n ASP 187 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2gfn h ALA 188 N 3.91 0.28 -0.72 2.12 0.00 -1.73 0.54 119.26 123.66 2gfn h ALA 188 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 2gfn h ALA 188 Cb 0.82 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 2gfn h ALA 188 CO 0.05 -0.28 0.37 0.00 0.00 0.00 0.00 179.25 179.38 2gfn h ALA 189 N 1.11 0.93 -0.50 0.00 0.00 -1.84 -1.96 119.26 117.00 2gfn h ALA 189 Ca 0.09 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 2gfn h ALA 189 Cb 0.01 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 2gfn h ALA 189 CO -0.05 0.47 0.01 0.00 0.00 0.00 0.00 179.25 179.68 2gfn h ALA 190 N 1.18 1.09 -0.65 0.00 0.00 -1.72 -1.72 119.26 117.44 2gfn h ALA 190 Ca 0.25 -0.26 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 2gfn h ALA 190 Cb 0.08 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 2gfn h ALA 190 CO -0.04 0.58 0.14 0.00 0.00 0.00 0.00 179.25 179.93 2gfn h ARG 191 N 0.77 1.04 -0.04 0.00 3.08 -0.60 -1.15 114.38 117.48 2gfn h ARG 191 Ca 0.15 -0.25 -0.00 0.00 0.07 0.00 0.00 59.98 59.95 2gfn h ARG 191 Cb 0.45 -0.14 -0.00 0.00 0.08 0.00 0.00 29.97 30.36 2gfn h ARG 191 CO 0.02 0.94 0.02 0.00 -1.07 0.00 0.00 179.97 179.88 2gfn h VAL 193 N -0.05 1.09 -0.91 0.00 2.07 -1.24 -2.02 116.25 115.18 2gfn h VAL 193 Ca 0.01 -0.22 0.04 0.00 0.82 0.00 0.00 66.70 67.36 2gfn h VAL 193 Cb 0.12 0.89 -0.06 0.00 -1.52 0.00 0.00 31.29 30.72 2gfn h VAL 193 CO -0.00 0.08 0.58 0.44 0.02 0.00 0.00 177.57 178.69 2gfn h ASP 194 N 0.22 0.96 -0.74 0.57 3.32 -1.15 -1.18 116.42 118.43 2gfn h ASP 194 Ca 0.07 -0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.08 2gfn h ASP 194 Cb 0.03 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.34 2gfn h ASP 194 CO -0.01 0.65 0.33 0.00 -1.72 0.00 0.00 179.24 178.48 2gfn h ALA 195 N 1.39 1.16 -0.13 3.45 0.00 -0.87 0.16 119.26 124.41 2gfn h ALA 195 Ca 0.37 -0.17 -0.12 0.00 0.00 0.00 0.00 54.91 54.99 2gfn h ALA 195 Cb 0.05 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.54 2gfn h ALA 195 CO -0.13 0.62 -0.40 0.00 0.00 0.00 0.00 179.25 179.34 2gfn h ALA 196 N 1.28 0.22 -0.02 0.00 0.00 -0.59 -3.27 119.26 116.88 2gfn h ALA 196 Ca 0.26 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.71 2gfn h ALA 196 Cb 0.16 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2gfn h ALA 196 CO -0.03 0.32 -0.01 1.33 0.00 0.00 0.00 179.25 180.86 2gfn n VAL 197 N -4.31 0.00 -2.99 0.00 0.24 -0.54 -4.78 118.33 105.95 2gfn n VAL 197 Ca -0.07 -0.35 -0.04 0.00 -2.04 0.00 0.00 64.34 61.84 2gfn n VAL 197 Cb 0.54 0.91 0.02 0.00 -1.47 0.00 0.00 33.84 33.83 2gfn n VAL 197 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2gfn n ARG 198 N 0.62 -1.45 -0.05 7.34 5.12 -0.23 -4.67 116.66 123.35 2gfn n ARG 198 Ca 0.17 1.26 0.00 0.00 -1.93 0.00 0.00 57.85 57.34 2gfn n ARG 198 Cb 0.45 -5.47 0.00 0.00 -1.16 0.00 0.00 32.46 26.29 2gfn n ARG 198 CO 0.00 0.00 0.00 -2.13 -1.93 0.00 0.00 177.63 173.57