#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g7f n HIS 3 N 0.00 2.91 0.00 -0.72 8.25 -1.26 -2.65 115.22 121.75 3g7f n HIS 3 Ca 0.00 0.41 0.00 0.00 -0.26 0.00 0.00 57.72 57.87 3g7f n HIS 3 Cb 0.00 -2.54 0.00 0.00 1.12 0.00 0.00 29.99 28.57 3g7f n HIS 3 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3g7f n GLY 4 N 0.85 2.94 3.73 -1.41 0.00 -1.26 -4.99 105.19 105.06 3g7f n GLY 4 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 3g7f n GLY 4 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g7f s ALA 5 N -2.89 3.39 0.39 4.61 0.00 -1.09 -0.72 121.76 125.45 3g7f s ALA 5 Ca 0.00 0.85 0.07 0.00 0.00 0.00 0.00 51.96 52.89 3g7f s ALA 5 Cb 0.00 -3.39 -0.08 0.00 0.00 0.00 0.00 23.12 19.65 3g7f s ALA 5 CO 0.00 -0.31 -0.01 -0.51 0.00 0.00 0.00 175.76 174.93 3g7f s LEU 6 N 0.05 2.82 0.61 0.00 1.43 -0.12 -4.93 118.68 118.54 3g7f s LEU 6 Ca 0.53 -1.33 -0.18 0.00 -1.03 0.00 0.00 54.13 52.11 3g7f s LEU 6 Cb -0.30 -0.89 -0.05 0.00 0.03 0.00 0.00 46.19 44.97 3g7f s LEU 6 CO 0.34 -0.41 0.88 0.00 0.23 0.00 0.00 176.35 177.39 3g7f n ALA 7 N -0.92 -0.10 -1.19 4.21 0.00 -1.26 -3.67 120.51 117.59 3g7f n ALA 7 Ca -0.05 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.38 3g7f n ALA 7 Cb 0.66 -2.06 0.00 0.00 0.00 0.00 0.00 19.45 18.06 3g7f n ALA 7 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3g7f n GLN 8 N -0.92 0.00 -2.35 0.00 6.02 -1.26 -3.13 117.38 115.74 3g7f n GLN 8 Ca 0.14 0.38 -0.12 0.00 -0.01 0.00 0.00 57.00 57.39 3g7f n GLN 8 Cb 0.48 -3.81 -0.01 0.00 1.02 0.00 0.00 30.24 27.92 3g7f n GLN 8 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 3g7f n HIS 9 N -3.18 -1.33 -2.37 1.08 8.25 -1.24 -5.01 115.22 111.41 3g7f n HIS 9 Ca 0.00 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.17 3g7f n HIS 9 Cb 0.11 -2.75 0.00 0.00 1.12 0.00 0.00 29.99 28.47 3g7f n HIS 9 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3g7f s LEU 10 N -5.46 3.50 0.10 2.41 1.43 -1.18 -4.98 118.68 114.50 3g7f s LEU 10 Ca 0.00 1.13 -0.03 0.00 -1.03 0.00 0.00 54.13 54.20 3g7f s LEU 10 Cb 0.00 -4.11 -0.03 0.00 0.03 0.00 0.00 46.19 42.08 3g7f s LEU 10 CO 0.00 -0.67 0.06 1.51 0.23 0.00 0.00 176.35 177.48 3g7f s ASP 11 N -4.05 0.33 0.10 2.29 1.47 -1.26 -0.94 116.67 114.61 3g7f s ASP 11 Ca 0.51 -1.02 -0.24 0.00 1.18 0.00 0.00 52.55 52.98 3g7f s ASP 11 Cb -0.11 0.28 -0.11 0.00 -0.34 0.00 0.00 42.92 42.65 3g7f s ASP 11 CO 0.47 -0.69 1.70 0.40 0.68 0.00 0.00 175.17 177.73 3g7f h ILE 12 N 2.93 0.78 -0.90 2.11 2.04 -1.28 -2.48 117.51 120.72 3g7f h ILE 12 Ca -0.34 0.00 0.11 0.00 1.00 0.00 0.00 64.86 65.63 3g7f h ILE 12 Cb 1.18 0.78 -0.08 0.00 -0.74 0.00 0.00 36.82 37.96 3g7f h ILE 12 CO 0.60 0.00 0.53 0.00 0.00 0.00 0.00 178.15 179.28 3g7f h ALA 13 N 0.79 1.31 -0.93 1.87 0.00 -1.99 -0.01 119.26 120.31 3g7f h ALA 13 Ca 0.02 0.03 0.06 0.00 0.00 0.00 0.00 54.91 55.03 3g7f h ALA 13 Cb 0.19 -0.15 -0.06 0.00 0.00 0.00 0.00 17.79 17.77 3g7f h ALA 13 CO -0.07 0.13 0.59 0.37 0.00 0.00 0.00 179.25 180.27 3g7f h GLN 14 N 0.86 1.05 -0.42 0.00 4.15 -1.88 0.57 115.11 119.43 3g7f h GLN 14 Ca 0.44 -0.06 -0.13 0.00 0.77 0.00 0.00 58.65 59.67 3g7f h GLN 14 Cb 0.43 -0.24 -0.01 0.00 0.21 0.00 0.00 27.48 27.87 3g7f h GLN 14 CO -0.26 0.69 -0.24 -0.07 -1.93 0.00 0.00 178.83 177.02 3g7f h LEU 15 N 1.08 0.89 -1.20 -2.39 3.38 -0.62 -3.00 115.31 113.45 3g7f h LEU 15 Ca 0.40 -0.34 -0.08 0.00 0.09 0.00 0.00 57.88 57.95 3g7f h LEU 15 Cb 0.16 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 3g7f h LEU 15 CO -0.17 1.09 -0.39 0.58 0.09 0.00 0.00 178.44 179.64 3g7f h VAL 16 N 0.75 1.21 -0.01 1.22 2.07 -0.37 -1.06 116.25 120.05 3g7f h VAL 16 Ca 0.10 -1.36 0.02 0.00 0.82 0.00 0.00 66.70 66.27 3g7f h VAL 16 Cb 0.79 1.75 -0.02 0.00 -1.52 0.00 0.00 31.29 32.28 3g7f h VAL 16 CO 0.07 0.38 -0.08 -0.25 0.02 0.00 0.00 177.57 177.70 3g7f h TRP 17 N 0.00 -0.21 -0.59 1.57 2.91 -0.77 0.75 115.95 119.61 3g7f h TRP 17 Ca -0.00 0.01 -0.03 0.00 1.13 0.00 0.00 58.89 60.00 3g7f h TRP 17 Cb 0.72 0.10 -0.03 0.00 -0.51 0.00 0.00 29.16 29.44 3g7f h TRP 17 CO 0.00 -0.13 0.27 1.88 -1.03 0.00 0.00 178.44 179.43 3g7f h TYR 18 N -0.14 0.87 -0.59 2.65 0.05 -1.44 -2.55 116.97 115.81 3g7f h TYR 18 Ca 0.04 -0.05 -0.01 0.00 0.05 0.00 0.00 58.73 58.76 3g7f h TYR 18 Cb 0.19 -0.27 -0.03 0.00 1.01 0.00 0.00 36.73 37.63 3g7f h TYR 18 CO -0.16 0.67 0.34 0.00 -1.05 0.00 0.00 178.16 177.96 3g7f h ALA 19 N 1.11 1.48 -0.06 3.88 0.00 -0.94 -1.16 119.26 123.56 3g7f h ALA 19 Ca 0.20 -0.08 -0.17 0.00 0.00 0.00 0.00 54.91 54.86 3g7f h ALA 19 Cb 0.14 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 17.70 3g7f h ALA 19 CO -0.02 0.44 -0.62 0.37 0.00 0.00 0.00 179.25 179.42 3g7f h GLN 20 N 0.82 0.53 -0.24 0.00 5.75 -0.61 -1.24 115.11 120.12 3g7f h GLN 20 Ca 0.21 -0.49 -0.02 0.00 -0.15 0.00 0.00 58.65 58.21 3g7f h GLN 20 Cb 0.00 0.12 -0.01 0.00 1.07 0.00 0.00 27.48 28.66 3g7f h GLN 20 CO -0.04 1.12 0.08 -1.49 -2.65 0.00 0.00 178.83 175.85 3g7f h TRP 21 N 0.11 0.33 -0.24 3.99 4.06 -1.33 -0.59 115.95 122.28 3g7f h TRP 21 Ca -0.06 -0.01 -0.09 0.00 2.06 0.00 0.00 58.89 60.80 3g7f h TRP 21 Cb 1.29 -0.11 -0.00 0.00 -1.00 0.00 0.00 29.16 29.34 3g7f h TRP 21 CO 0.12 0.28 -0.19 1.25 -3.56 0.00 0.00 178.44 176.34 3g7f h LEU 22 N 0.34 0.59 -0.02 -4.49 5.85 -0.86 0.28 115.31 117.00 3g7f h LEU 22 Ca 0.08 -0.45 0.01 0.00 0.84 0.00 0.00 57.88 58.36 3g7f h LEU 22 Cb 0.10 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 40.96 3g7f h LEU 22 CO -0.01 0.91 -0.02 0.58 -0.34 0.00 0.00 178.44 179.57 3g7f h VAL 23 N 0.27 0.95 -0.13 1.05 2.07 -1.00 -1.03 116.25 118.43 3g7f h VAL 23 Ca 0.05 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.60 3g7f h VAL 23 Cb 0.72 0.95 -0.03 0.00 -1.52 0.00 0.00 31.29 31.41 3g7f h VAL 23 CO 0.05 0.00 -0.08 0.40 0.02 0.00 0.00 177.57 177.96 3g7f h ILE 24 N -0.02 0.76 -0.69 4.57 2.04 -1.05 -0.63 117.51 122.49 3g7f h ILE 24 Ca 0.01 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.83 3g7f h ILE 24 Cb 0.04 0.76 -0.03 0.00 -0.74 0.00 0.00 36.82 36.85 3g7f h ILE 24 CO -0.03 0.00 0.26 -0.50 0.00 0.00 0.00 178.15 177.88 3g7f h TRP 25 N -0.07 1.06 0.05 1.37 -0.00 -0.87 0.02 115.95 117.50 3g7f h TRP 25 Ca 0.08 -0.09 0.01 0.00 -0.00 0.00 0.00 58.89 58.89 3g7f h TRP 25 Cb 0.19 -0.32 -0.01 0.00 -0.00 0.00 0.00 29.16 29.02 3g7f h TRP 25 CO -0.21 0.83 -0.07 1.15 -0.00 0.00 0.00 178.44 180.14 3g7f h THR 26 N 0.98 0.84 -0.21 1.49 2.02 -0.96 0.20 112.91 117.27 3g7f h THR 26 Ca 0.23 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.39 3g7f h THR 26 Cb 0.23 0.84 -0.01 0.00 -1.74 0.00 0.00 68.15 67.46 3g7f h THR 26 CO -0.02 0.00 0.04 0.58 0.37 0.00 0.00 175.52 176.50 3g7f h VAL 27 N -0.14 1.21 0.52 3.16 2.07 -1.02 0.13 116.25 122.17 3g7f h VAL 27 Ca 0.01 -0.70 -0.03 0.00 0.82 0.00 0.00 66.70 66.81 3g7f h VAL 27 Cb 0.15 1.29 0.01 0.00 -1.52 0.00 0.00 31.29 31.21 3g7f h VAL 27 CO -0.04 0.22 -0.25 0.58 0.02 0.00 0.00 177.57 178.10 3g7f h VAL 28 N 0.14 0.45 0.01 2.57 2.07 -0.88 0.13 116.25 120.75 3g7f h VAL 28 Ca 0.06 -0.23 -0.00 0.00 0.82 0.00 0.00 66.70 67.35 3g7f h VAL 28 Cb 0.29 0.55 0.00 0.00 -1.52 0.00 0.00 31.29 30.61 3g7f h VAL 28 CO 0.00 0.04 -0.01 -0.07 0.02 0.00 0.00 177.57 177.55 3g7f h LEU 29 N -0.84 -0.02 0.00 2.57 3.38 -0.66 -0.36 115.31 119.38 3g7f h LEU 29 Ca -0.07 -0.78 -0.20 0.00 0.09 0.00 0.00 57.88 56.92 3g7f h LEU 29 Cb 0.59 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.32 3g7f h LEU 29 CO 0.12 0.81 -1.02 -0.07 0.09 0.00 0.00 178.44 178.36 3g7f h LEU 30 N -0.89 0.00 0.00 1.67 3.38 -0.86 -3.36 115.31 115.25 3g7f h LEU 30 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3g7f h LEU 30 Cb 0.79 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.54 3g7f h LEU 30 CO 0.00 0.88 -0.25 0.00 0.09 0.00 0.00 178.44 179.17 3g7f n TYR 31 N -3.26 0.00 0.06 1.13 9.36 -0.86 -4.49 117.16 119.11 3g7f n TYR 31 Ca -0.02 0.00 -0.12 0.00 3.32 0.00 0.00 57.90 61.07 3g7f n TYR 31 Cb 0.91 -0.12 -0.07 0.00 -0.63 0.00 0.00 39.34 39.43 3g7f n TYR 31 CO 0.00 0.00 0.00 -0.07 0.22 0.00 0.00 176.86 177.01 3g7f h LEU 32 N -0.25 -0.09 -2.20 2.98 3.38 -0.66 -1.40 115.31 117.08 3g7f h LEU 32 Ca 0.00 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 3g7f h LEU 32 Cb 0.25 0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.03 3g7f h LEU 32 CO 0.00 -0.06 -0.05 0.03 0.09 0.00 0.00 178.44 178.45 3g7f h ARG 33 N -0.09 0.00 0.19 1.13 2.47 -1.20 0.28 114.38 117.16 3g7f h ARG 33 Ca -0.00 0.00 -0.32 0.00 -1.26 0.00 0.00 59.98 58.40 3g7f h ARG 33 Cb 0.08 0.00 0.02 0.00 -1.65 0.00 0.00 29.97 28.42 3g7f h ARG 33 CO -0.00 0.05 -1.47 0.00 0.56 0.00 0.00 179.97 179.11 3g7f h ARG 34 N 0.00 0.40 -0.72 0.04 3.08 -1.60 -3.26 114.38 112.33 3g7f h ARG 34 Ca -0.00 -0.69 0.01 0.00 0.07 0.00 0.00 59.98 59.37 3g7f h ARG 34 Cb 0.24 0.26 -0.04 0.00 0.08 0.00 0.00 29.97 30.51 3g7f h ARG 34 CO 0.01 1.31 0.47 0.93 -1.07 0.00 0.00 179.97 181.62 3g7f h GLU 35 N 0.11 0.94 0.00 0.04 4.39 0.06 -1.07 114.58 119.04 3g7f h GLU 35 Ca -0.23 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.41 3g7f h GLU 35 Cb 2.09 -0.21 0.00 0.00 -0.10 0.00 0.00 28.75 30.52 3g7f h GLU 35 CO 0.23 0.62 0.10 -0.25 -1.16 0.00 0.00 179.01 178.55 3g7f n ASP 36 N -4.43 0.13 -0.76 1.42 8.00 0.80 -2.47 116.55 119.25 3g7f n ASP 36 Ca 0.08 0.48 0.07 0.00 0.71 0.00 0.00 54.79 56.13 3g7f n ASP 36 Cb 0.04 -0.49 0.22 0.00 -0.02 0.00 0.00 41.12 40.88 3g7f n ASP 36 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3g7f n ARG 37 N -1.62 2.38 0.00 -1.24 1.74 -0.40 -4.45 116.66 113.06 3g7f n ARG 37 Ca -0.00 -2.85 0.14 0.00 -0.77 0.00 0.00 57.85 54.36 3g7f n ARG 37 Cb 0.11 -1.77 0.69 0.00 -1.02 0.00 0.00 32.46 30.47 3g7f n ARG 37 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3g7f n ARG 38 N -0.82 0.34 -4.59 5.56 1.74 -1.03 -4.52 116.66 113.34 3g7f n ARG 38 Ca 0.22 0.02 -0.22 0.00 -0.77 0.00 0.00 57.85 57.10 3g7f n ARG 38 Cb 0.86 -1.50 -0.15 0.00 -1.02 0.00 0.00 32.46 30.65 3g7f n ARG 38 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 3g7f s GLU 39 N -2.63 1.13 0.00 5.56 0.41 -1.26 -3.98 118.70 117.92 3g7f s GLU 39 Ca 0.25 -0.46 0.00 0.00 -0.41 0.00 0.00 54.97 54.35 3g7f s GLU 39 Cb 0.19 -1.07 0.00 0.00 -1.78 0.00 0.00 34.13 31.47 3g7f s GLU 39 CO 0.44 0.25 0.00 0.41 -0.49 0.00 0.00 175.26 175.87 3g7f n GLY 40 N 2.90 0.77 3.50 -1.39 0.00 -1.26 -5.04 105.19 104.67 3g7f n GLY 40 Ca -0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.57 3g7f n GLY 40 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3g7f s TYR 41 N -2.80 2.56 0.59 1.61 1.51 -1.26 -4.13 117.35 115.42 3g7f s TYR 41 Ca 0.00 -0.25 -0.16 0.00 -1.01 0.00 0.00 57.07 55.65 3g7f s TYR 41 Cb 0.00 -1.35 -0.04 0.00 -0.11 0.00 0.00 41.96 40.47 3g7f s TYR 41 CO 0.00 0.40 1.06 -2.14 -1.11 0.00 0.00 175.55 173.76 3g7f s PRO 42 N -2.20 3.34 1.06 -1.71 0.02 -1.26 -4.74 135.00 129.52 3g7f s PRO 42 Ca 0.19 1.21 -0.15 0.00 0.02 0.00 0.00 61.00 62.26 3g7f s PRO 42 Cb -0.10 -2.04 0.11 0.00 0.02 0.00 0.00 34.50 32.49 3g7f s PRO 42 CO 0.11 -0.79 0.33 1.28 -0.33 0.00 0.00 177.00 177.60 3g7f n LEU 43 N -1.99 -1.17 -4.25 -5.54 4.77 -1.26 -5.07 117.00 102.49 3g7f n LEU 43 Ca 0.09 0.05 -0.26 0.00 -0.03 0.00 0.00 56.01 55.86 3g7f n LEU 43 Cb 0.53 -1.11 -0.14 0.00 -2.33 0.00 0.00 43.42 40.37 3g7f n LEU 43 CO 0.47 -3.24 -0.52 0.68 -1.33 0.00 0.00 177.39 173.44 3g7f s VAL 44 N -2.33 1.68 0.00 4.08 -7.23 -1.26 -5.23 120.40 110.10 3g7f s VAL 44 Ca 0.59 -1.15 0.00 0.00 -1.81 0.00 0.00 61.98 59.61 3g7f s VAL 44 Cb -0.17 -1.44 0.00 0.00 0.56 0.00 0.00 36.38 35.32 3g7f s VAL 44 CO 0.66 0.26 0.00 -0.62 -0.31 0.00 0.00 175.10 175.09 3g7f n GLU 45 N 1.98 0.00 -3.50 4.82 -0.58 -1.26 -5.27 120.64 116.83 3g7f n GLU 45 Ca -0.17 0.00 -0.41 0.00 -0.42 0.00 0.00 57.16 56.16 3g7f n GLU 45 Cb 0.53 0.00 -0.04 0.00 -0.57 0.00 0.00 31.44 31.36 3g7f n GLU 45 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 3g7f s PRO 54 N -0.29 3.43 0.62 3.49 0.04 -1.26 -5.28 135.00 135.75 3g7f s PRO 54 Ca 0.00 -2.87 -0.19 0.00 0.04 0.00 0.00 61.00 57.98 3g7f s PRO 54 Cb 0.00 -4.18 -0.02 0.00 0.04 0.00 0.00 34.50 30.34 3g7f s PRO 54 CO 0.00 -1.25 1.32 -1.21 0.04 0.00 0.00 177.00 175.90 3g7f s GLU 55 N -0.63 2.70 0.21 4.56 2.02 -1.26 -4.92 118.70 121.39 3g7f s GLU 55 Ca 0.23 2.13 -0.09 0.00 0.02 0.00 0.00 54.97 57.26 3g7f s GLU 55 Cb -0.12 -1.96 0.24 0.00 0.10 0.00 0.00 34.13 32.39 3g7f s GLU 55 CO -0.08 -1.50 1.80 -0.44 0.02 0.00 0.00 175.26 175.06 3g7f h ASP 56 N 0.80 0.52 -0.88 -0.19 3.32 -2.06 -2.34 116.42 115.58 3g7f h ASP 56 Ca -0.51 0.03 0.18 0.00 0.02 0.00 0.00 57.03 56.75 3g7f h ASP 56 Cb 1.33 -0.07 -0.07 0.00 0.22 0.00 0.00 39.33 40.75 3g7f h ASP 56 CO 0.54 0.33 0.58 1.23 -1.72 0.00 0.00 179.24 180.20 3g7f h GLY 57 N 0.65 0.96 2.00 2.75 0.00 -1.99 0.12 103.07 107.56 3g7f h GLY 57 Ca 0.30 -0.22 -0.08 0.00 0.00 0.00 0.00 47.33 47.33 3g7f h GLY 57 CO -0.19 0.02 -0.36 1.46 0.00 0.00 0.00 176.54 177.47 3g7f h GLN 58 N 0.49 0.00 0.13 4.80 4.20 -1.79 -2.24 115.11 120.70 3g7f h GLN 58 Ca 0.45 0.00 -0.25 0.00 0.06 0.00 0.00 58.65 58.91 3g7f h GLN 58 Cb 1.01 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.79 3g7f h GLN 58 CO -0.18 0.36 -1.24 0.28 -0.67 0.00 0.00 178.83 177.38 3g7f h VAL 59 N 0.00 1.19 -0.34 -0.54 2.07 -1.05 -3.36 116.25 114.21 3g7f h VAL 59 Ca -0.00 -2.46 -0.04 0.00 0.82 0.00 0.00 66.70 65.02 3g7f h VAL 59 Cb 0.81 2.88 -0.02 0.00 -1.52 0.00 0.00 31.29 33.44 3g7f h VAL 59 CO 0.05 0.71 0.04 1.88 0.02 0.00 0.00 177.57 180.27 3g7f h TYR 60 N -0.30 0.52 0.00 1.57 0.05 -1.11 -2.80 116.97 114.90 3g7f h TYR 60 Ca -0.25 -0.04 0.00 0.00 0.05 0.00 0.00 58.73 58.49 3g7f h TYR 60 Cb 1.75 -0.16 0.00 0.00 1.01 0.00 0.00 36.73 39.33 3g7f h TYR 60 CO 0.15 0.49 0.00 1.05 -1.05 0.00 0.00 178.16 178.80 3g7f h GLU 61 N 0.50 0.00 -6.36 4.88 4.11 -1.57 -3.46 114.58 112.68 3g7f h GLU 61 Ca 0.11 0.00 -0.55 0.00 0.07 0.00 0.00 59.36 58.99 3g7f h GLU 61 Cb 0.26 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.48 3g7f h GLU 61 CO 0.00 0.00 -0.12 -0.51 0.07 0.00 0.00 179.01 178.45 3g7f s LEU 62 N -4.82 4.24 0.72 3.06 1.43 -1.06 -4.57 118.68 117.68 3g7f s LEU 62 Ca 0.08 0.95 -0.06 0.00 -1.03 0.00 0.00 54.13 54.07 3g7f s LEU 62 Cb 0.10 -3.47 0.08 0.00 0.03 0.00 0.00 46.19 42.93 3g7f s LEU 62 CO 0.55 0.01 1.02 -2.16 0.23 0.00 0.00 176.35 176.00 3g7f s PRO 63 N -2.45 1.98 0.30 1.29 0.04 -1.26 -5.03 135.00 129.87 3g7f s PRO 63 Ca 0.43 -0.47 -0.30 0.00 0.04 0.00 0.00 61.00 60.70 3g7f s PRO 63 Cb -0.13 -2.20 -0.11 0.00 0.04 0.00 0.00 34.50 32.11 3g7f s PRO 63 CO 0.20 -1.34 1.55 0.71 0.04 0.00 0.00 177.00 178.16 3g7f s TYR 64 N -3.25 2.77 0.60 0.56 2.02 -1.26 -4.82 117.35 113.97 3g7f s TYR 64 Ca 0.62 0.88 -0.18 0.00 -0.37 0.00 0.00 57.07 58.03 3g7f s TYR 64 Cb -0.09 -4.02 -0.07 0.00 -0.40 0.00 0.00 41.96 37.37 3g7f s TYR 64 CO 0.45 -3.36 0.59 -2.30 -1.57 0.00 0.00 175.55 169.36 3g7f n PRO 65 N 1.92 0.53 -4.30 -1.71 -0.02 -1.26 -4.81 135.00 125.35 3g7f n PRO 65 Ca 0.07 0.21 -0.23 0.00 -2.02 0.00 0.00 63.50 61.53 3g7f n PRO 65 Cb 0.38 -1.79 -0.12 0.00 -0.02 0.00 0.00 33.50 31.96 3g7f n PRO 65 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 3g7f s LYS 66 N -2.28 1.18 -0.18 -0.52 -2.85 -0.48 -4.94 119.74 109.66 3g7f s LYS 66 Ca 0.69 -1.27 -0.01 0.00 -1.00 0.00 0.00 55.97 54.39 3g7f s LYS 66 Cb -0.43 -1.32 0.00 0.00 -2.06 0.00 0.00 37.83 34.02 3g7f s LYS 66 CO 0.54 0.29 -0.14 0.99 0.10 0.00 0.00 175.35 177.13 3g7f s THR 67 N -1.61 2.67 -0.09 3.79 2.01 -1.26 -1.64 115.64 119.50 3g7f s THR 67 Ca 0.10 -0.75 -0.23 0.00 0.31 0.00 0.00 61.69 61.12 3g7f s THR 67 Cb -0.08 -2.15 -0.03 0.00 0.01 0.00 0.00 72.50 70.25 3g7f s THR 67 CO 0.05 0.50 0.71 -0.36 -0.69 0.00 0.00 174.62 174.83 3g7f s PHE 68 N 1.15 3.54 -0.41 4.92 0.08 0.17 -4.93 117.98 122.49 3g7f s PHE 68 Ca 0.01 1.22 -0.20 0.00 0.12 0.00 0.00 56.93 58.08 3g7f s PHE 68 Cb -0.14 -2.83 0.02 0.00 -0.57 0.00 0.00 43.02 39.50 3g7f s PHE 68 CO -0.05 0.02 0.58 0.08 -0.10 0.00 0.00 175.22 175.75 3g7f s VAL 69 N 1.06 4.92 0.41 -0.44 1.01 -1.26 -1.24 120.40 124.86 3g7f s VAL 69 Ca 0.37 0.08 -0.25 0.00 0.00 0.00 0.00 61.98 62.18 3g7f s VAL 69 Cb -0.17 -4.12 -0.08 0.00 0.00 0.00 0.00 36.38 32.00 3g7f s VAL 69 CO 0.17 -0.48 1.20 -0.76 0.00 0.00 0.00 175.10 175.22 3g7f s LEU 70 N 2.60 4.18 0.57 3.92 1.43 -0.66 -4.94 118.68 125.79 3g7f s LEU 70 Ca 0.20 2.41 0.31 0.00 -1.03 0.00 0.00 54.13 56.02 3g7f s LEU 70 Cb -0.15 -4.02 1.76 0.00 0.03 0.00 0.00 46.19 43.81 3g7f s LEU 70 CO 0.17 -0.75 2.19 1.55 0.23 0.00 0.00 176.35 179.74 3g7f h PRO 71 N 2.58 0.00 -0.48 1.29 0.13 -1.97 -2.90 132.00 130.65 3g7f h PRO 71 Ca -0.49 0.00 -0.35 0.00 -0.87 0.00 0.00 66.00 64.29 3g7f h PRO 71 Cb 1.24 0.00 -0.26 0.00 0.13 0.00 0.00 31.00 32.11 3g7f h PRO 71 CO 0.62 0.05 -0.62 0.72 -0.23 0.00 0.00 178.00 178.54 3g7f n HIS 72 N -3.61 1.74 0.00 1.56 8.25 -1.26 -5.07 115.22 116.83 3g7f n HIS 72 Ca -0.02 -1.97 0.00 0.00 -0.26 0.00 0.00 57.72 55.47 3g7f n HIS 72 Cb 0.15 -0.35 0.00 0.00 1.12 0.00 0.00 29.99 30.91 3g7f n HIS 72 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3g7f n GLY 73 N -0.88 0.74 0.00 -1.41 0.00 -1.09 -5.12 105.19 97.42 3g7f n GLY 73 Ca 0.36 -1.52 0.00 0.00 0.00 0.00 0.00 46.02 44.86 3g7f n GLY 73 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3g7f n GLY 74 N 1.11 -0.16 3.17 -0.02 0.00 -1.26 -4.66 105.19 103.37 3g7f n GLY 74 Ca 0.00 -1.85 -0.09 0.00 0.00 0.00 0.00 46.02 44.08 3g7f n GLY 74 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3g7f s THR 75 N -1.42 0.11 -0.03 2.61 -4.23 -1.26 -1.65 115.64 109.78 3g7f s THR 75 Ca 0.00 -1.83 0.00 0.00 -1.18 0.00 0.00 61.69 58.69 3g7f s THR 75 Cb 0.00 -1.95 0.02 0.00 1.34 0.00 0.00 72.50 71.92 3g7f s THR 75 CO 0.00 -0.51 -0.00 -0.69 -0.54 0.00 0.00 174.62 172.88 3g7f s VAL 76 N -4.02 0.16 -0.10 2.29 1.01 -0.37 -4.95 120.40 114.42 3g7f s VAL 76 Ca 0.21 0.07 0.01 0.00 0.00 0.00 0.00 61.98 62.27 3g7f s VAL 76 Cb 0.07 -0.25 -0.02 0.00 0.00 0.00 0.00 36.38 36.19 3g7f s VAL 76 CO -0.00 0.13 -0.14 -0.89 0.00 0.00 0.00 175.10 174.20 3g7f s THR 77 N 0.88 3.03 -0.02 3.92 2.01 -1.26 0.44 115.64 124.64 3g7f s THR 77 Ca -0.09 -0.69 -0.02 0.00 0.31 0.00 0.00 61.69 61.20 3g7f s THR 77 Cb -0.12 -2.24 0.01 0.00 0.01 0.00 0.00 72.50 70.16 3g7f s THR 77 CO -0.02 0.55 0.06 0.68 -0.69 0.00 0.00 174.62 175.20 3g7f s VAL 78 N -0.05 -0.01 0.61 3.82 -7.23 -0.65 -4.10 120.40 112.80 3g7f s VAL 78 Ca -0.03 0.03 -0.14 0.00 -1.81 0.00 0.00 61.98 60.03 3g7f s VAL 78 Cb -0.14 -0.09 -0.03 0.00 0.56 0.00 0.00 36.38 36.68 3g7f s VAL 78 CO 0.04 0.01 1.04 -2.16 -0.31 0.00 0.00 175.10 173.72 3g7f s PRO 79 N 0.16 3.34 0.09 4.82 0.04 -1.26 -1.39 135.00 140.80 3g7f s PRO 79 Ca -0.01 1.04 -0.07 0.00 0.04 0.00 0.00 61.00 62.01 3g7f s PRO 79 Cb -0.02 -2.04 -0.01 0.00 0.04 0.00 0.00 34.50 32.47 3g7f s PRO 79 CO -0.00 -0.78 0.14 -0.98 0.04 0.00 0.00 177.00 175.41 3g7f s ARG 80 N -4.47 0.81 0.01 4.56 1.70 -1.26 -4.82 118.95 115.48 3g7f s ARG 80 Ca 0.60 -1.05 -0.30 0.00 -0.47 0.00 0.00 55.73 54.51 3g7f s ARG 80 Cb -0.14 0.31 -0.07 0.00 -0.57 0.00 0.00 34.95 34.48 3g7f s ARG 80 CO 0.43 -0.24 1.66 0.50 -1.08 0.00 0.00 175.30 176.57 3g7f s ARG 81 N -3.89 4.19 -0.41 3.89 3.52 -1.26 -4.92 118.95 120.08 3g7f s ARG 81 Ca 0.07 2.27 0.05 0.00 -0.13 0.00 0.00 55.73 57.99 3g7f s ARG 81 Cb 0.06 -3.80 0.19 0.00 -1.56 0.00 0.00 34.95 29.84 3g7f s ARG 81 CO -0.10 -0.78 0.40 0.54 -0.81 0.00 0.00 175.30 174.55 3g7f n ARG 82 N 6.34 0.37 -2.68 5.12 1.74 -1.26 -5.13 116.66 121.17 3g7f n ARG 82 Ca 0.17 -3.21 -0.34 0.00 -0.77 0.00 0.00 57.85 53.70 3g7f n ARG 82 Cb 0.42 -1.55 -0.05 0.00 -1.02 0.00 0.00 32.46 30.26 3g7f n ARG 82 CO 0.00 0.00 0.00 -2.14 -1.52 0.00 0.00 177.63 173.97 3g7f s PRO 83 N -0.34 4.07 -0.70 5.56 0.02 -1.26 -4.95 135.00 137.41 3g7f s PRO 83 Ca 0.34 1.27 -0.20 0.00 0.02 0.00 0.00 61.00 62.42 3g7f s PRO 83 Cb 0.08 -2.21 0.10 0.00 0.02 0.00 0.00 34.50 32.49 3g7f s PRO 83 CO -0.17 -0.19 0.89 -1.21 -0.33 0.00 0.00 177.00 175.99 3g7f s GLU 84 N -3.07 3.21 0.09 5.54 2.02 -1.26 -4.92 118.70 120.31 3g7f s GLU 84 Ca 0.63 -1.29 -0.27 0.00 0.02 0.00 0.00 54.97 54.06 3g7f s GLU 84 Cb -0.14 -4.39 -0.14 0.00 0.10 0.00 0.00 34.13 29.56 3g7f s GLU 84 CO 0.18 -1.68 1.67 1.15 0.02 0.00 0.00 175.26 176.60 3g7f h THR 85 N 5.87 0.61 -1.55 3.63 2.02 -2.06 -3.45 112.91 117.97 3g7f h THR 85 Ca -0.18 0.00 -0.73 0.00 0.77 0.00 0.00 66.41 66.26 3g7f h THR 85 Cb 1.07 0.61 0.02 0.00 -1.74 0.00 0.00 68.15 68.10 3g7f h THR 85 CO 1.12 0.00 0.83 -1.14 0.37 0.00 0.00 175.52 176.70 3g7f n ARG 86 N -5.31 1.13 -1.71 6.66 0.63 -1.26 -4.87 116.66 111.92 3g7f n ARG 86 Ca -0.09 0.41 -0.43 0.00 -0.92 0.00 0.00 57.85 56.83 3g7f n ARG 86 Cb 0.22 -2.09 -0.03 0.00 0.45 0.00 0.00 32.46 31.01 3g7f n ARG 86 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 3g7f n GLU 87 N 4.93 2.68 -3.63 -0.14 -0.58 -1.26 -4.98 120.64 117.67 3g7f n GLU 87 Ca 0.25 0.97 -0.37 0.00 -0.42 0.00 0.00 57.16 57.59 3g7f n GLU 87 Cb 0.13 -2.80 -0.10 0.00 -0.57 0.00 0.00 31.44 28.10 3g7f n GLU 87 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 3g7f s LEU 88 N 1.05 4.03 -1.33 -4.62 1.43 -1.26 -4.99 118.68 112.99 3g7f s LEU 88 Ca 0.75 0.03 -0.15 0.00 -1.03 0.00 0.00 54.13 53.73 3g7f s LEU 88 Cb -0.53 -2.10 -0.01 0.00 0.03 0.00 0.00 46.19 43.58 3g7f s LEU 88 CO 0.34 0.00 2.24 0.29 0.23 0.00 0.00 176.35 179.45 3g7f n LYS 89 N 4.71 2.65 -3.91 1.70 4.76 -1.26 -4.84 118.16 121.97 3g7f n LYS 89 Ca -0.15 -2.39 -0.11 0.00 -2.87 0.00 0.00 58.31 52.80 3g7f n LYS 89 Cb 0.52 -3.15 -0.12 0.00 -1.84 0.00 0.00 35.03 30.44 3g7f n LYS 89 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 3g7f s LEU 90 N 1.77 2.01 0.06 -0.35 1.43 -1.26 -1.57 118.68 120.76 3g7f s LEU 90 Ca 0.51 -0.22 0.04 0.00 -1.03 0.00 0.00 54.13 53.43 3g7f s LEU 90 Cb 0.14 0.17 -0.03 0.00 0.03 0.00 0.00 46.19 46.50 3g7f s LEU 90 CO -0.05 -0.18 -0.12 0.00 0.23 0.00 0.00 176.35 176.23 3g7f s ALA 91 N -0.80 0.99 0.31 4.21 0.00 -0.26 -4.89 121.76 121.33 3g7f s ALA 91 Ca -0.09 -0.89 -0.30 0.00 0.00 0.00 0.00 51.96 50.69 3g7f s ALA 91 Cb -0.05 -0.07 -0.12 0.00 0.00 0.00 0.00 23.12 22.88 3g7f s ALA 91 CO -0.00 0.12 1.57 1.04 0.00 0.00 0.00 175.76 178.49 3g7f n GLN 92 N 1.47 2.69 0.05 0.00 6.02 -1.26 -0.69 117.38 125.66 3g7f n GLN 92 Ca -0.21 0.95 0.12 0.00 -0.01 0.00 0.00 57.00 57.85 3g7f n GLN 92 Cb 0.54 -2.72 0.22 0.00 1.02 0.00 0.00 30.24 29.30 3g7f n GLN 92 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 3g7f n THR 93 N 1.72 0.28 -3.69 5.09 -2.24 -1.09 -4.85 114.28 109.49 3g7f n THR 93 Ca 0.07 -0.21 -0.06 0.00 -2.27 0.00 0.00 64.05 61.58 3g7f n THR 93 Cb 0.37 -0.09 -0.02 0.00 -2.10 0.00 0.00 70.33 68.50 3g7f n THR 93 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3g7f s ASP 94 N -3.93 -0.28 0.19 3.42 2.15 -1.26 -5.07 116.67 111.89 3g7f s ASP 94 Ca 0.08 -0.33 0.08 0.00 0.43 0.00 0.00 52.55 52.81 3g7f s ASP 94 Cb 0.14 0.54 0.06 0.00 -0.30 0.00 0.00 42.92 43.36 3g7f s ASP 94 CO 0.70 -0.96 1.44 1.23 -0.17 0.00 0.00 175.17 177.41 3g7f h GLY 95 N 2.00 0.01 -4.81 2.66 0.00 -1.99 -3.46 103.07 97.47 3g7f h GLY 95 Ca -0.24 -0.02 -0.62 0.00 0.00 0.00 0.00 47.33 46.45 3g7f h GLY 95 CO 0.27 0.01 0.32 0.33 0.00 0.00 0.00 176.54 177.48 3g7f n PHE 96 N -3.57 1.50 0.05 5.60 7.35 -1.26 -4.91 117.46 122.22 3g7f n PHE 96 Ca -0.01 0.63 0.00 0.00 -0.76 0.00 0.00 57.45 57.31 3g7f n PHE 96 Cb 0.78 -2.32 0.32 0.00 0.35 0.00 0.00 39.48 38.62 3g7f n PHE 96 CO 0.00 0.00 0.00 1.49 -0.76 0.00 0.00 176.76 177.49 3g7f h GLU 97 N 3.25 0.39 -0.53 -4.13 4.81 -2.04 -1.88 114.58 114.46 3g7f h GLU 97 Ca -0.43 -0.10 0.00 0.00 -0.13 0.00 0.00 59.36 58.71 3g7f h GLU 97 Cb 1.33 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.65 3g7f h GLU 97 CO 0.69 0.50 0.00 0.41 -0.73 0.00 0.00 179.01 179.88 3g7f n GLY 98 N -0.80 1.42 3.77 1.92 0.00 -1.26 -4.94 105.19 105.29 3g7f n GLY 98 Ca 0.00 -0.49 -0.41 0.00 0.00 0.00 0.00 46.02 45.12 3g7f n GLY 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g7f s ALA 99 N -1.59 3.48 0.83 4.61 0.00 -0.71 -5.03 121.76 123.35 3g7f s ALA 99 Ca 0.30 1.19 -0.11 0.00 0.00 0.00 0.00 51.96 53.33 3g7f s ALA 99 Cb 0.18 -3.45 0.09 0.00 0.00 0.00 0.00 23.12 19.94 3g7f s ALA 99 CO 0.17 -0.54 1.09 -1.25 0.00 0.00 0.00 175.76 175.23 3g7f s PRO 100 N -1.68 1.84 0.25 0.00 0.04 -1.26 -4.84 135.00 129.36 3g7f s PRO 100 Ca 0.48 0.74 0.03 0.00 0.04 0.00 0.00 61.00 62.29 3g7f s PRO 100 Cb -0.38 -1.88 -0.03 0.00 0.04 0.00 0.00 34.50 32.24 3g7f s PRO 100 CO 0.50 -1.81 0.40 -0.51 0.04 0.00 0.00 177.00 175.62 3g7f s LEU 101 N -5.93 4.24 0.01 -3.56 1.43 -1.26 -2.68 118.68 110.94 3g7f s LEU 101 Ca 0.62 0.19 0.05 0.00 -1.03 0.00 0.00 54.13 53.96 3g7f s LEU 101 Cb -0.16 -2.99 -0.02 0.00 0.03 0.00 0.00 46.19 43.05 3g7f s LEU 101 CO 0.55 -0.11 -0.16 0.00 0.23 0.00 0.00 176.35 176.86 3g7f s GLN 102 N -3.95 1.22 0.29 1.70 -2.07 0.13 -4.90 119.66 112.08 3g7f s GLN 102 Ca 0.36 -0.68 -0.30 0.00 -1.82 0.00 0.00 55.36 52.92 3g7f s GLN 102 Cb -0.09 -1.22 -0.13 0.00 -1.09 0.00 0.00 33.01 30.48 3g7f s GLN 102 CO 0.31 0.32 1.37 -2.30 -1.32 0.00 0.00 175.29 173.67 3g7f n PRO 103 N 2.35 2.14 0.00 9.60 -0.02 -1.26 -1.10 135.00 146.70 3g7f n PRO 103 Ca -0.16 0.76 0.10 0.00 -2.02 0.00 0.00 63.50 62.18 3g7f n PRO 103 Cb 0.54 -2.39 -0.07 0.00 -0.02 0.00 0.00 33.50 31.56 3g7f n PRO 103 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 3g7f n THR 104 N 1.25 0.00 -0.06 3.45 -2.24 -0.61 -4.85 114.28 111.23 3g7f n THR 104 Ca 0.08 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.84 3g7f n THR 104 Cb 0.34 0.84 0.00 0.00 -2.10 0.00 0.00 70.33 69.41 3g7f n THR 104 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3g7f n GLY 105 N 1.49 5.62 3.57 3.38 0.00 -1.26 -5.06 105.19 112.93 3g7f n GLY 105 Ca 0.04 -1.01 -0.43 0.00 0.00 0.00 0.00 46.02 44.62 3g7f n GLY 105 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3g7f s ASN 106 N 1.00 6.50 0.40 1.61 3.84 -1.26 -4.93 114.94 122.10 3g7f s ASN 106 Ca 0.00 0.12 0.11 0.00 0.21 0.00 0.00 52.86 53.30 3g7f s ASN 106 Cb 0.00 -2.48 0.85 0.00 -0.55 0.00 0.00 41.25 39.07 3g7f s ASN 106 CO 0.00 -1.18 1.93 1.55 -2.79 0.00 0.00 177.10 176.62 3g7f h PRO 107 N 9.21 0.15 0.20 0.43 0.13 -1.94 0.37 132.00 140.55 3g7f h PRO 107 Ca -0.24 -0.03 -0.01 0.00 -0.87 0.00 0.00 66.00 64.84 3g7f h PRO 107 Cb 1.07 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.18 3g7f h PRO 107 CO 1.08 0.31 -0.09 -0.07 -0.23 0.00 0.00 178.00 179.00 3g7f h LEU 108 N 0.14 -0.22 -0.32 1.56 3.38 -1.92 0.19 115.31 118.13 3g7f h LEU 108 Ca 0.03 -0.12 -0.10 0.00 0.09 0.00 0.00 57.88 57.77 3g7f h LEU 108 Cb 0.37 0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 3g7f h LEU 108 CO 0.02 -0.01 -0.19 0.58 0.09 0.00 0.00 178.44 178.94 3g7f h VAL 109 N -0.43 1.29 0.00 1.22 2.07 -1.86 -3.05 116.25 115.49 3g7f h VAL 109 Ca -0.03 -1.31 0.00 0.00 0.82 0.00 0.00 66.70 66.18 3g7f h VAL 109 Cb 0.33 1.46 0.00 0.00 -1.52 0.00 0.00 31.29 31.56 3g7f h VAL 109 CO 0.04 0.42 0.00 0.44 0.02 0.00 0.00 177.57 178.50 3g7f h ASP 110 N 0.44 0.00 -4.68 0.57 3.32 -0.22 -3.47 116.42 112.38 3g7f h ASP 110 Ca 0.07 0.00 -0.19 0.00 0.02 0.00 0.00 57.03 56.93 3g7f h ASP 110 Cb 0.73 0.00 0.14 0.00 0.22 0.00 0.00 39.33 40.41 3g7f h ASP 110 CO 0.05 0.00 -0.59 0.00 -1.72 0.00 0.00 179.24 176.98 3g7f n ALA 111 N -1.91 -1.79 -2.44 3.45 0.00 0.64 -4.79 120.51 113.67 3g7f n ALA 111 Ca 0.02 0.07 -0.22 0.00 0.00 0.00 0.00 53.44 53.31 3g7f n ALA 111 Cb 0.30 -3.70 -0.10 0.00 0.00 0.00 0.00 19.45 15.95 3g7f n ALA 111 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 3g7f s VAL 112 N -3.27 1.67 0.00 0.00 -7.23 -1.00 -4.00 120.40 106.57 3g7f s VAL 112 Ca 0.25 -2.12 0.00 0.00 -1.81 0.00 0.00 61.98 58.30 3g7f s VAL 112 Cb -0.03 -2.50 0.00 0.00 0.56 0.00 0.00 36.38 34.41 3g7f s VAL 112 CO 0.52 -0.27 0.00 0.61 -0.31 0.00 0.00 175.10 175.65 3g7f n GLY 113 N -0.62 3.15 0.00 2.32 0.00 -1.26 -1.70 105.19 107.08 3g7f n GLY 113 Ca -0.05 -0.30 0.06 0.00 0.00 0.00 0.00 46.02 45.73 3g7f n GLY 113 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3g7f n PRO 114 N 13.98 0.22 -0.18 1.61 -0.04 -1.26 -1.64 135.00 147.69 3g7f n PRO 114 Ca 0.00 0.13 0.10 0.00 -0.04 0.00 0.00 63.50 63.69 3g7f n PRO 114 Cb 0.00 -1.50 0.27 0.00 -0.04 0.00 0.00 33.50 32.23 3g7f n PRO 114 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3g7f n ALA 115 N -1.21 2.45 -1.76 0.55 0.00 -0.69 -3.09 120.51 116.76 3g7f n ALA 115 Ca 0.06 -0.81 -0.40 0.00 0.00 0.00 0.00 53.44 52.29 3g7f n ALA 115 Cb 0.08 -0.97 -0.03 0.00 0.00 0.00 0.00 19.45 18.52 3g7f n ALA 115 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 3g7f s SER 116 N -1.35 6.99 0.24 0.00 0.01 -0.65 -4.15 113.70 114.80 3g7f s SER 116 Ca 0.35 2.40 0.08 0.00 1.31 0.00 0.00 55.95 60.10 3g7f s SER 116 Cb 0.19 -2.63 -0.04 0.00 0.21 0.00 0.00 66.02 63.75 3g7f s SER 116 CO 0.27 -0.35 0.05 -0.72 0.41 0.00 0.00 173.24 172.90 3g7f s TYR 117 N -1.21 2.84 0.28 2.43 1.13 -1.26 -4.74 117.35 116.82 3g7f s TYR 117 Ca 0.48 -0.17 -0.10 0.00 -1.41 0.00 0.00 57.07 55.87 3g7f s TYR 117 Cb -0.34 -1.29 -0.07 0.00 -1.10 0.00 0.00 41.96 39.16 3g7f s TYR 117 CO 0.44 0.57 0.61 0.00 -2.51 0.00 0.00 175.55 174.66 3g7f s ALA 118 N -2.14 3.50 -1.05 9.51 0.00 -1.26 -4.98 121.76 125.35 3g7f s ALA 118 Ca 0.31 -0.25 -0.07 0.00 0.00 0.00 0.00 51.96 51.95 3g7f s ALA 118 Cb -0.07 -2.51 -0.06 0.00 0.00 0.00 0.00 23.12 20.48 3g7f s ALA 118 CO 0.21 0.37 2.27 0.39 0.00 0.00 0.00 175.76 178.99 3g7f n GLU 119 N -0.46 2.38 -1.19 0.00 -0.58 -1.26 -4.88 120.64 114.65 3g7f n GLU 119 Ca 0.01 -1.61 -0.30 0.00 -0.42 0.00 0.00 57.16 54.85 3g7f n GLU 119 Cb 0.53 -2.53 0.14 0.00 -0.57 0.00 0.00 31.44 29.01 3g7f n GLU 119 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 3g7f s ARG 120 N 3.20 1.26 0.45 3.49 0.52 -1.26 -4.98 118.95 121.63 3g7f s ARG 120 Ca 0.45 0.85 -0.24 0.00 -0.52 0.00 0.00 55.73 56.27 3g7f s ARG 120 Cb 0.12 -1.81 -0.08 0.00 0.52 0.00 0.00 34.95 33.70 3g7f s ARG 120 CO -0.04 -2.24 1.28 0.00 0.02 0.00 0.00 175.30 174.32 3g7f s ALA 121 N -2.92 3.10 -1.46 2.13 0.00 -1.26 -4.45 121.76 116.89 3g7f s ALA 121 Ca 0.63 1.18 -0.09 0.00 0.00 0.00 0.00 51.96 53.69 3g7f s ALA 121 Cb -0.18 -3.48 0.03 0.00 0.00 0.00 0.00 23.12 19.49 3g7f s ALA 121 CO 0.57 -0.90 2.55 0.39 0.00 0.00 0.00 175.76 178.37 3g7f n GLU 122 N -0.27 3.89 -4.42 0.00 -0.58 -1.26 -2.84 120.64 115.16 3g7f n GLU 122 Ca 0.06 -2.83 -0.19 0.00 -0.42 0.00 0.00 57.16 53.78 3g7f n GLU 122 Cb 0.45 -2.82 -0.15 0.00 -0.57 0.00 0.00 31.44 28.35 3g7f n GLU 122 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 3g7f s VAL 123 N 0.98 0.81 -0.04 2.62 1.01 -1.26 -4.94 120.40 119.58 3g7f s VAL 123 Ca 0.58 -0.48 -0.30 0.00 0.00 0.00 0.00 61.98 61.78 3g7f s VAL 123 Cb 0.17 -0.69 -0.03 0.00 0.00 0.00 0.00 36.38 35.83 3g7f s VAL 123 CO -0.07 0.20 1.05 -0.69 0.00 0.00 0.00 175.10 175.59 3g7f s VAL 124 N -0.29 4.66 0.39 2.92 1.01 -1.26 -0.61 120.40 127.21 3g7f s VAL 124 Ca 0.03 1.92 -0.26 0.00 0.00 0.00 0.00 61.98 63.68 3g7f s VAL 124 Cb -0.04 -4.23 -0.09 0.00 0.00 0.00 0.00 36.38 32.02 3g7f s VAL 124 CO -0.00 0.08 1.21 -0.62 0.00 0.00 0.00 175.10 175.76 3g7f s ASP 125 N 1.11 6.52 0.15 3.32 2.15 -1.26 -4.92 116.67 123.74 3g7f s ASP 125 Ca 0.52 2.45 0.09 0.00 0.43 0.00 0.00 52.55 56.04 3g7f s ASP 125 Cb -0.21 -2.62 -0.04 0.00 -0.30 0.00 0.00 42.92 39.74 3g7f s ASP 125 CO 0.24 -0.69 -0.14 0.00 -0.17 0.00 0.00 175.17 174.40 3g7f s ALA 126 N -1.34 2.80 1.01 3.66 0.00 -1.26 -0.66 121.76 125.97 3g7f s ALA 126 Ca 0.56 -1.41 -0.14 0.00 0.00 0.00 0.00 51.96 50.97 3g7f s ALA 126 Cb -0.33 -0.68 0.19 0.00 0.00 0.00 0.00 23.12 22.30 3g7f s ALA 126 CO 0.42 0.53 1.12 0.95 0.00 0.00 0.00 175.76 178.79 3g7f s THR 127 N -1.42 1.93 0.52 0.00 -4.23 0.99 -4.68 115.64 108.76 3g7f s THR 127 Ca 0.21 0.00 0.20 0.00 -1.18 0.00 0.00 61.69 60.93 3g7f s THR 127 Cb -0.10 -2.61 0.28 0.00 1.34 0.00 0.00 72.50 71.41 3g7f s THR 127 CO 0.12 0.00 2.15 1.62 -0.54 0.00 0.00 174.62 177.98 3g7f h VAL 128 N -1.88 0.86 -0.19 2.29 3.04 -1.99 -1.71 116.25 116.68 3g7f h VAL 128 Ca -0.51 -0.13 0.00 0.00 -1.01 0.00 0.00 66.70 65.05 3g7f h VAL 128 Cb 1.32 1.07 0.00 0.00 -2.01 0.00 0.00 31.29 31.67 3g7f h VAL 128 CO 0.54 0.03 0.00 0.47 -1.01 0.00 0.00 177.57 177.61 3g7f n ASP 129 N -4.25 2.04 0.00 3.17 8.00 -1.26 -4.93 116.55 119.31 3g7f n ASP 129 Ca -0.03 -1.76 0.00 0.00 0.71 0.00 0.00 54.79 53.71 3g7f n ASP 129 Cb 0.12 -0.12 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 3g7f n ASP 129 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3g7f n GLY 130 N 1.21 0.85 3.92 0.44 0.00 -0.64 -5.07 105.19 105.90 3g7f n GLY 130 Ca 0.17 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.92 3g7f n GLY 130 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g7f s LYS 131 N -0.76 3.16 0.14 1.61 -0.14 -1.26 -4.77 119.74 117.73 3g7f s LYS 131 Ca 0.00 0.03 -0.31 0.00 -1.36 0.00 0.00 55.97 54.32 3g7f s LYS 131 Cb 0.00 -2.34 -0.11 0.00 -1.68 0.00 0.00 37.83 33.71 3g7f s LYS 131 CO 0.00 -0.48 1.80 0.00 -0.76 0.00 0.00 175.35 175.91 3g7f s ALA 132 N -2.86 3.81 -0.01 5.17 0.00 -1.26 -0.01 121.76 126.60 3g7f s ALA 132 Ca 0.51 1.48 -0.22 0.00 0.00 0.00 0.00 51.96 53.73 3g7f s ALA 132 Cb -0.10 -3.74 -0.21 0.00 0.00 0.00 0.00 23.12 19.06 3g7f s ALA 132 CO 0.44 -1.14 1.14 -0.22 0.00 0.00 0.00 175.76 175.98 3g7f h LYS 133 N 8.13 0.28 -4.55 0.00 3.64 -1.16 -3.43 116.57 119.48 3g7f h LYS 133 Ca -0.45 -0.25 -0.71 0.00 -1.27 0.00 0.00 60.65 57.98 3g7f h LYS 133 Cb 1.21 0.06 -0.28 0.00 -0.41 0.00 0.00 32.23 32.81 3g7f h LYS 133 CO 0.95 0.91 -0.52 0.42 -2.27 0.00 0.00 179.45 178.93 3g7f s ILE 134 N -3.50 4.12 0.01 2.00 -1.09 -1.26 -0.86 121.20 120.62 3g7f s ILE 134 Ca -0.15 -1.23 -0.03 0.00 -2.23 0.00 0.00 60.65 57.01 3g7f s ILE 134 Cb 0.03 -3.43 -0.01 0.00 -1.58 0.00 0.00 42.46 37.47 3g7f s ILE 134 CO 0.76 -0.35 0.04 0.68 -1.23 0.00 0.00 174.94 174.84 3g7f s VAL 135 N 1.43 0.10 0.69 2.92 -7.23 -0.76 -4.34 120.40 113.21 3g7f s VAL 135 Ca 0.01 -0.80 -0.14 0.00 -1.81 0.00 0.00 61.98 59.24 3g7f s VAL 135 Cb -0.21 -0.33 0.02 0.00 0.56 0.00 0.00 36.38 36.42 3g7f s VAL 135 CO 0.03 -0.44 1.11 -2.16 -0.31 0.00 0.00 175.10 173.33 3g7f s PRO 136 N -1.41 2.62 0.50 4.82 0.04 -1.26 -0.89 135.00 139.43 3g7f s PRO 136 Ca -0.15 1.36 0.18 0.00 0.04 0.00 0.00 61.00 62.42 3g7f s PRO 136 Cb -0.09 -1.93 1.24 0.00 0.04 0.00 0.00 34.50 33.76 3g7f s PRO 136 CO 0.00 -1.38 2.09 -0.07 0.04 0.00 0.00 177.00 177.68 3g7f h LEU 137 N -0.28 0.00 -2.01 -3.56 3.38 -1.42 0.03 115.31 111.45 3g7f h LEU 137 Ca -0.46 0.00 0.08 0.00 0.09 0.00 0.00 57.88 57.59 3g7f h LEU 137 Cb 1.25 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.98 3g7f h LEU 137 CO 0.53 0.09 0.20 0.08 0.09 0.00 0.00 178.44 179.42 3g7f h ARG 138 N 0.00 0.00 0.07 1.13 0.11 -1.92 -2.50 114.38 111.27 3g7f h ARG 138 Ca -0.00 0.00 -0.35 0.00 0.10 0.00 0.00 59.98 59.73 3g7f h ARG 138 Cb 0.16 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 31.21 3g7f h ARG 138 CO 0.01 0.00 -1.98 0.28 0.10 0.00 0.00 179.97 178.38 3g7f n VAL 139 N -4.43 1.66 -2.28 0.08 0.31 -0.46 -4.61 118.33 108.60 3g7f n VAL 139 Ca 0.03 -0.50 -0.42 0.00 -0.01 0.00 0.00 64.34 63.44 3g7f n VAL 139 Cb 0.36 -1.75 0.00 0.00 -0.91 0.00 0.00 33.84 31.54 3g7f n VAL 139 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3g7f n ALA 140 N -3.22 5.46 0.20 3.52 0.00 -0.13 -4.79 120.51 121.55 3g7f n ALA 140 Ca -0.36 -4.28 0.08 0.00 0.00 0.00 0.00 53.44 48.87 3g7f n ALA 140 Cb 0.95 -3.00 0.34 0.00 0.00 0.00 0.00 19.45 17.74 3g7f n ALA 140 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 3g7f h THR 141 N 3.69 0.62 0.00 0.00 1.35 -1.81 -1.22 112.91 115.55 3g7f h THR 141 Ca 0.42 -1.39 0.00 0.00 -0.55 0.00 0.00 66.41 64.89 3g7f h THR 141 Cb 0.61 1.93 0.00 0.00 -1.73 0.00 0.00 68.15 68.97 3g7f h THR 141 CO 1.64 0.28 0.00 -0.90 -0.25 0.00 0.00 175.52 176.29 3g7f n ASP 142 N -3.35 0.00 -4.90 5.36 5.75 -1.26 -4.77 116.55 113.37 3g7f n ASP 142 Ca 0.01 -0.12 -0.34 0.00 -0.01 0.00 0.00 54.79 54.33 3g7f n ASP 142 Cb 0.51 -0.26 -0.05 0.00 -1.03 0.00 0.00 41.12 40.29 3g7f n ASP 142 CO 0.00 0.00 0.00 -0.36 -0.11 0.00 0.00 177.20 176.73 3g7f s PHE 143 N -2.51 3.55 0.29 2.11 0.40 -0.46 -5.11 117.98 116.24 3g7f s PHE 143 Ca 0.23 0.42 0.03 0.00 -0.60 0.00 0.00 56.93 57.01 3g7f s PHE 143 Cb 0.16 -1.88 -0.03 0.00 0.51 0.00 0.00 43.02 41.78 3g7f s PHE 143 CO 0.34 0.63 0.26 -1.54 0.70 0.00 0.00 175.22 175.62 3g7f s SER 144 N -1.91 1.03 -0.08 1.36 1.04 -1.26 -5.01 113.70 108.88 3g7f s SER 144 Ca 0.28 -1.58 -0.18 0.00 0.48 0.00 0.00 55.95 54.95 3g7f s SER 144 Cb -0.13 0.51 -0.05 0.00 0.10 0.00 0.00 66.02 66.46 3g7f s SER 144 CO 0.18 -1.02 0.48 -0.63 0.98 0.00 0.00 173.24 173.23 3g7f s ILE 145 N -3.64 5.12 0.41 -1.02 1.01 -1.26 -5.05 121.20 116.78 3g7f s ILE 145 Ca 0.38 0.96 -0.26 0.00 0.00 0.00 0.00 60.65 61.74 3g7f s ILE 145 Cb 0.03 -3.81 -0.10 0.00 0.01 0.00 0.00 42.46 38.59 3g7f s ILE 145 CO 0.21 0.38 1.23 0.00 0.00 0.00 0.00 174.94 176.76 3g7f n ALA 146 N 3.23 1.09 -2.12 9.38 0.00 -1.26 -4.92 120.51 125.90 3g7f n ALA 146 Ca -0.08 0.27 -0.42 0.00 0.00 0.00 0.00 53.44 53.21 3g7f n ALA 146 Cb 0.52 -2.23 -0.03 0.00 0.00 0.00 0.00 19.45 17.70 3g7f n ALA 146 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 3g7f s GLU 147 N -2.13 4.41 0.00 0.00 2.12 -1.26 -2.43 118.70 119.41 3g7f s GLU 147 Ca 0.61 1.95 0.00 0.00 0.36 0.00 0.00 54.97 57.89 3g7f s GLU 147 Cb -0.53 -3.24 0.00 0.00 0.26 0.00 0.00 34.13 30.62 3g7f s GLU 147 CO 0.58 -0.24 0.00 0.41 -0.54 0.00 0.00 175.26 175.48 3g7f n GLY 148 N 2.67 2.16 3.82 -1.50 0.00 -1.26 -5.10 105.19 105.97 3g7f n GLY 148 Ca 0.07 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.78 3g7f n GLY 148 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3g7f s ASP 149 N -1.68 5.77 0.16 1.61 1.01 -1.02 -5.07 116.67 117.45 3g7f s ASP 149 Ca 0.00 0.08 -0.33 0.00 0.71 0.00 0.00 52.55 53.00 3g7f s ASP 149 Cb 0.00 -1.63 -0.13 0.00 1.01 0.00 0.00 42.92 42.17 3g7f s ASP 149 CO 0.00 0.18 1.62 0.52 0.21 0.00 0.00 175.17 177.70 3g7f n VAL 150 N 0.46 0.03 -2.86 -1.27 0.31 -1.26 -4.93 118.33 108.80 3g7f n VAL 150 Ca -0.08 -0.00 -0.43 0.00 -0.01 0.00 0.00 64.34 63.82 3g7f n VAL 150 Cb 0.51 -1.65 -0.04 0.00 -0.91 0.00 0.00 33.84 31.75 3g7f n VAL 150 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3g7f s ASP 151 N 1.10 6.51 0.00 4.52 -1.08 -1.26 -4.95 116.67 121.50 3g7f s ASP 151 Ca 0.79 0.15 0.28 0.00 -0.52 0.00 0.00 52.55 53.24 3g7f s ASP 151 Cb -0.64 -2.43 1.35 0.00 -1.46 0.00 0.00 42.92 39.73 3g7f s ASP 151 CO 0.37 -0.97 1.93 -0.81 0.52 0.00 0.00 175.17 176.21 3g7f n PRO 152 N 6.96 0.31 -1.98 4.34 -0.04 -1.26 -4.82 135.00 138.51 3g7f n PRO 152 Ca 0.05 0.03 -0.42 0.00 -0.04 0.00 0.00 63.50 63.12 3g7f n PRO 152 Cb 0.48 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.41 3g7f n PRO 152 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 3g7f s ARG 153 N -2.66 4.23 0.00 0.54 0.52 -1.26 -0.98 118.95 119.34 3g7f s ARG 153 Ca 0.24 2.29 0.00 0.00 -0.52 0.00 0.00 55.73 57.73 3g7f s ARG 153 Cb 0.18 -3.35 0.00 0.00 0.52 0.00 0.00 34.95 32.30 3g7f s ARG 153 CO 0.44 -0.63 0.00 0.41 0.02 0.00 0.00 175.30 175.54 3g7f n GLY 154 N 3.80 3.35 3.79 -3.53 0.00 0.13 -5.00 105.19 107.72 3g7f n GLY 154 Ca 0.14 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.81 3g7f n GLY 154 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3g7f s LEU 155 N 0.00 3.88 0.54 0.99 1.43 -0.15 -4.72 118.68 120.65 3g7f s LEU 155 Ca 0.00 2.05 -0.18 0.00 -1.03 0.00 0.00 54.13 54.98 3g7f s LEU 155 Cb 0.00 -4.48 -0.06 0.00 0.03 0.00 0.00 46.19 41.68 3g7f s LEU 155 CO 0.00 -0.87 1.04 -2.16 0.23 0.00 0.00 176.35 174.59 3g7f s PRO 156 N -3.08 3.57 -0.29 1.29 0.04 -1.26 -1.01 135.00 134.26 3g7f s PRO 156 Ca 0.67 1.25 -0.09 0.00 0.04 0.00 0.00 61.00 62.87 3g7f s PRO 156 Cb -0.20 -2.07 -0.02 0.00 0.04 0.00 0.00 34.50 32.25 3g7f s PRO 156 CO 0.24 -0.61 0.14 0.08 0.04 0.00 0.00 177.00 176.90 3g7f s VAL 157 N -2.27 4.62 -0.23 -0.36 1.01 -0.24 -1.35 120.40 121.59 3g7f s VAL 157 Ca 0.65 -0.30 -0.07 0.00 0.00 0.00 0.00 61.98 62.26 3g7f s VAL 157 Cb -0.16 -3.30 -0.03 0.00 0.00 0.00 0.00 36.38 32.89 3g7f s VAL 157 CO 0.29 0.14 0.06 -0.69 0.00 0.00 0.00 175.10 174.91 3g7f s VAL 158 N 1.63 4.39 0.59 2.92 1.01 0.11 0.52 120.40 131.57 3g7f s VAL 158 Ca 0.05 -0.15 -0.06 0.00 0.00 0.00 0.00 61.98 61.82 3g7f s VAL 158 Cb -0.17 -3.03 0.13 0.00 0.00 0.00 0.00 36.38 33.31 3g7f s VAL 158 CO 0.06 0.37 0.81 0.00 0.00 0.00 0.00 175.10 176.34 3g7f n ALA 159 N 4.56 -0.51 0.21 5.51 0.00 -0.76 0.03 120.51 129.55 3g7f n ALA 159 Ca -0.16 -1.26 0.05 0.00 0.00 0.00 0.00 53.44 52.07 3g7f n ALA 159 Cb 0.52 0.07 0.46 0.00 0.00 0.00 0.00 19.45 20.50 3g7f n ALA 159 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3g7f h ALA 160 N -1.27 1.45 -0.07 0.00 0.00 -0.28 -0.60 119.26 118.49 3g7f h ALA 160 Ca -0.26 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.40 3g7f h ALA 160 Cb 0.82 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.57 3g7f h ALA 160 CO 0.22 0.34 0.00 -0.40 0.00 0.00 0.00 179.25 179.41 3g7f n ASP 161 N -4.07 0.35 -0.03 0.00 5.68 -1.26 -4.89 116.55 112.34 3g7f n ASP 161 Ca -0.02 -2.00 -0.00 0.00 -0.50 0.00 0.00 54.79 52.27 3g7f n ASP 161 Cb 0.33 -0.04 -0.00 0.00 -1.14 0.00 0.00 41.12 40.27 3g7f n ASP 161 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3g7f n GLY 162 N 0.61 0.28 3.86 6.12 0.00 -0.23 -5.00 105.19 110.82 3g7f n GLY 162 Ca 0.02 -0.02 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 3g7f n GLY 162 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g7f s VAL 163 N -1.52 5.22 0.05 1.61 1.01 -1.26 -4.83 120.40 120.68 3g7f s VAL 163 Ca 0.00 0.53 -0.30 0.00 0.00 0.00 0.00 61.98 62.21 3g7f s VAL 163 Cb 0.00 -3.59 -0.09 0.00 0.00 0.00 0.00 36.38 32.71 3g7f s VAL 163 CO 0.00 0.55 1.89 -0.70 0.00 0.00 0.00 175.10 176.84 3g7f s GLU 164 N -1.19 4.15 0.10 2.72 2.12 -1.26 -1.82 118.70 123.52 3g7f s GLU 164 Ca 0.22 2.55 0.22 0.00 0.36 0.00 0.00 54.97 58.32 3g7f s GLU 164 Cb -0.15 -3.99 -0.14 0.00 0.26 0.00 0.00 34.13 30.11 3g7f s GLU 164 CO 0.11 -0.91 0.80 0.00 -0.54 0.00 0.00 175.26 174.72 3g7f n ALA 165 N 6.99 2.61 0.00 6.30 0.00 0.18 -4.89 120.51 131.70 3g7f n ALA 165 Ca 0.19 -0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.26 3g7f n ALA 165 Cb 0.41 -0.95 0.00 0.00 0.00 0.00 0.00 19.45 18.91 3g7f n ALA 165 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3g7f n GLY 166 N 1.23 -0.82 2.92 0.00 0.00 -1.24 -1.37 105.19 105.92 3g7f n GLY 166 Ca -0.02 -1.09 -0.19 0.00 0.00 0.00 0.00 46.02 44.72 3g7f n GLY 166 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3g7f s THR 167 N -3.00 0.55 0.01 2.61 2.01 -0.34 -1.08 115.64 116.40 3g7f s THR 167 Ca 0.00 -0.17 -0.30 0.00 0.31 0.00 0.00 61.69 61.53 3g7f s THR 167 Cb 0.00 -0.54 -0.07 0.00 0.01 0.00 0.00 72.50 71.90 3g7f s THR 167 CO 0.00 0.21 1.68 -0.69 -0.69 0.00 0.00 174.62 175.13 3g7f s VAL 168 N 0.62 3.30 -0.08 3.82 1.01 -0.18 -0.20 120.40 128.71 3g7f s VAL 168 Ca -0.08 0.55 0.14 0.00 0.00 0.00 0.00 61.98 62.58 3g7f s VAL 168 Cb -0.12 -3.35 -0.21 0.00 0.00 0.00 0.00 36.38 32.70 3g7f s VAL 168 CO 0.00 -0.03 0.20 0.35 0.00 0.00 0.00 175.10 175.62 3g7f n THR 169 N 5.16 0.44 -3.82 3.92 -2.24 0.30 0.18 114.28 118.22 3g7f n THR 169 Ca 0.17 -0.46 -0.06 0.00 -2.27 0.00 0.00 64.05 61.43 3g7f n THR 169 Cb 0.42 -0.21 -0.01 0.00 -2.10 0.00 0.00 70.33 68.43 3g7f n THR 169 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3g7f s ASP 170 N -4.19 -0.18 -0.02 3.42 -1.08 -0.96 -4.89 116.67 108.77 3g7f s ASP 170 Ca -0.06 -0.63 0.06 0.00 -0.52 0.00 0.00 52.55 51.39 3g7f s ASP 170 Cb 0.07 0.66 -0.01 0.00 -1.46 0.00 0.00 42.92 42.18 3g7f s ASP 170 CO 0.60 -1.24 -0.19 -0.76 0.52 0.00 0.00 175.17 174.10 3g7f s LEU 171 N -2.98 2.01 -0.30 -1.34 1.02 -1.26 -0.47 118.68 115.37 3g7f s LEU 171 Ca 0.13 -0.36 -0.11 0.00 0.02 0.00 0.00 54.13 53.81 3g7f s LEU 171 Cb -0.04 -1.01 -0.04 0.00 0.02 0.00 0.00 46.19 45.12 3g7f s LEU 171 CO 0.06 0.22 0.20 0.26 0.02 0.00 0.00 176.35 177.11 3g7f s TRP 172 N -0.35 3.21 0.06 0.29 0.52 0.40 -1.15 118.94 121.93 3g7f s TRP 172 Ca 0.05 -0.03 -0.03 0.00 0.02 0.00 0.00 56.10 56.11 3g7f s TRP 172 Cb -0.09 -2.40 -0.05 0.00 -1.15 0.00 0.00 33.47 29.79 3g7f s TRP 172 CO 0.00 -0.24 0.26 0.54 0.02 0.00 0.00 176.95 177.53 3g7f s VAL 173 N 1.74 5.32 -0.47 4.03 0.11 -0.07 -0.81 120.40 130.25 3g7f s VAL 173 Ca 0.07 -0.15 -0.20 0.00 -2.93 0.00 0.00 61.98 58.76 3g7f s VAL 173 Cb -0.16 -3.60 0.04 0.00 -1.53 0.00 0.00 36.38 31.12 3g7f s VAL 173 CO 0.10 0.18 0.64 -0.62 -3.33 0.00 0.00 175.10 172.08 3g7f s ASP 174 N -2.27 6.28 0.53 3.54 -1.08 0.14 -1.82 116.67 122.00 3g7f s ASP 174 Ca 0.34 -0.56 0.31 0.00 -0.52 0.00 0.00 52.55 52.12 3g7f s ASP 174 Cb -0.13 -2.31 1.46 0.00 -1.46 0.00 0.00 42.92 40.48 3g7f s ASP 174 CO 0.24 -0.84 2.04 0.03 0.52 0.00 0.00 175.17 177.17 3g7f h ARG 175 N 8.94 0.00 0.00 4.34 3.08 -1.30 0.14 114.38 129.58 3g7f h ARG 175 Ca -0.26 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 59.62 3g7f h ARG 175 Cb 1.09 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 31.12 3g7f h ARG 175 CO 0.92 0.10 -0.99 0.77 -1.07 0.00 0.00 179.97 179.70 3g7f h SER 176 N 0.00 0.00 -0.00 7.04 0.02 -1.93 -3.35 113.55 115.33 3g7f h SER 176 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3g7f h SER 176 Cb 0.41 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.95 3g7f h SER 176 CO 0.01 0.71 -0.01 -0.62 -1.14 0.00 0.00 176.83 175.79 3g7f n GLU 177 N -3.16 0.03 -3.36 3.45 1.02 -1.12 -5.04 120.64 112.46 3g7f n GLU 177 Ca -0.03 -0.54 -0.17 0.00 -0.02 0.00 0.00 57.16 56.39 3g7f n GLU 177 Cb 0.85 -0.99 0.07 0.00 -0.02 0.00 0.00 31.44 31.36 3g7f n GLU 177 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 3g7f n HIS 178 N -0.02 -2.32 -3.67 -0.32 8.25 0.48 -5.01 115.22 112.61 3g7f n HIS 178 Ca 0.01 0.84 -0.09 0.00 -0.26 0.00 0.00 57.72 58.22 3g7f n HIS 178 Cb 0.04 -4.29 -0.09 0.00 1.12 0.00 0.00 29.99 26.77 3g7f n HIS 178 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 3g7f s TYR 179 N -3.41 -0.78 0.16 4.41 5.04 -1.14 -4.98 117.35 116.65 3g7f s TYR 179 Ca 0.33 1.57 -0.30 0.00 -2.44 0.00 0.00 57.07 56.23 3g7f s TYR 179 Cb -0.05 0.38 -0.07 0.00 0.35 0.00 0.00 41.96 42.57 3g7f s TYR 179 CO 0.75 -0.43 1.05 -0.06 -1.34 0.00 0.00 175.55 175.53 3g7f s PHE 180 N 1.81 3.67 -0.01 4.97 0.08 -1.26 0.28 117.98 127.52 3g7f s PHE 180 Ca -0.08 1.66 0.03 0.00 0.12 0.00 0.00 56.93 58.66 3g7f s PHE 180 Cb -0.09 -3.20 -0.04 0.00 -0.57 0.00 0.00 43.02 39.12 3g7f s PHE 180 CO -0.15 -0.34 0.04 0.54 -0.10 0.00 0.00 175.22 175.22 3g7f n ARG 181 N 2.51 1.37 -4.02 0.44 1.74 0.01 -4.86 116.66 113.84 3g7f n ARG 181 Ca 0.03 -0.02 -0.11 0.00 -0.77 0.00 0.00 57.85 56.98 3g7f n ARG 181 Cb 0.47 -1.07 -0.11 0.00 -1.02 0.00 0.00 32.46 30.73 3g7f n ARG 181 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 3g7f s TYR 182 N -2.15 0.46 -0.06 -1.55 1.51 -1.13 -1.29 117.35 113.16 3g7f s TYR 182 Ca -0.01 -0.55 -0.03 0.00 -1.01 0.00 0.00 57.07 55.47 3g7f s TYR 182 Cb 0.01 -0.30 -0.04 0.00 -0.11 0.00 0.00 41.96 41.53 3g7f s TYR 182 CO 0.11 -0.15 0.12 -0.51 -1.11 0.00 0.00 175.55 174.01 3g7f s LEU 183 N -1.61 4.15 -0.13 -1.29 1.43 0.59 -0.45 118.68 121.37 3g7f s LEU 183 Ca -0.12 0.31 -0.04 0.00 -1.03 0.00 0.00 54.13 53.26 3g7f s LEU 183 Cb -0.09 -2.23 -0.03 0.00 0.03 0.00 0.00 46.19 43.87 3g7f s LEU 183 CO -0.01 0.33 0.00 -0.70 0.23 0.00 0.00 176.35 176.21 3g7f s GLU 184 N -1.43 3.44 0.08 1.70 2.12 0.38 -0.80 118.70 124.19 3g7f s GLU 184 Ca 0.20 -0.43 0.03 0.00 0.36 0.00 0.00 54.97 55.13 3g7f s GLU 184 Cb -0.12 -2.93 -0.03 0.00 0.26 0.00 0.00 34.13 31.30 3g7f s GLU 184 CO 0.10 0.46 -0.09 -0.48 -0.54 0.00 0.00 175.26 174.71 3g7f s LEU 185 N -0.20 2.38 -0.09 2.70 2.34 -0.05 -0.54 118.68 125.23 3g7f s LEU 185 Ca 0.05 -0.77 -0.24 0.00 0.06 0.00 0.00 54.13 53.22 3g7f s LEU 185 Cb -0.12 -0.23 -0.03 0.00 -0.56 0.00 0.00 46.19 45.24 3g7f s LEU 185 CO 0.02 -0.28 0.75 -0.44 -1.06 0.00 0.00 176.35 175.34 3g7f s SER 186 N -2.31 7.01 -0.31 1.48 0.01 0.73 -1.27 113.70 119.04 3g7f s SER 186 Ca 0.02 1.22 -0.23 0.00 1.31 0.00 0.00 55.95 58.27 3g7f s SER 186 Cb -0.03 -2.43 0.00 0.00 0.21 0.00 0.00 66.02 63.76 3g7f s SER 186 CO -0.01 -0.19 0.78 -0.69 0.41 0.00 0.00 173.24 173.54 3g7f s VAL 187 N 1.14 4.80 0.03 3.43 1.01 -0.56 -1.20 120.40 129.04 3g7f s VAL 187 Ca 0.39 1.16 -0.33 0.00 0.00 0.00 0.00 61.98 63.20 3g7f s VAL 187 Cb -0.18 -4.14 -0.12 0.00 0.00 0.00 0.00 36.38 31.94 3g7f s VAL 187 CO 0.18 -0.25 1.81 0.00 0.00 0.00 0.00 175.10 176.84 3g7f n ALA 188 N 6.19 1.32 -0.97 5.51 0.00 -0.47 -2.37 120.51 129.73 3g7f n ALA 188 Ca 0.03 0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.80 3g7f n ALA 188 Cb 0.48 -2.50 0.00 0.00 0.00 0.00 0.00 19.45 17.43 3g7f n ALA 188 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3g7f n GLY 189 N 4.14 0.76 0.10 0.00 0.00 -1.26 -4.85 105.19 104.09 3g7f n GLY 189 Ca 0.20 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.24 3g7f n GLY 189 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3g7f n SER 190 N -0.03 0.99 -3.72 1.61 7.64 -1.00 -5.02 113.62 114.08 3g7f n SER 190 Ca 0.00 -0.99 -0.22 0.00 1.01 0.00 0.00 58.87 58.66 3g7f n SER 190 Cb 0.01 0.27 0.03 0.00 -1.01 0.00 0.00 64.21 63.51 3g7f n SER 190 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3g7f n ALA 191 N -0.14 -2.07 -3.51 -0.43 0.00 -1.25 -4.95 120.51 108.15 3g7f n ALA 191 Ca 0.02 -0.18 -0.10 0.00 0.00 0.00 0.00 53.44 53.18 3g7f n ALA 191 Cb 0.08 -2.15 -0.02 0.00 0.00 0.00 0.00 19.45 17.36 3g7f n ALA 191 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 3g7f s ARG 192 N -6.02 1.14 0.29 0.00 1.70 -1.26 -5.08 118.95 109.72 3g7f s ARG 192 Ca 0.05 -0.46 0.07 0.00 -0.47 0.00 0.00 55.73 54.92 3g7f s ARG 192 Cb -0.01 0.50 -0.03 0.00 -0.57 0.00 0.00 34.95 34.83 3g7f s ARG 192 CO 0.83 -0.50 0.27 -0.08 -1.08 0.00 0.00 175.30 174.74 3g7f s THR 193 N -3.49 4.11 -0.13 4.99 -1.32 -1.26 -1.50 115.64 117.05 3g7f s THR 193 Ca 0.04 -1.32 -0.20 0.00 -1.21 0.00 0.00 61.69 59.00 3g7f s THR 193 Cb -0.01 -3.35 0.05 0.00 -1.51 0.00 0.00 72.50 67.67 3g7f s THR 193 CO -0.09 -0.26 0.52 0.00 -2.21 0.00 0.00 174.62 172.58 3g7f s ALA 194 N -2.19 -1.30 0.10 11.08 0.00 -0.39 -4.88 121.76 124.17 3g7f s ALA 194 Ca 0.37 1.21 0.00 0.00 0.00 0.00 0.00 51.96 53.55 3g7f s ALA 194 Cb -0.07 -0.48 -0.04 0.00 0.00 0.00 0.00 23.12 22.52 3g7f s ALA 194 CO 0.26 -0.28 0.26 -0.51 0.00 0.00 0.00 175.76 175.49 3g7f s LEU 195 N -0.38 4.34 -0.02 0.00 1.02 -1.26 -0.87 118.68 121.52 3g7f s LEU 195 Ca -0.05 0.26 0.00 0.00 0.02 0.00 0.00 54.13 54.36 3g7f s LEU 195 Cb -0.03 -2.98 0.02 0.00 0.02 0.00 0.00 46.19 43.22 3g7f s LEU 195 CO 0.03 0.11 0.01 -0.51 0.02 0.00 0.00 176.35 176.02 3g7f s ILE 196 N -1.62 0.02 0.39 -0.59 2.07 0.02 -4.98 121.20 116.51 3g7f s ILE 196 Ca 0.35 0.12 -0.26 0.00 -1.41 0.00 0.00 60.65 59.45 3g7f s ILE 196 Cb -0.12 -0.11 -0.09 0.00 0.13 0.00 0.00 42.46 42.27 3g7f s ILE 196 CO 0.28 0.08 1.30 -2.84 -1.91 0.00 0.00 174.94 171.85 3g7f s PRO 197 N 0.74 4.03 0.56 3.50 0.02 -1.26 -0.30 135.00 142.29 3g7f s PRO 197 Ca -0.06 2.16 0.25 0.00 0.02 0.00 0.00 61.00 63.36 3g7f s PRO 197 Cb -0.09 -2.80 1.50 0.00 0.02 0.00 0.00 34.50 33.13 3g7f s PRO 197 CO -0.02 -0.44 2.09 -0.07 -0.33 0.00 0.00 177.00 178.23 3g7f h LEU 198 N 2.79 0.00 -2.72 -5.54 3.38 -1.52 -1.27 115.31 110.44 3g7f h LEU 198 Ca -0.49 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.47 3g7f h LEU 198 Cb 1.24 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.99 3g7f h LEU 198 CO 0.63 0.00 -0.01 1.23 0.09 0.00 0.00 178.44 180.38 3g7f h GLY 199 N 0.00 0.00 -2.23 0.83 0.00 -1.91 0.72 103.07 100.48 3g7f h GLY 199 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.44 3g7f h GLY 199 CO -0.00 0.00 0.00 0.69 0.00 0.00 0.00 176.54 177.23 3g7f n PHE 200 N -3.25 0.71 -4.18 5.60 3.72 -0.48 -4.91 117.46 114.67 3g7f n PHE 200 Ca -0.03 -0.36 -0.34 0.00 -0.05 0.00 0.00 57.45 56.67 3g7f n PHE 200 Cb 0.10 0.00 -0.13 0.00 -0.94 0.00 0.00 39.48 38.51 3g7f n PHE 200 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3g7f s ASP 202 N 0.89 6.19 -0.41 0.00 -1.08 -0.05 -4.96 116.67 117.25 3g7f s ASP 202 Ca -0.00 -1.34 -0.26 0.00 -0.52 0.00 0.00 52.55 50.44 3g7f s ASP 202 Cb -0.14 -2.27 0.02 0.00 -1.46 0.00 0.00 42.92 39.06 3g7f s ASP 202 CO 0.02 -0.97 0.94 -0.69 0.52 0.00 0.00 175.17 174.98 3g7f s VAL 203 N 2.41 4.52 0.37 1.11 1.01 -1.26 -1.09 120.40 127.47 3g7f s VAL 203 Ca 0.10 1.02 0.08 0.00 0.00 0.00 0.00 61.98 63.18 3g7f s VAL 203 Cb -0.24 -4.39 -0.05 0.00 0.00 0.00 0.00 36.38 31.71 3g7f s VAL 203 CO 0.07 -0.68 0.16 -0.54 0.00 0.00 0.00 175.10 174.12 3g7f s LYS 204 N 3.63 2.29 0.33 2.72 1.02 0.27 -5.03 119.74 124.97 3g7f s LYS 204 Ca 0.38 -1.69 0.04 0.00 0.02 0.00 0.00 55.97 54.72 3g7f s LYS 204 Cb -0.11 -2.08 0.65 0.00 -0.52 0.00 0.00 37.83 35.77 3g7f s LYS 204 CO 0.22 0.00 1.92 0.87 -0.92 0.00 0.00 175.35 177.44 3g7f h LYS 205 N 1.49 0.85 -0.01 1.68 1.57 -2.00 -3.23 116.57 116.93 3g7f h LYS 205 Ca -0.43 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.30 3g7f h LYS 205 Cb 1.25 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 33.37 3g7f h LYS 205 CO 0.66 0.56 -0.12 -0.40 -0.57 0.00 0.00 179.45 179.58 3g7f n ASP 206 N -4.50 1.33 -3.65 0.86 5.75 -1.26 -5.01 116.55 110.07 3g7f n ASP 206 Ca 0.13 -1.17 -0.05 0.00 -0.01 0.00 0.00 54.79 53.69 3g7f n ASP 206 Cb 0.26 0.31 -0.02 0.00 -1.03 0.00 0.00 41.12 40.64 3g7f n ASP 206 CO 0.00 0.00 0.00 -1.59 -0.11 0.00 0.00 177.20 175.50 3g7f s LYS 207 N -1.07 1.02 -0.28 0.11 -2.85 -1.22 -4.40 119.74 111.06 3g7f s LYS 207 Ca 0.08 -0.50 -0.02 0.00 -1.00 0.00 0.00 55.97 54.53 3g7f s LYS 207 Cb 0.07 0.39 0.04 0.00 -2.06 0.00 0.00 37.83 36.27 3g7f s LYS 207 CO 0.18 -0.46 -0.03 0.42 0.10 0.00 0.00 175.35 175.56 3g7f s ILE 208 N -3.19 2.92 -0.13 3.79 -1.09 -0.46 -0.56 121.20 122.48 3g7f s ILE 208 Ca 0.09 -1.22 -0.18 0.00 -2.23 0.00 0.00 60.65 57.11 3g7f s ILE 208 Cb -0.01 -2.59 -0.04 0.00 -1.58 0.00 0.00 42.46 38.24 3g7f s ILE 208 CO -0.02 0.04 0.48 -0.69 -1.23 0.00 0.00 174.94 173.52 3g7f s VAL 209 N 1.28 5.17 -0.28 2.92 1.01 -0.25 0.06 120.40 130.32 3g7f s VAL 209 Ca -0.03 0.95 0.02 0.00 0.00 0.00 0.00 61.98 62.93 3g7f s VAL 209 Cb -0.18 -3.82 0.07 0.00 0.00 0.00 0.00 36.38 32.45 3g7f s VAL 209 CO -0.03 0.30 -0.04 -0.69 0.00 0.00 0.00 175.10 174.64 3g7f s VAL 210 N 0.82 1.92 -1.22 2.92 1.01 0.10 -0.87 120.40 125.08 3g7f s VAL 210 Ca 0.26 -1.69 0.26 0.00 0.00 0.00 0.00 61.98 60.81 3g7f s VAL 210 Cb -0.15 -2.20 0.12 0.00 0.00 0.00 0.00 36.38 34.15 3g7f s VAL 210 CO 0.10 -0.25 1.54 0.35 0.00 0.00 0.00 175.10 176.84 3g7f n THR 211 N 4.48 0.00 0.07 3.92 -2.24 -1.26 -1.48 114.28 117.77 3g7f n THR 211 Ca -0.08 -0.03 -0.07 0.00 -2.27 0.00 0.00 64.05 61.60 3g7f n THR 211 Cb 0.43 0.18 0.07 0.00 -2.10 0.00 0.00 70.33 68.91 3g7f n THR 211 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 3g7f h SER 212 N 0.31 0.36 -4.81 3.42 4.64 -1.88 -3.42 113.55 112.18 3g7f h SER 212 Ca 0.00 -0.22 -0.23 0.00 -0.47 0.00 0.00 61.79 60.87 3g7f h SER 212 Cb 0.49 -0.11 -0.15 0.00 -0.31 0.00 0.00 62.40 62.33 3g7f h SER 212 CO 0.00 0.92 -0.67 0.27 -0.87 0.00 0.00 176.83 176.48 3g7f s ILE 213 N -3.68 0.51 0.53 0.95 -4.36 -1.26 -3.40 121.20 110.48 3g7f s ILE 213 Ca -0.05 -1.93 -0.13 0.00 -0.26 0.00 0.00 60.65 58.28 3g7f s ILE 213 Cb 0.11 -1.91 -0.06 0.00 1.25 0.00 0.00 42.46 41.85 3g7f s ILE 213 CO 0.82 -0.65 0.95 -0.76 0.24 0.00 0.00 174.94 175.54 3g7f s LEU 214 N -3.08 3.54 0.21 0.37 1.43 -1.26 -1.62 118.68 118.27 3g7f s LEU 214 Ca 0.18 1.41 -0.11 0.00 -1.03 0.00 0.00 54.13 54.59 3g7f s LEU 214 Cb 0.06 -4.37 0.30 0.00 0.03 0.00 0.00 46.19 42.21 3g7f s LEU 214 CO -0.01 -0.64 1.67 0.77 0.23 0.00 0.00 176.35 178.37 3g7f h SER 215 N 0.55 -0.25 0.57 2.29 4.64 -1.90 0.76 113.55 120.20 3g7f h SER 215 Ca -0.46 0.15 0.00 0.00 -0.47 0.00 0.00 61.79 61.01 3g7f h SER 215 Cb 1.19 0.26 0.00 0.00 -0.31 0.00 0.00 62.40 63.54 3g7f h SER 215 CO 0.62 -0.11 0.00 -2.24 -0.87 0.00 0.00 176.83 174.23 3g7f h ASP 216 N 0.13 0.00 1.39 4.97 3.04 -1.95 -2.56 116.42 121.43 3g7f h ASP 216 Ca 0.32 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 54.11 3g7f h ASP 216 Cb 0.52 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.81 3g7f h ASP 216 CO -0.52 0.00 0.00 1.56 -2.04 0.00 0.00 179.24 178.24 3g7f h GLN 217 N 0.00 0.00 0.00 4.15 4.20 -1.22 -3.03 115.11 119.22 3g7f h GLN 217 Ca 0.00 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.71 3g7f h GLN 217 Cb 0.28 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.06 3g7f h GLN 217 CO 0.00 0.00 -0.02 0.74 -0.67 0.00 0.00 178.83 178.88 3g7f h PHE 218 N 0.00 0.00 -0.17 2.96 -1.00 -1.49 -2.95 116.94 114.29 3g7f h PHE 218 Ca 0.00 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.77 3g7f h PHE 218 Cb 0.69 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.24 3g7f h PHE 218 CO 0.00 0.02 0.05 0.00 -1.61 0.00 0.00 178.31 176.77 3g7f h ALA 219 N 1.98 1.77 -0.47 2.45 0.00 -1.74 -3.03 119.26 120.22 3g7f h ALA 219 Ca -0.00 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.84 3g7f h ALA 219 Cb 0.09 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3g7f h ALA 219 CO 0.00 0.19 0.00 0.09 0.00 0.00 0.00 179.25 179.53 3g7f n ASN 220 N -4.45 4.17 -4.69 0.00 5.03 -1.11 -4.98 115.26 109.22 3g7f n ASN 220 Ca -0.00 -2.53 -0.44 0.00 0.87 0.00 0.00 54.58 52.47 3g7f n ASN 220 Cb 0.13 -0.50 -0.02 0.00 -1.02 0.00 0.00 39.78 38.37 3g7f n ASN 220 CO 0.00 0.00 0.00 0.52 -1.83 0.00 0.00 177.26 175.95 3g7f n VAL 221 N 0.50 1.07 -1.64 2.41 0.31 -1.15 -4.87 118.33 114.96 3g7f n VAL 221 Ca 0.21 -0.27 -0.44 0.00 -0.01 0.00 0.00 64.34 63.84 3g7f n VAL 221 Cb 0.81 -1.61 -0.01 0.00 -0.91 0.00 0.00 33.84 32.11 3g7f n VAL 221 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 3g7f n PRO 222 N 1.91 1.72 -3.49 5.55 -0.02 -1.26 -4.97 135.00 134.44 3g7f n PRO 222 Ca 0.10 0.61 -0.35 0.00 -2.02 0.00 0.00 63.50 61.83 3g7f n PRO 222 Cb 0.33 -2.10 -0.06 0.00 -0.02 0.00 0.00 33.50 31.66 3g7f n PRO 222 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 3g7f s ARG 223 N -1.51 3.85 0.64 -0.52 0.52 -1.26 -4.76 118.95 115.92 3g7f s ARG 223 Ca 0.59 0.31 -0.11 0.00 -0.52 0.00 0.00 55.73 55.99 3g7f s ARG 223 Cb -0.65 -3.00 -0.03 0.00 0.52 0.00 0.00 34.95 31.79 3g7f s ARG 223 CO 0.59 0.55 1.04 -0.51 0.02 0.00 0.00 175.30 176.99 3g7f s LEU 224 N -1.83 3.22 0.04 2.53 1.43 -1.26 -4.99 118.68 117.82 3g7f s LEU 224 Ca 0.33 1.50 0.08 0.00 -1.03 0.00 0.00 54.13 55.01 3g7f s LEU 224 Cb -0.15 -4.48 -0.23 0.00 0.03 0.00 0.00 46.19 41.37 3g7f s LEU 224 CO 0.18 -1.05 0.96 -0.61 0.23 0.00 0.00 176.35 176.07 3g7f h GLN 225 N -0.37 0.03 -6.03 1.70 5.75 -1.99 -3.46 115.11 110.75 3g7f h GLN 225 Ca -0.44 -0.06 -0.55 0.00 -0.15 0.00 0.00 58.65 57.46 3g7f h GLN 225 Cb 1.20 0.02 -0.17 0.00 1.07 0.00 0.00 27.48 29.60 3g7f h GLN 225 CO 0.60 0.80 -0.78 -1.12 -2.65 0.00 0.00 178.83 175.69 3g7f s SER 226 N -6.49 2.92 0.21 -0.69 0.01 -1.26 -5.06 113.70 103.35 3g7f s SER 226 Ca -0.03 -0.91 0.08 0.00 1.31 0.00 0.00 55.95 56.40 3g7f s SER 226 Cb 0.09 -0.19 0.15 0.00 0.21 0.00 0.00 66.02 66.28 3g7f s SER 226 CO 0.83 -0.02 1.49 0.03 0.41 0.00 0.00 173.24 175.98 3g7f h ARG 227 N 2.99 0.05 0.00 12.44 -0.00 -2.04 -3.37 114.38 124.45 3g7f h ARG 227 Ca -0.42 -0.05 0.00 0.00 -0.50 0.00 0.00 59.98 59.01 3g7f h ARG 227 Cb 1.22 0.01 0.00 0.00 0.00 0.00 0.00 29.97 31.20 3g7f h ARG 227 CO 0.54 0.78 -0.01 -0.25 0.00 0.00 0.00 179.97 181.02 3g7f n ASP 228 N -3.68 1.78 -3.71 7.04 8.00 -1.26 -4.98 116.55 119.74 3g7f n ASP 228 Ca -0.01 -2.02 -0.10 0.00 0.71 0.00 0.00 54.79 53.36 3g7f n ASP 228 Cb 0.72 -0.06 -0.06 0.00 -0.02 0.00 0.00 41.12 41.71 3g7f n ASP 228 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3g7f s GLN 229 N -1.10 0.97 -0.03 -1.24 -2.07 -1.26 -4.55 119.66 110.38 3g7f s GLN 229 Ca 0.04 -0.76 -0.01 0.00 -1.82 0.00 0.00 55.36 52.81 3g7f s GLN 229 Cb 0.03 0.42 0.02 0.00 -1.09 0.00 0.00 33.01 32.40 3g7f s GLN 229 CO 0.00 -0.35 0.06 -1.50 -1.32 0.00 0.00 175.29 172.18 3g7f s ILE 230 N -3.69 -0.03 0.62 3.63 2.07 -1.26 -4.46 121.20 118.08 3g7f s ILE 230 Ca 0.03 0.12 -0.10 0.00 -1.41 0.00 0.00 60.65 59.29 3g7f s ILE 230 Cb 0.03 -0.11 -0.01 0.00 0.13 0.00 0.00 42.46 42.49 3g7f s ILE 230 CO -0.11 0.05 1.00 0.42 -1.91 0.00 0.00 174.94 174.39 3g7f s THR 231 N 0.66 4.18 0.27 4.00 -4.23 -1.26 -4.07 115.64 115.20 3g7f s THR 231 Ca -0.05 0.52 -0.01 0.00 -1.18 0.00 0.00 61.69 60.97 3g7f s THR 231 Cb -0.07 -3.68 0.26 0.00 1.34 0.00 0.00 72.50 70.35 3g7f s THR 231 CO -0.02 -0.83 1.84 -0.07 -0.54 0.00 0.00 174.62 174.99 3g7f h LEU 232 N -0.33 0.90 -0.44 4.79 3.38 -0.95 -0.14 115.31 122.53 3g7f h LEU 232 Ca -0.45 0.04 -0.17 0.00 0.09 0.00 0.00 57.88 57.39 3g7f h LEU 232 Cb 1.22 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.82 3g7f h LEU 232 CO 0.62 0.51 -0.50 -0.09 0.09 0.00 0.00 178.44 179.08 3g7f h ARG 233 N 1.00 0.74 -0.68 1.13 2.43 -1.74 -2.68 114.38 114.58 3g7f h ARG 233 Ca 0.46 -0.44 -0.04 0.00 -0.81 0.00 0.00 59.98 59.15 3g7f h ARG 233 Cb 0.38 0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.94 3g7f h ARG 233 CO -0.24 1.07 0.28 0.93 -1.51 0.00 0.00 179.97 180.50 3g7f h GLU 234 N 0.58 1.00 -0.95 0.20 5.08 -1.73 0.16 114.58 118.92 3g7f h GLU 234 Ca 0.03 -0.18 0.10 0.00 -1.00 0.00 0.00 59.36 58.30 3g7f h GLU 234 Cb 1.07 -0.17 -0.08 0.00 0.50 0.00 0.00 28.75 30.08 3g7f h GLU 234 CO 0.10 0.83 0.59 0.93 -1.00 0.00 0.00 179.01 180.47 3g7f h GLU 235 N 0.95 0.97 -0.07 2.33 5.08 -0.91 0.85 114.58 123.79 3g7f h GLU 235 Ca 0.23 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.51 3g7f h GLU 235 Cb 0.19 -0.22 -0.00 0.00 0.50 0.00 0.00 28.75 29.22 3g7f h GLU 235 CO -0.02 0.64 -0.03 -0.44 -1.00 0.00 0.00 179.01 178.17 3g7f h ASP 236 N 1.00 0.14 -0.64 1.42 5.19 -1.03 -1.60 116.42 120.90 3g7f h ASP 236 Ca 0.45 -0.40 0.09 0.00 -0.62 0.00 0.00 57.03 56.55 3g7f h ASP 236 Cb 0.35 -0.04 -0.07 0.00 0.18 0.00 0.00 39.33 39.75 3g7f h ASP 236 CO -0.23 0.51 0.29 0.11 -3.12 0.00 0.00 179.24 176.79 3g7f h LYS 237 N -0.23 0.49 0.29 3.56 1.57 -0.05 -0.25 116.57 121.96 3g7f h LYS 237 Ca 0.02 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.75 3g7f h LYS 237 Cb 0.45 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.65 3g7f h LYS 237 CO 0.01 0.32 -0.14 0.28 -0.57 0.00 0.00 179.45 179.35 3g7f h VAL 238 N 0.50 0.72 -0.71 0.50 2.07 -0.79 -2.78 116.25 115.76 3g7f h VAL 238 Ca 0.32 -0.62 0.11 0.00 0.82 0.00 0.00 66.70 67.32 3g7f h VAL 238 Cb 0.35 1.04 -0.08 0.00 -1.52 0.00 0.00 31.29 31.08 3g7f h VAL 238 CO -0.27 0.12 0.33 0.28 0.02 0.00 0.00 177.57 178.05 3g7f h SER 239 N -0.74 0.40 0.34 0.57 0.02 -1.20 -2.73 113.55 110.21 3g7f h SER 239 Ca -0.04 0.07 -0.05 0.00 -0.84 0.00 0.00 61.79 60.93 3g7f h SER 239 Cb 0.50 0.01 -0.01 0.00 0.14 0.00 0.00 62.40 63.04 3g7f h SER 239 CO 0.06 0.21 -0.25 0.00 -1.14 0.00 0.00 176.83 175.72 3g7f h ALA 240 N 1.46 1.44 -0.20 3.77 0.00 -1.00 -2.60 119.26 122.13 3g7f h ALA 240 Ca 0.36 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 3g7f h ALA 240 Cb 0.44 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 3g7f h ALA 240 CO -0.30 0.32 -0.08 -0.92 0.00 0.00 0.00 179.25 178.26 3g7f h TYR 241 N 0.00 0.46 -0.45 0.00 3.20 -1.19 -0.00 116.97 118.98 3g7f h TYR 241 Ca -0.00 -0.11 -0.11 0.00 3.14 0.00 0.00 58.73 61.65 3g7f h TYR 241 Cb 0.49 -0.11 -0.02 0.00 1.54 0.00 0.00 36.73 38.64 3g7f h TYR 241 CO 0.00 0.68 -0.14 1.88 -1.64 0.00 0.00 178.16 178.94 3g7f h TYR 242 N 0.10 0.94 -0.57 -3.82 0.05 -1.57 -2.78 116.97 109.32 3g7f h TYR 242 Ca 0.05 -0.19 -0.04 0.00 0.05 0.00 0.00 58.73 58.60 3g7f h TYR 242 Cb 0.55 -0.23 -0.03 0.00 1.01 0.00 0.00 36.73 38.03 3g7f h TYR 242 CO 0.06 0.93 0.19 0.00 -1.05 0.00 0.00 178.16 178.29 3g7f h ALA 243 N 1.08 1.26 -0.92 3.88 0.00 -1.28 -0.10 119.26 123.18 3g7f h ALA 243 Ca 0.12 -0.18 0.09 0.00 0.00 0.00 0.00 54.91 54.94 3g7f h ALA 243 Cb 0.66 -0.23 -0.07 0.00 0.00 0.00 0.00 17.79 18.15 3g7f h ALA 243 CO 0.05 0.53 0.59 0.78 0.00 0.00 0.00 179.25 181.20 3g7f h GLY 244 N 0.97 1.35 1.62 0.00 0.00 -0.72 -1.43 103.07 104.86 3g7f h GLY 244 Ca 0.19 -0.39 0.02 0.00 0.00 0.00 0.00 47.33 47.16 3g7f h GLY 244 CO -0.01 0.23 0.20 -1.33 0.00 0.00 0.00 176.54 175.63 3g7f h GLY 245 N 0.95 0.34 1.12 4.60 0.00 -0.83 0.83 103.07 110.08 3g7f h GLY 245 Ca 0.42 -0.12 0.10 0.00 0.00 0.00 0.00 47.33 47.73 3g7f h GLY 245 CO -0.18 0.11 0.35 1.41 0.00 0.00 0.00 176.54 178.23 3g7f h LEU 246 N 0.31 0.22 0.00 3.11 3.38 -1.17 -0.55 115.31 120.61 3g7f h LEU 246 Ca 0.12 0.01 -0.06 0.00 0.09 0.00 0.00 57.88 58.04 3g7f h LEU 246 Cb 0.11 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 3g7f h LEU 246 CO -0.03 0.13 -1.73 -0.11 0.09 0.00 0.00 178.44 176.79 3g7f n LEU 247 N -4.45 0.00 0.00 1.67 7.94 -0.68 -4.79 117.00 116.69 3g7f n LEU 247 Ca 0.08 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.98 3g7f n LEU 247 Cb 0.41 0.08 0.00 0.00 0.53 0.00 0.00 43.42 44.44 3g7f n LEU 247 CO 0.35 0.08 0.09 -1.22 -1.11 0.00 0.00 177.39 175.58 3g7f n TYR 248 N -2.13 0.00 -0.17 1.96 4.01 0.20 -2.27 117.16 118.77 3g7f n TYR 248 Ca -0.07 0.00 0.15 0.00 -0.16 0.00 0.00 57.90 57.82 3g7f n TYR 248 Cb 0.52 0.00 0.50 0.00 -0.31 0.00 0.00 39.34 40.05 3g7f n TYR 248 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3g7f h ALA 249 N 0.00 2.10 -3.01 -0.72 0.00 -1.29 -3.41 119.26 112.93 3g7f h ALA 249 Ca 0.00 -0.00 -0.30 0.00 0.00 0.00 0.00 54.91 54.61 3g7f h ALA 249 Cb 0.03 -0.06 -0.20 0.00 0.00 0.00 0.00 17.79 17.55 3g7f h ALA 249 CO 0.00 -0.30 -0.74 0.95 0.00 0.00 0.00 179.25 179.16 3g7f s THR 250 N -5.42 0.75 0.55 0.00 -4.23 -1.26 -4.80 115.64 101.24 3g7f s THR 250 Ca -0.08 -1.34 0.24 0.00 -1.18 0.00 0.00 61.69 59.33 3g7f s THR 250 Cb 0.21 -0.98 0.35 0.00 1.34 0.00 0.00 72.50 73.42 3g7f s THR 250 CO 0.77 -0.45 2.09 -0.65 -0.54 0.00 0.00 174.62 175.84 3g7f h PRO 251 N 4.08 0.00 0.00 3.99 0.11 -1.91 -2.39 132.00 135.88 3g7f h PRO 251 Ca -0.37 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.70 3g7f h PRO 251 Cb 1.19 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 3g7f h PRO 251 CO 0.46 0.00 -0.21 1.49 -0.21 0.00 0.00 178.00 179.53 3g7f h GLU 252 N 0.00 0.00 0.00 1.05 4.81 -1.95 -3.27 114.58 115.22 3g7f h GLU 252 Ca 0.11 0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 59.27 3g7f h GLU 252 Cb 0.51 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.88 3g7f h GLU 252 CO -0.00 0.21 -0.37 0.00 -0.73 0.00 0.00 179.01 178.12 3g7f h ARG 253 N 0.00 0.00 0.00 1.92 3.08 -1.62 -2.06 114.38 115.70 3g7f h ARG 253 Ca -0.00 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.02 3g7f h ARG 253 Cb 0.38 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.43 3g7f h ARG 253 CO 0.03 0.37 -0.15 0.00 -1.07 0.00 0.00 179.97 179.14 3g7f h ALA 254 N 1.63 0.97 -2.44 0.04 0.00 -1.50 -3.45 119.26 114.50 3g7f h ALA 254 Ca -0.00 -0.14 -0.49 0.00 0.00 0.00 0.00 54.91 54.28 3g7f h ALA 254 Cb 0.77 -0.02 0.07 0.00 0.00 0.00 0.00 17.79 18.61 3g7f h ALA 254 CO 0.05 0.19 0.37 -1.21 0.00 0.00 0.00 179.25 178.64 3g7f s GLU 255 N -3.49 2.83 -0.00 0.00 0.41 -0.78 -4.95 118.70 112.73 3g7f s GLU 255 Ca 0.02 0.35 -0.36 0.00 -0.41 0.00 0.00 54.97 54.57 3g7f s GLU 255 Cb 0.09 -2.07 -0.15 0.00 -1.78 0.00 0.00 34.13 30.22 3g7f s GLU 255 CO 0.63 -1.00 1.58 0.00 -0.49 0.00 0.00 175.26 175.98 3g7f n ALA 256 N -2.94 0.11 0.24 5.21 0.00 -1.26 -4.87 120.51 116.99 3g7f n ALA 256 Ca 0.06 0.43 0.09 0.00 0.00 0.00 0.00 53.44 54.02 3g7f n ALA 256 Cb 0.57 -2.25 0.58 0.00 0.00 0.00 0.00 19.45 18.36 3g7f n ALA 256 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3g7f h LEU 257 N 6.27 0.00 -0.75 0.00 3.38 -1.92 -3.51 115.31 118.78 3g7f h LEU 257 Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.50 3g7f h LEU 257 Cb 1.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.05 3g7f h LEU 257 CO 0.87 0.19 0.00 0.18 0.09 0.00 0.00 178.44 179.78