#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2g0b n PRO 3 N 0.00 0.00 -3.70 1.09 -0.02 -1.26 -5.00 135.00 126.11 2g0b n PRO 3 Ca 0.00 0.00 -0.37 0.00 -2.02 0.00 0.00 63.50 61.11 2g0b n PRO 3 Cb 0.00 -0.28 -0.12 0.00 -0.02 0.00 0.00 33.50 33.08 2g0b n PRO 3 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 2g0b s ARG 4 N -0.25 3.62 -0.06 -0.52 3.52 -1.26 -4.93 118.95 119.06 2g0b s ARG 4 Ca 0.18 -0.51 -0.18 0.00 -0.13 0.00 0.00 55.73 55.08 2g0b s ARG 4 Cb -0.26 -3.44 -0.05 0.00 -1.56 0.00 0.00 34.95 29.64 2g0b s ARG 4 CO 0.15 -0.25 0.51 0.15 -0.81 0.00 0.00 175.30 175.05 2g0b s LYS 5 N 1.64 4.26 -0.09 5.12 1.02 -1.26 -0.12 119.74 130.31 2g0b s LYS 5 Ca 0.06 0.54 -0.00 0.00 0.02 0.00 0.00 55.97 56.59 2g0b s LYS 5 Cb -0.16 -3.37 0.02 0.00 -0.52 0.00 0.00 37.83 33.81 2g0b s LYS 5 CO 0.05 0.32 -0.05 0.08 -0.92 0.00 0.00 175.35 174.83 2g0b s VAL 6 N 0.06 0.75 -0.29 3.17 1.01 -0.49 -4.98 120.40 119.64 2g0b s VAL 6 Ca 0.27 -0.14 -0.07 0.00 0.00 0.00 0.00 61.98 62.04 2g0b s VAL 6 Cb -0.16 -0.81 0.00 0.00 0.00 0.00 0.00 36.38 35.41 2g0b s VAL 6 CO 0.13 0.31 0.08 0.00 0.00 0.00 0.00 175.10 175.63 2g0b s ALA 7 N 1.61 3.10 0.09 5.51 0.00 -1.26 -0.20 121.76 130.61 2g0b s ALA 7 Ca 0.01 -1.39 -0.10 0.00 0.00 0.00 0.00 51.96 50.48 2g0b s ALA 7 Cb -0.13 -2.15 0.01 0.00 0.00 0.00 0.00 23.12 20.84 2g0b s ALA 7 CO -0.05 -0.84 0.23 0.50 0.00 0.00 0.00 175.76 175.60 2g0b s ARG 8 N 1.53 0.88 0.19 0.00 3.52 -0.90 -5.00 118.95 119.17 2g0b s ARG 8 Ca 0.03 -0.90 -0.30 0.00 -0.13 0.00 0.00 55.73 54.44 2g0b s ARG 8 Cb -0.17 0.37 -0.08 0.00 -1.56 0.00 0.00 34.95 33.51 2g0b s ARG 8 CO 0.03 -0.29 1.01 0.42 -0.81 0.00 0.00 175.30 175.65 2g0b s ILE 9 N -3.81 4.07 -0.40 4.11 1.01 -1.26 -1.07 121.20 123.85 2g0b s ILE 9 Ca 0.04 1.89 -0.19 0.00 0.00 0.00 0.00 60.65 62.39 2g0b s ILE 9 Cb 0.04 -4.20 0.01 0.00 0.01 0.00 0.00 42.46 38.32 2g0b s ILE 9 CO -0.11 0.37 0.54 -0.76 0.00 0.00 0.00 174.94 174.98 2g0b s LEU 10 N -0.67 4.54 -0.20 2.97 1.43 0.09 -4.90 118.68 121.94 2g0b s LEU 10 Ca 0.45 -0.31 -0.02 0.00 -1.03 0.00 0.00 54.13 53.22 2g0b s LEU 10 Cb -0.27 -2.58 -0.12 0.00 0.03 0.00 0.00 46.19 43.25 2g0b s LEU 10 CO 0.33 -0.61 -0.20 0.52 0.23 0.00 0.00 176.35 176.62 2g0b n VAL 11 N 5.58 1.14 -2.13 -1.59 0.31 -1.26 -4.58 118.33 115.80 2g0b n VAL 11 Ca -0.04 -0.39 -0.41 0.00 -0.01 0.00 0.00 64.34 63.49 2g0b n VAL 11 Cb 0.48 -1.38 -0.02 0.00 -0.91 0.00 0.00 33.84 32.01 2g0b n VAL 11 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2g0b s ALA 12 N -2.39 3.53 0.53 3.52 0.00 -1.26 -4.93 121.76 120.75 2g0b s ALA 12 Ca -0.27 1.23 0.18 0.00 0.00 0.00 0.00 51.96 53.10 2g0b s ALA 12 Cb 0.08 -3.49 1.33 0.00 0.00 0.00 0.00 23.12 21.04 2g0b s ALA 12 CO 0.43 -0.62 2.13 -1.35 0.00 0.00 0.00 175.76 176.35 2g0b h PRO 13 N 4.13 0.00 -0.45 0.00 0.11 -1.99 -2.43 132.00 131.36 2g0b h PRO 13 Ca -0.47 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 65.51 2g0b h PRO 13 Cb 1.22 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 2g0b h PRO 13 CO 0.70 0.00 -0.23 -0.91 -0.21 0.00 0.00 178.00 177.35 2g0b h ASN 14 N 0.00 0.96 0.01 -2.05 2.35 -2.00 -2.43 115.58 112.42 2g0b h ASN 14 Ca 0.04 -0.37 -0.11 0.00 -0.55 0.00 0.00 56.30 55.31 2g0b h ASN 14 Cb 0.16 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.25 2g0b h ASN 14 CO -0.00 1.15 -0.31 -0.33 -1.65 0.00 0.00 177.43 176.28 2g0b h GLU 15 N 0.81 0.45 -0.43 0.81 5.08 -1.84 -2.81 114.58 116.64 2g0b h GLU 15 Ca 0.10 -0.19 -0.09 0.00 -1.00 0.00 0.00 59.36 58.18 2g0b h GLU 15 Cb 0.80 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.01 2g0b h GLU 15 CO 0.07 0.71 -0.11 0.00 -1.00 0.00 0.00 179.01 178.68 2g0b h ARG 16 N 0.39 0.77 -0.16 2.33 3.08 -1.34 -1.55 114.38 117.89 2g0b h ARG 16 Ca 0.05 -0.25 -0.10 0.00 0.07 0.00 0.00 59.98 59.74 2g0b h ARG 16 Cb 0.74 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.72 2g0b h ARG 16 CO 0.06 0.85 -0.34 -0.44 -1.07 0.00 0.00 179.97 179.03 2g0b h ASP 17 N 0.70 0.34 0.39 7.04 3.32 -1.31 -0.54 116.42 126.36 2g0b h ASP 17 Ca 0.12 -0.13 -0.17 0.00 0.02 0.00 0.00 57.03 56.87 2g0b h ASP 17 Cb 0.58 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.03 2g0b h ASP 17 CO 0.04 0.67 -0.72 0.00 -1.72 0.00 0.00 179.24 177.51 2g0b h ALA 18 N 1.36 0.68 -0.16 3.45 0.00 -1.31 -1.91 119.26 121.36 2g0b h ALA 18 Ca 0.04 -0.61 -0.15 0.00 0.00 0.00 0.00 54.91 54.19 2g0b h ALA 18 Cb 0.74 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 2g0b h ALA 18 CO 0.06 0.79 -0.52 0.00 0.00 0.00 0.00 179.25 179.58 2g0b h ALA 19 N 1.05 0.79 -0.08 0.00 0.00 -1.01 -2.66 119.26 117.35 2g0b h ALA 19 Ca -0.02 -0.50 -0.13 0.00 0.00 0.00 0.00 54.91 54.26 2g0b h ALA 19 Cb 1.28 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 2g0b h ALA 19 CO 0.11 0.68 -0.52 -0.09 0.00 0.00 0.00 179.25 179.44 2g0b h ARG 20 N 0.36 0.21 -0.23 0.00 2.43 -1.03 -2.73 114.38 113.40 2g0b h ARG 20 Ca 0.01 -0.12 -0.01 0.00 -0.81 0.00 0.00 59.98 59.05 2g0b h ARG 20 Cb 1.03 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.58 2g0b h ARG 20 CO 0.09 0.68 0.09 0.00 -1.51 0.00 0.00 179.97 179.33 2g0b h ARG 21 N 0.17 0.35 -0.58 0.20 3.08 -1.18 0.13 114.38 116.54 2g0b h ARG 21 Ca 0.00 -0.06 -0.05 0.00 0.07 0.00 0.00 59.98 59.94 2g0b h ARG 21 Cb 0.97 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.94 2g0b h ARG 21 CO 0.08 0.39 0.16 0.82 -1.07 0.00 0.00 179.97 180.36 2g0b h ILE 22 N 0.22 1.23 0.01 2.04 2.04 -1.45 0.96 117.51 122.56 2g0b h ILE 22 Ca 0.08 -0.80 -0.00 0.00 1.00 0.00 0.00 64.86 65.14 2g0b h ILE 22 Cb 0.18 0.61 0.00 0.00 -0.74 0.00 0.00 36.82 36.87 2g0b h ILE 22 CO -0.01 0.30 -0.00 0.58 0.00 0.00 0.00 178.15 179.02 2g0b h VAL 23 N 0.85 1.21 0.00 1.67 2.07 -1.36 -1.62 116.25 119.08 2g0b h VAL 23 Ca 0.19 -0.65 -0.03 0.00 0.82 0.00 0.00 66.70 67.03 2g0b h VAL 23 Cb 0.27 1.65 -0.00 0.00 -1.52 0.00 0.00 31.29 31.69 2g0b h VAL 23 CO -0.01 0.17 -0.12 0.08 0.02 0.00 0.00 177.57 177.71 2g0b h ARG 24 N -0.29 0.00 -0.00 1.57 0.11 -0.61 -0.28 114.38 114.87 2g0b h ARG 24 Ca -0.00 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.08 2g0b h ARG 24 Cb 0.28 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.36 2g0b h ARG 24 CO 0.00 0.12 -0.01 1.15 0.10 0.00 0.00 179.97 181.34 2g0b h THR 25 N 0.00 1.54 -0.88 0.08 2.02 -0.72 -2.13 112.91 112.82 2g0b h THR 25 Ca -0.00 -1.61 0.00 0.00 0.77 0.00 0.00 66.41 65.57 2g0b h THR 25 Cb 0.41 2.63 -0.04 0.00 -1.74 0.00 0.00 68.15 69.41 2g0b h THR 25 CO 0.02 0.42 0.56 0.74 0.37 0.00 0.00 175.52 177.63 2g0b h THR 26 N -0.67 1.23 -0.09 3.16 2.02 -0.83 -1.36 112.91 116.37 2g0b h THR 26 Ca -0.00 -0.46 -0.24 0.00 0.77 0.00 0.00 66.41 66.48 2g0b h THR 26 Cb 0.69 -0.04 0.01 0.00 -1.74 0.00 0.00 68.15 67.07 2g0b h THR 26 CO 0.00 0.23 -0.88 1.88 0.37 0.00 0.00 175.52 177.13 2g0b h TYR 27 N 1.20 1.03 -0.19 3.16 -1.99 -1.15 -2.64 116.97 116.39 2g0b h TYR 27 Ca 0.32 -0.50 -0.08 0.00 2.00 0.00 0.00 58.73 60.48 2g0b h TYR 27 Cb -0.10 -0.14 -0.01 0.00 2.00 0.00 0.00 36.73 38.47 2g0b h TYR 27 CO -0.01 1.33 -0.22 0.93 -0.00 0.00 0.00 178.16 180.20 2g0b h GLU 28 N 0.47 0.34 0.00 4.88 5.08 -1.24 0.99 114.58 125.10 2g0b h GLU 28 Ca -0.08 -0.11 -0.09 0.00 -1.00 0.00 0.00 59.36 58.09 2g0b h GLU 28 Cb 1.51 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.72 2g0b h GLU 28 CO 0.18 0.54 -0.41 0.00 -1.00 0.00 0.00 179.01 178.32 2g0b h ALA 29 N 1.47 1.06 -0.20 3.43 0.00 -1.14 -3.12 119.26 120.77 2g0b h ALA 29 Ca 0.05 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.59 2g0b h ALA 29 Cb 0.56 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2g0b h ALA 29 CO 0.04 0.51 0.00 1.04 0.00 0.00 0.00 179.25 180.84 2g0b n GLN 30 N -3.67 2.33 -0.75 0.00 6.02 -1.01 -4.95 117.38 115.35 2g0b n GLN 30 Ca -0.01 -2.06 0.00 0.00 -0.01 0.00 0.00 57.00 54.92 2g0b n GLN 30 Cb 0.50 -1.47 0.00 0.00 1.02 0.00 0.00 30.24 30.29 2g0b n GLN 30 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2g0b n GLY 31 N 1.37 0.64 3.79 1.08 0.00 -0.93 -5.04 105.19 106.09 2g0b n GLY 31 Ca 0.16 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.82 2g0b n GLY 31 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2g0b s TYR 32 N -2.10 3.31 0.33 1.61 4.12 0.30 -4.97 117.35 119.95 2g0b s TYR 32 Ca 0.00 1.66 -0.12 0.00 0.02 0.00 0.00 57.07 58.63 2g0b s TYR 32 Cb 0.00 -3.07 -0.07 0.00 -1.52 0.00 0.00 41.96 37.30 2g0b s TYR 32 CO 0.00 -0.47 0.70 0.00 0.02 0.00 0.00 175.55 175.79 2g0b s ALA 33 N -1.72 3.40 -0.16 3.71 0.00 0.29 -4.17 121.76 123.11 2g0b s ALA 33 Ca 0.58 -0.15 0.01 0.00 0.00 0.00 0.00 51.96 52.40 2g0b s ALA 33 Cb -0.20 -2.65 0.00 0.00 0.00 0.00 0.00 23.12 20.28 2g0b s ALA 33 CO 0.25 0.24 -0.17 0.42 0.00 0.00 0.00 175.76 176.50 2g0b s ILE 34 N -2.09 2.43 0.22 0.00 1.01 -1.26 -4.37 121.20 117.14 2g0b s ILE 34 Ca 0.51 -0.84 0.08 0.00 0.00 0.00 0.00 60.65 60.39 2g0b s ILE 34 Cb -0.10 -2.02 -0.05 0.00 0.01 0.00 0.00 42.46 40.30 2g0b s ILE 34 CO 0.24 0.52 -0.13 1.51 0.00 0.00 0.00 174.94 177.08 2g0b s ASP 35 N 0.91 2.67 0.00 3.58 -4.77 -1.26 -5.05 116.67 112.75 2g0b s ASP 35 Ca -0.04 -1.05 0.20 0.00 -3.30 0.00 0.00 52.55 48.36 2g0b s ASP 35 Cb -0.15 -0.15 1.12 0.00 -1.09 0.00 0.00 42.92 42.65 2g0b s ASP 35 CO -0.02 -0.19 1.63 -0.62 0.70 0.00 0.00 175.17 176.67 2g0b n GLU 36 N -0.43 0.45 0.06 2.11 1.02 -1.26 -3.59 120.64 119.01 2g0b n GLU 36 Ca -0.07 0.05 0.02 0.00 -0.02 0.00 0.00 57.16 57.14 2g0b n GLU 36 Cb 0.61 -1.50 0.38 0.00 -0.02 0.00 0.00 31.44 30.91 2g0b n GLU 36 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2g0b h SER 37 N 0.00 0.36 -0.06 1.62 4.64 -1.97 -1.74 113.55 116.39 2g0b h SER 37 Ca 0.00 -0.05 -0.13 0.00 -0.47 0.00 0.00 61.79 61.14 2g0b h SER 37 Cb 0.10 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 62.09 2g0b h SER 37 CO 0.00 0.41 -0.37 -0.26 -0.87 0.00 0.00 176.83 175.74 2g0b h PHE 38 N 0.38 0.67 -0.13 4.77 0.05 -1.98 -3.09 116.94 117.61 2g0b h PHE 38 Ca 0.09 -0.18 -0.11 0.00 3.82 0.00 0.00 57.97 61.58 2g0b h PHE 38 Cb 0.24 -0.15 -0.01 0.00 2.00 0.00 0.00 35.95 38.03 2g0b h PHE 38 CO 0.01 0.86 -0.41 0.00 -0.18 0.00 0.00 178.31 178.59 2g0b h ALA 39 N 1.12 1.07 -0.22 2.45 0.00 -1.57 -2.43 119.26 119.69 2g0b h ALA 39 Ca 0.05 -0.41 -0.11 0.00 0.00 0.00 0.00 54.91 54.43 2g0b h ALA 39 Cb 0.86 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 2g0b h ALA 39 CO 0.07 0.60 -0.35 1.15 0.00 0.00 0.00 179.25 180.72 2g0b h THR 40 N 0.24 1.29 -0.17 0.00 2.02 -1.37 -2.83 112.91 112.09 2g0b h THR 40 Ca 0.02 -1.46 -0.09 0.00 0.77 0.00 0.00 66.41 65.65 2g0b h THR 40 Cb 0.82 1.51 -0.00 0.00 -1.74 0.00 0.00 68.15 68.74 2g0b h THR 40 CO 0.07 0.46 -0.23 -0.26 0.37 0.00 0.00 175.52 175.92 2g0b h PHE 41 N 0.40 0.56 0.00 3.16 -1.00 -1.44 -3.21 116.94 115.41 2g0b h PHE 41 Ca 0.04 -0.18 0.00 0.00 2.81 0.00 0.00 57.97 60.64 2g0b h PHE 41 Cb 0.81 -0.11 0.00 0.00 3.61 0.00 0.00 35.95 40.26 2g0b h PHE 41 CO 0.03 0.87 0.00 -0.07 -1.61 0.00 0.00 178.31 177.52 2g0b h LEU 42 N 0.09 0.00 0.00 1.54 3.38 -1.38 -1.25 115.31 117.69 2g0b h LEU 42 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2g0b h LEU 42 Cb 0.80 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.55 2g0b h LEU 42 CO 0.05 0.00 -0.52 -0.62 0.09 0.00 0.00 178.44 177.45 2g0b n GLU 43 N -2.77 0.10 -1.44 1.13 1.02 -1.07 -4.83 120.64 112.77 2g0b n GLU 43 Ca 0.02 0.03 -0.29 0.00 -0.02 0.00 0.00 57.16 56.90 2g0b n GLU 43 Cb 0.31 -1.56 0.16 0.00 -0.02 0.00 0.00 31.44 30.32 2g0b n GLU 43 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2g0b s GLY 44 N -3.23 1.58 0.33 0.62 0.00 -0.47 -4.98 107.32 101.18 2g0b s GLY 44 Ca 0.09 -0.58 0.14 0.00 0.00 0.00 0.00 44.72 44.38 2g0b s GLY 44 CO 0.70 0.04 1.70 -2.55 0.00 0.00 0.00 173.10 172.98 2g0b h PRO 45 N -1.69 0.00 -0.73 2.90 0.11 -1.93 -3.24 132.00 127.42 2g0b h PRO 45 Ca -0.51 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.51 2g0b h PRO 45 Cb 1.32 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.38 2g0b h PRO 45 CO 0.57 0.49 0.12 -1.13 -0.21 0.00 0.00 178.00 177.84 2g0b n SER 46 N -3.75 4.61 -4.27 -2.05 3.41 -1.26 -4.91 113.62 105.40 2g0b n SER 46 Ca -0.01 -2.88 -0.25 0.00 -0.26 0.00 0.00 58.87 55.46 2g0b n SER 46 Cb 0.54 -0.68 -0.14 0.00 -0.26 0.00 0.00 64.21 63.67 2g0b n SER 46 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2g0b s ALA 47 N -2.50 1.81 -0.06 7.33 0.00 -1.22 -0.41 121.76 126.71 2g0b s ALA 47 Ca 0.45 -1.12 -0.02 0.00 0.00 0.00 0.00 51.96 51.27 2g0b s ALA 47 Cb 0.35 -0.33 0.03 0.00 0.00 0.00 0.00 23.12 23.17 2g0b s ALA 47 CO 0.12 0.40 0.03 0.99 0.00 0.00 0.00 175.76 177.30 2g0b s THR 48 N -0.89 0.13 -0.17 0.00 2.01 -0.73 -4.91 115.64 111.08 2g0b s THR 48 Ca 0.08 0.26 -0.07 0.00 0.31 0.00 0.00 61.69 62.27 2g0b s THR 48 Cb -0.09 -0.35 -0.04 0.00 0.01 0.00 0.00 72.50 72.03 2g0b s THR 48 CO 0.02 0.21 0.08 -0.89 -0.69 0.00 0.00 174.62 173.35 2g0b s THR 49 N 2.07 4.96 0.34 -0.82 2.01 -1.26 -1.88 115.64 121.07 2g0b s THR 49 Ca 0.05 0.02 0.08 0.00 0.31 0.00 0.00 61.69 62.15 2g0b s THR 49 Cb -0.12 -3.21 -0.03 0.00 0.01 0.00 0.00 72.50 69.15 2g0b s THR 49 CO -0.04 0.50 0.29 -0.36 -0.69 0.00 0.00 174.62 174.31 2g0b s PHE 50 N 0.02 2.87 -0.01 4.92 0.40 0.15 -0.73 117.98 125.60 2g0b s PHE 50 Ca 0.07 -0.32 -0.20 0.00 -0.60 0.00 0.00 56.93 55.87 2g0b s PHE 50 Cb -0.12 -1.82 0.04 0.00 0.51 0.00 0.00 43.02 41.63 2g0b s PHE 50 CO 0.01 0.17 0.44 0.20 0.70 0.00 0.00 175.22 176.74 2g0b s GLY 51 N -4.00 -0.31 -0.18 4.36 0.00 -0.23 -2.87 107.32 104.10 2g0b s GLY 51 Ca 0.41 0.61 -0.05 0.00 0.00 0.00 0.00 44.72 45.69 2g0b s GLY 51 CO 0.26 0.35 0.00 1.08 0.00 0.00 0.00 173.10 174.79 2g0b s LEU 52 N -1.46 3.39 -0.03 0.66 1.43 0.48 -2.13 118.68 121.03 2g0b s LEU 52 Ca -0.11 -0.10 0.05 0.00 -1.03 0.00 0.00 54.13 52.94 2g0b s LEU 52 Cb -0.03 -1.84 -0.03 0.00 0.03 0.00 0.00 46.19 44.32 2g0b s LEU 52 CO 0.04 0.13 -0.17 -0.36 0.23 0.00 0.00 176.35 176.23 2g0b s PHE 53 N 0.61 2.62 -0.56 0.29 0.40 0.72 -1.55 117.98 120.49 2g0b s PHE 53 Ca -0.00 -0.22 0.01 0.00 -0.60 0.00 0.00 56.93 56.12 2g0b s PHE 53 Cb -0.14 -1.58 0.14 0.00 0.51 0.00 0.00 43.02 41.96 2g0b s PHE 53 CO 0.02 0.17 0.33 1.21 0.70 0.00 0.00 175.22 177.65 2g0b s ASN 54 N -0.86 4.70 0.69 1.36 3.04 -0.52 -1.40 114.94 121.96 2g0b s ASN 54 Ca 0.12 -2.95 0.00 0.00 0.04 0.00 0.00 52.86 50.07 2g0b s ASN 54 Cb -0.10 -1.73 0.00 0.00 -1.54 0.00 0.00 41.25 37.88 2g0b s ASN 54 CO 0.01 -0.29 0.00 0.61 -3.04 0.00 0.00 177.10 174.40 2g0b n GLY 55 N 3.26 1.77 0.04 1.21 0.00 0.83 -3.29 105.19 109.01 2g0b n GLY 55 Ca 0.06 -0.25 0.02 0.00 0.00 0.00 0.00 46.02 45.84 2g0b n GLY 55 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2g0b n GLU 56 N 0.00 4.25 -2.84 1.61 1.02 -1.26 -4.86 120.64 118.56 2g0b n GLU 56 Ca 0.00 -0.19 -0.42 0.00 -0.02 0.00 0.00 57.16 56.53 2g0b n GLU 56 Cb 0.00 -0.76 -0.04 0.00 -0.02 0.00 0.00 31.44 30.62 2g0b n GLU 56 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2g0b s VAL 57 N -1.04 4.80 -0.05 2.62 1.01 -1.21 -5.03 120.40 121.51 2g0b s VAL 57 Ca 0.02 1.65 -0.30 0.00 0.00 0.00 0.00 61.98 63.35 2g0b s VAL 57 Cb 0.03 -4.16 -0.02 0.00 0.00 0.00 0.00 36.38 32.22 2g0b s VAL 57 CO 0.11 -0.11 1.00 -0.22 0.00 0.00 0.00 175.10 175.88 2g0b s LEU 58 N 2.93 4.32 0.00 3.92 2.96 -1.26 -1.43 118.68 130.11 2g0b s LEU 58 Ca 0.37 1.61 0.00 0.00 -0.22 0.00 0.00 54.13 55.89 2g0b s LEU 58 Cb -0.15 -3.56 0.00 0.00 0.50 0.00 0.00 46.19 42.97 2g0b s LEU 58 CO 0.07 -0.35 0.00 0.00 -1.32 0.00 0.00 176.35 174.75 2g0b n TYR 59 N 4.40 0.00 -4.28 5.38 0.18 -0.60 -4.99 117.16 117.25 2g0b n TYR 59 Ca 0.07 0.00 -0.23 0.00 1.88 0.00 0.00 57.90 59.62 2g0b n TYR 59 Cb 0.50 0.00 -0.12 0.00 -0.38 0.00 0.00 39.34 39.33 2g0b n TYR 59 CO 0.00 0.00 0.00 0.20 -2.08 0.00 0.00 176.86 174.98 2g0b s GLY 60 N -2.00 1.16 -0.04 -7.48 0.00 -1.20 -0.15 107.32 97.61 2g0b s GLY 60 Ca 0.00 -1.19 -0.17 0.00 0.00 0.00 0.00 44.72 43.36 2g0b s GLY 60 CO 0.00 -1.19 0.38 -1.08 0.00 0.00 0.00 173.10 171.21 2g0b s THR 61 N -1.16 0.04 0.00 0.90 -1.32 -0.07 -0.39 115.64 113.64 2g0b s THR 61 Ca 0.05 -0.34 -0.18 0.00 -1.21 0.00 0.00 61.69 60.01 2g0b s THR 61 Cb -0.10 -0.67 0.03 0.00 -1.51 0.00 0.00 72.50 70.25 2g0b s THR 61 CO 0.04 -0.19 0.38 -0.51 -2.21 0.00 0.00 174.62 172.13 2g0b s ILE 62 N -1.12 0.05 0.02 5.08 2.07 -1.14 -1.25 121.20 124.91 2g0b s ILE 62 Ca -0.12 -0.43 -0.01 0.00 -1.41 0.00 0.00 60.65 58.68 2g0b s ILE 62 Cb -0.04 -0.79 -0.02 0.00 0.13 0.00 0.00 42.46 41.75 2g0b s ILE 62 CO 0.05 -0.24 0.00 -0.44 -1.91 0.00 0.00 174.94 172.40 2g0b s SER 63 N -1.55 0.20 0.14 4.50 0.01 -0.08 0.29 113.70 117.22 2g0b s SER 63 Ca -0.10 -0.45 0.10 0.00 1.31 0.00 0.00 55.95 56.80 2g0b s SER 63 Cb -0.03 0.12 -0.04 0.00 0.21 0.00 0.00 66.02 66.28 2g0b s SER 63 CO 0.03 -0.32 -0.20 0.27 0.41 0.00 0.00 173.24 173.43 2g0b s ILE 64 N -1.48 2.69 -0.14 1.44 -0.00 -0.79 0.77 121.20 123.69 2g0b s ILE 64 Ca -0.16 -1.66 0.00 0.00 -0.00 0.00 0.00 60.65 58.84 2g0b s ILE 64 Cb -0.09 -2.25 0.02 0.00 -0.00 0.00 0.00 42.46 40.14 2g0b s ILE 64 CO -0.01 0.04 -0.14 -0.63 -0.00 0.00 0.00 174.94 174.20 2g0b s ILE 65 N -1.28 1.55 0.59 8.37 1.01 0.34 -1.78 121.20 129.99 2g0b s ILE 65 Ca 0.18 -0.62 -0.17 0.00 0.00 0.00 0.00 60.65 60.05 2g0b s ILE 65 Cb -0.10 -1.45 -0.04 0.00 0.01 0.00 0.00 42.46 40.88 2g0b s ILE 65 CO 0.10 0.45 1.07 0.20 0.00 0.00 0.00 174.94 176.76 2g0b s ASN 66 N 1.46 5.74 -1.01 3.58 0.01 0.45 -1.49 114.94 123.68 2g0b s ASN 66 Ca 0.04 1.89 -0.23 0.00 -0.71 0.00 0.00 52.86 53.85 2g0b s ASN 66 Cb -0.13 -2.54 -0.03 0.00 0.41 0.00 0.00 41.25 38.95 2g0b s ASN 66 CO -0.10 -1.20 1.85 -0.62 -1.51 0.00 0.00 177.10 175.52 2g0b s ASP 67 N -2.56 5.45 0.00 -1.22 -1.08 -0.69 -4.87 116.67 111.70 2g0b s ASP 67 Ca 0.65 -1.15 0.00 0.00 -0.52 0.00 0.00 52.55 51.53 2g0b s ASP 67 Cb -0.17 -2.57 0.00 0.00 -1.46 0.00 0.00 42.92 38.72 2g0b s ASP 67 CO 0.35 -2.52 0.00 0.61 0.52 0.00 0.00 175.17 174.12 2g0b n GLY 68 N 6.51 0.76 0.21 2.66 0.00 -1.26 -4.91 105.19 109.16 2g0b n GLY 68 Ca 0.41 -1.84 -0.00 0.00 0.00 0.00 0.00 46.02 44.58 2g0b n GLY 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2g0b h ALA 69 N -1.45 1.27 -0.53 4.61 0.00 -2.02 -2.97 119.26 118.16 2g0b h ALA 69 Ca 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.58 2g0b h ALA 69 Cb 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.70 2g0b h ALA 69 CO 0.00 0.49 0.00 1.04 0.00 0.00 0.00 179.25 180.78 2g0b n GLN 70 N -4.13 3.44 0.00 0.00 6.02 -1.26 -5.04 117.38 116.41 2g0b n GLN 70 Ca -0.01 -2.42 0.00 0.00 -0.01 0.00 0.00 57.00 54.56 2g0b n GLN 70 Cb 0.39 -1.85 0.00 0.00 1.02 0.00 0.00 30.24 29.80 2g0b n GLN 70 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2g0b n GLY 71 N 0.92 0.56 3.13 1.08 0.00 -1.12 -4.89 105.19 104.86 2g0b n GLY 71 Ca 0.22 -0.86 -0.17 0.00 0.00 0.00 0.00 46.02 45.21 2g0b n GLY 71 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2g0b s LEU 72 N 0.00 2.26 0.60 0.99 1.43 -1.26 -4.19 118.68 118.51 2g0b s LEU 72 Ca 0.00 -0.58 0.29 0.00 -1.03 0.00 0.00 54.13 52.81 2g0b s LEU 72 Cb 0.00 -0.41 1.57 0.00 0.03 0.00 0.00 46.19 47.39 2g0b s LEU 72 CO 0.00 -0.11 1.98 -0.65 0.23 0.00 0.00 176.35 177.81 2g0b h PRO 73 N 4.43 0.00 0.00 1.29 0.11 -1.97 -0.88 132.00 134.97 2g0b h PRO 73 Ca -0.39 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.68 2g0b h PRO 73 Cb 1.19 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 2g0b h PRO 73 CO 0.41 0.00 -0.21 0.52 -0.21 0.00 0.00 178.00 178.51 2g0b h MET 74 N 0.00 0.00 -0.79 1.05 2.86 -1.96 -3.27 114.93 112.82 2g0b h MET 74 Ca 0.14 0.00 0.12 0.00 -2.06 0.00 0.00 59.70 57.90 2g0b h MET 74 Cb 0.84 0.00 -0.06 0.00 0.06 0.00 0.00 31.60 32.44 2g0b h MET 74 CO -0.00 0.21 0.52 -0.44 1.06 0.00 0.00 176.91 178.25 2g0b h ASP 75 N 0.00 0.56 0.02 1.22 3.32 -1.44 0.72 116.42 120.82 2g0b h ASP 75 Ca -0.00 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.07 2g0b h ASP 75 Cb 0.49 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.95 2g0b h ASP 75 CO 0.03 0.31 0.00 -1.54 -1.72 0.00 0.00 179.24 176.32 2g0b n SER 76 N -4.51 0.10 0.00 6.45 3.41 -1.23 -3.06 113.62 114.78 2g0b n SER 76 Ca 0.14 0.55 0.00 0.00 -0.26 0.00 0.00 58.87 59.30 2g0b n SER 76 Cb 0.41 -0.56 0.00 0.00 -0.26 0.00 0.00 64.21 63.80 2g0b n SER 76 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 2g0b n ILE 77 N -1.64 0.00 -1.53 -1.33 -0.00 -0.76 -4.95 119.36 109.15 2g0b n ILE 77 Ca -0.00 0.00 -0.23 0.00 -0.00 0.00 0.00 62.75 62.52 2g0b n ILE 77 Cb 0.01 -0.00 0.11 0.00 -0.00 0.00 0.00 39.64 39.76 2g0b n ILE 77 CO 0.00 0.00 0.00 -1.22 -0.00 0.00 0.00 176.55 175.33 2g0b n TYR 78 N -1.50 2.57 0.14 1.39 4.02 0.24 -4.76 117.16 119.26 2g0b n TYR 78 Ca 0.00 -2.32 -0.14 0.00 -0.01 0.00 0.00 57.90 55.43 2g0b n TYR 78 Cb 0.00 -0.87 -0.08 0.00 -0.02 0.00 0.00 39.34 38.38 2g0b n TYR 78 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2g0b h ALA 79 N 1.67 -0.31 0.00 -0.72 0.00 -1.66 -2.93 119.26 115.30 2g0b h ALA 79 Ca 0.46 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.25 2g0b h ALA 79 Cb 1.48 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 19.39 2g0b h ALA 79 CO 1.02 -0.63 -0.06 -0.39 0.00 0.00 0.00 179.25 179.19 2g0b h VAL 80 N -0.40 0.19 0.00 0.00 -1.51 -1.89 -1.97 116.25 110.66 2g0b h VAL 80 Ca -0.03 -0.60 0.00 0.00 -1.23 0.00 0.00 66.70 64.84 2g0b h VAL 80 Cb 0.31 1.50 0.00 0.00 -2.13 0.00 0.00 31.29 30.96 2g0b h VAL 80 CO 0.05 0.06 0.00 -0.62 -1.23 0.00 0.00 177.57 175.83 2g0b n GLU 81 N -3.22 0.10 -0.02 5.19 4.71 -1.12 -2.92 120.64 123.37 2g0b n GLU 81 Ca -0.00 0.10 0.05 0.00 -0.01 0.00 0.00 57.16 57.30 2g0b n GLU 81 Cb 0.30 -1.62 -0.12 0.00 -1.01 0.00 0.00 31.44 28.99 2g0b n GLU 81 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 2g0b n LEU 82 N -1.80 0.00 -0.35 -4.62 4.77 -0.91 -4.70 117.00 109.38 2g0b n LEU 82 Ca 0.06 0.00 0.24 0.00 -0.03 0.00 0.00 56.01 56.29 2g0b n LEU 82 Cb 0.36 0.06 0.50 0.00 -2.33 0.00 0.00 43.42 42.01 2g0b n LEU 82 CO 0.28 0.06 1.18 0.00 -1.33 0.00 0.00 177.39 177.57 2g0b h ALA 83 N 1.31 2.14 -0.10 -1.18 0.00 -1.25 -0.63 119.26 119.56 2g0b h ALA 83 Ca -0.07 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 2g0b h ALA 83 Cb 0.92 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.80 2g0b h ALA 83 CO 0.00 -0.66 0.03 0.00 0.00 0.00 0.00 179.25 178.62 2g0b h ALA 84 N 1.71 0.13 -0.32 0.00 0.00 -1.84 -2.22 119.26 116.72 2g0b h ALA 84 Ca 0.69 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 55.40 2g0b h ALA 84 Cb 1.68 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 19.42 2g0b h ALA 84 CO -0.45 -0.26 -0.16 -1.49 0.00 0.00 0.00 179.25 176.89 2g0b h TRP 85 N -0.03 0.63 0.00 0.00 6.55 -1.45 -1.89 115.95 119.76 2g0b h TRP 85 Ca 0.03 -0.11 -0.04 0.00 0.95 0.00 0.00 58.89 59.72 2g0b h TRP 85 Cb 0.22 -0.16 -0.01 0.00 -0.86 0.00 0.00 29.16 28.35 2g0b h TRP 85 CO -0.00 0.70 -0.18 0.00 -1.05 0.00 0.00 178.44 177.91 2g0b h ARG 86 N 0.52 0.00 0.00 0.49 3.08 -1.47 -0.70 114.38 116.31 2g0b h ARG 86 Ca 0.09 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.07 2g0b h ARG 86 Cb 0.57 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.61 2g0b h ARG 86 CO 0.04 0.18 -0.33 0.78 -1.07 0.00 0.00 179.97 179.56 2g0b h GLY 87 N 2.39 0.00 -0.69 0.04 0.00 -0.69 -2.50 103.07 101.62 2g0b h GLY 87 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2g0b h GLY 87 CO 0.02 0.00 -0.36 1.18 0.00 0.00 0.00 176.54 177.39 2g0b n GLU 88 N -3.67 1.21 -2.22 4.80 1.02 -1.06 -4.97 120.64 115.74 2g0b n GLU 88 Ca -0.01 -0.92 -0.08 0.00 -0.02 0.00 0.00 57.16 56.13 2g0b n GLU 88 Cb 0.44 -1.48 -0.00 0.00 -0.02 0.00 0.00 31.44 30.38 2g0b n GLU 88 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2g0b n GLY 89 N 1.38 0.06 3.74 0.62 0.00 -0.86 -5.00 105.19 105.12 2g0b n GLY 89 Ca 0.11 -0.52 -0.41 0.00 0.00 0.00 0.00 46.02 45.19 2g0b n GLY 89 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2g0b s LYS 90 N -4.50 4.51 -0.47 1.61 1.02 -0.32 -4.96 119.74 116.63 2g0b s LYS 90 Ca 0.02 1.84 -0.28 0.00 0.02 0.00 0.00 55.97 57.57 2g0b s LYS 90 Cb -0.01 -3.25 -0.00 0.00 -0.52 0.00 0.00 37.83 34.05 2g0b s LYS 90 CO 0.02 -0.07 1.61 0.21 -0.92 0.00 0.00 175.35 176.20 2g0b s LYS 91 N -0.21 3.26 -0.02 1.68 2.20 -1.26 -4.67 119.74 120.72 2g0b s LYS 91 Ca 0.52 0.89 -0.02 0.00 -0.36 0.00 0.00 55.97 57.00 2g0b s LYS 91 Cb -0.32 -4.17 -0.04 0.00 -1.51 0.00 0.00 37.83 31.79 2g0b s LYS 91 CO 0.36 -1.96 0.13 -0.51 -0.36 0.00 0.00 175.35 173.01 2g0b s LEU 92 N 6.69 4.15 -0.02 5.43 1.43 -1.26 -1.73 118.68 133.36 2g0b s LEU 92 Ca 0.65 0.26 -0.01 0.00 -1.03 0.00 0.00 54.13 54.00 2g0b s LEU 92 Cb -0.15 -2.41 0.02 0.00 0.03 0.00 0.00 46.19 43.67 2g0b s LEU 92 CO 0.29 0.28 0.05 0.00 0.23 0.00 0.00 176.35 177.20 2g0b s ALA 93 N -1.24 -0.05 -0.14 4.21 0.00 -0.91 -1.70 121.76 121.93 2g0b s ALA 93 Ca 0.24 0.26 -0.10 0.00 0.00 0.00 0.00 51.96 52.36 2g0b s ALA 93 Cb -0.12 -0.18 -0.05 0.00 0.00 0.00 0.00 23.12 22.77 2g0b s ALA 93 CO 0.15 -0.07 0.19 -2.00 0.00 0.00 0.00 175.76 174.03 2g0b s GLU 94 N 0.55 3.83 -0.18 0.00 2.12 -0.55 0.20 118.70 124.67 2g0b s GLU 94 Ca -0.04 -0.07 -0.16 0.00 0.36 0.00 0.00 54.97 55.06 2g0b s GLU 94 Cb -0.06 -3.30 -0.04 0.00 0.26 0.00 0.00 34.13 30.99 2g0b s GLU 94 CO -0.02 0.55 0.39 0.08 -0.54 0.00 0.00 175.26 175.72 2g0b s VAL 95 N -0.40 5.21 0.06 3.70 1.01 -0.72 -0.50 120.40 128.76 2g0b s VAL 95 Ca 0.14 0.72 -0.03 0.00 0.00 0.00 0.00 61.98 62.80 2g0b s VAL 95 Cb -0.12 -3.73 -0.03 0.00 0.00 0.00 0.00 36.38 32.50 2g0b s VAL 95 CO 0.03 0.28 0.04 0.54 0.00 0.00 0.00 175.10 175.99 2g0b s VAL 96 N 1.09 0.19 -1.39 2.92 0.11 0.23 -4.59 120.40 118.96 2g0b s VAL 96 Ca 0.20 -1.58 -0.08 0.00 -2.93 0.00 0.00 61.98 57.58 2g0b s VAL 96 Cb -0.14 -1.42 0.03 0.00 -1.53 0.00 0.00 36.38 33.32 2g0b s VAL 96 CO 0.08 -0.87 1.06 0.00 -3.33 0.00 0.00 175.10 172.03 2g0b n GLN 97 N 0.11 -6.82 -2.62 1.54 1.13 -1.26 -0.90 117.38 108.56 2g0b n GLN 97 Ca -0.15 0.74 -0.43 0.00 -1.94 0.00 0.00 57.00 55.23 2g0b n GLN 97 Cb 0.61 -5.70 -0.02 0.00 0.11 0.00 0.00 30.24 25.24 2g0b n GLN 97 CO 0.00 0.00 0.00 0.12 -1.44 0.00 0.00 177.06 175.74 2g0b s PHE 98 N -3.35 3.21 -0.04 1.08 5.36 -1.26 -4.12 117.98 118.87 2g0b s PHE 98 Ca 0.48 1.33 -0.21 0.00 -0.96 0.00 0.00 56.93 57.57 2g0b s PHE 98 Cb -0.22 -3.44 0.04 0.00 -0.34 0.00 0.00 43.02 39.06 2g0b s PHE 98 CO 0.77 -0.73 0.45 0.00 -1.46 0.00 0.00 175.22 174.25 2g0b s ALA 99 N 3.40 -1.16 0.01 11.12 0.00 -0.38 -5.02 121.76 129.73 2g0b s ALA 99 Ca 0.46 0.75 0.02 0.00 0.00 0.00 0.00 51.96 53.19 2g0b s ALA 99 Cb -0.15 -0.00 -0.01 0.00 0.00 0.00 0.00 23.12 22.96 2g0b s ALA 99 CO 0.10 -0.30 -0.08 -1.64 0.00 0.00 0.00 175.76 173.84 2g0b s MET 100 N -1.18 0.60 -0.47 0.00 -1.94 -1.26 -0.89 119.30 114.15 2g0b s MET 100 Ca -0.12 -0.38 -0.16 0.00 -1.71 0.00 0.00 55.69 53.32 2g0b s MET 100 Cb -0.03 -0.54 0.06 0.00 2.01 0.00 0.00 34.83 36.33 2g0b s MET 100 CO 0.06 0.14 0.43 0.34 -0.01 0.00 0.00 175.02 175.99 2g0b s ASP 101 N -0.49 6.16 0.21 3.03 -1.08 0.79 -4.85 116.67 120.44 2g0b s ASP 101 Ca 0.00 -1.19 0.02 0.00 -0.52 0.00 0.00 52.55 50.86 2g0b s ASP 101 Cb -0.04 -2.20 0.15 0.00 -1.46 0.00 0.00 42.92 39.36 2g0b s ASP 101 CO -0.00 -0.68 1.49 0.45 0.52 0.00 0.00 175.17 176.96 2g0b h HIS 102 N 8.79 0.42 0.00 -5.34 3.86 -2.00 -2.28 115.15 118.60 2g0b h HIS 102 Ca -0.28 -0.17 -0.10 0.00 -1.16 0.00 0.00 60.37 58.65 2g0b h HIS 102 Cb 1.11 -0.07 -0.01 0.00 1.06 0.00 0.00 27.41 29.50 2g0b h HIS 102 CO 0.65 0.89 -0.49 1.79 0.86 0.00 0.00 177.93 181.63 2g0b h THR 103 N 0.22 0.94 0.19 2.45 1.35 -1.99 -2.67 112.91 113.40 2g0b h THR 103 Ca -0.02 -2.02 -0.31 0.00 -0.55 0.00 0.00 66.41 63.51 2g0b h THR 103 Cb 1.21 2.25 0.03 0.00 -1.73 0.00 0.00 68.15 69.91 2g0b h THR 103 CO 0.11 0.48 -1.37 0.25 -0.25 0.00 0.00 175.52 174.74 2g0b h LEU 104 N 0.00 0.76 -0.79 3.87 5.85 -1.94 -3.03 115.31 120.03 2g0b h LEU 104 Ca -0.00 -0.78 -0.10 0.00 0.84 0.00 0.00 57.88 57.84 2g0b h LEU 104 Cb 1.21 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.98 2g0b h LEU 104 CO 0.06 1.60 -0.12 0.22 -0.34 0.00 0.00 178.44 179.86 2g0b h TYR 105 N 0.16 0.87 -0.08 1.25 3.20 -1.46 -3.07 116.97 117.85 2g0b h TYR 105 Ca -0.21 -0.16 -0.09 0.00 3.14 0.00 0.00 58.73 61.40 2g0b h TYR 105 Cb 2.06 -0.22 -0.01 0.00 1.54 0.00 0.00 36.73 40.10 2g0b h TYR 105 CO 0.11 0.86 -0.38 1.49 -1.64 0.00 0.00 178.16 178.61 2g0b h GLU 106 N 0.71 0.16 -0.16 1.82 4.81 -1.53 -0.45 114.58 119.94 2g0b h GLU 106 Ca 0.12 -0.07 -0.12 0.00 -0.13 0.00 0.00 59.36 59.16 2g0b h GLU 106 Cb 0.61 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.97 2g0b h GLU 106 CO 0.04 0.52 -0.44 0.00 -0.73 0.00 0.00 179.01 178.40 2g0b h ALA 107 N 1.48 0.95 0.05 2.92 0.00 -1.44 -1.64 119.26 121.59 2g0b h ALA 107 Ca 0.01 -0.44 -0.20 0.00 0.00 0.00 0.00 54.91 54.28 2g0b h ALA 107 Cb 0.74 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 2g0b h ALA 107 CO 0.06 0.63 -1.06 0.28 0.00 0.00 0.00 179.25 179.16 2g0b h VAL 108 N 0.31 1.16 -0.02 0.00 2.07 -1.44 -3.40 116.25 114.94 2g0b h VAL 108 Ca 0.02 -2.32 0.00 0.00 0.82 0.00 0.00 66.70 65.22 2g0b h VAL 108 Cb 0.90 2.71 0.00 0.00 -1.52 0.00 0.00 31.29 33.38 2g0b h VAL 108 CO 0.08 0.56 -0.37 0.00 0.02 0.00 0.00 177.57 177.85 2g0b n ALA 109 N -3.03 3.33 -0.95 1.67 0.00 -0.20 -4.98 120.51 116.35 2g0b n ALA 109 Ca -0.24 -0.61 0.00 0.00 0.00 0.00 0.00 53.44 52.59 2g0b n ALA 109 Cb 0.74 -0.85 0.00 0.00 0.00 0.00 0.00 19.45 19.34 2g0b n ALA 109 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2g0b n GLY 110 N 1.39 0.68 3.68 0.00 0.00 -0.62 -4.97 105.19 105.36 2g0b n GLY 110 Ca 0.11 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.04 2g0b n GLY 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2g0b s ALA 111 N -2.87 -0.76 0.52 4.61 0.00 -1.25 -5.02 121.76 116.99 2g0b s ALA 111 Ca 0.00 -0.52 -0.18 0.00 0.00 0.00 0.00 51.96 51.26 2g0b s ALA 111 Cb 0.00 0.94 -0.07 0.00 0.00 0.00 0.00 23.12 23.99 2g0b s ALA 111 CO 0.00 -0.92 1.02 0.15 0.00 0.00 0.00 175.76 176.02 2g0b s LYS 112 N -3.95 3.73 0.44 0.00 1.02 -1.26 -3.87 119.74 115.85 2g0b s LYS 112 Ca 0.15 1.19 -0.25 0.00 0.02 0.00 0.00 55.97 57.09 2g0b s LYS 112 Cb -0.03 -2.09 -0.08 0.00 -0.52 0.00 0.00 37.83 35.11 2g0b s LYS 112 CO 0.06 -0.47 1.29 -2.14 -0.92 0.00 0.00 175.35 173.17 2g0b s PRO 113 N -3.68 3.76 0.56 -1.68 0.02 -1.26 -5.04 135.00 127.68 2g0b s PRO 113 Ca 0.64 2.11 -0.03 0.00 0.02 0.00 0.00 61.00 63.73 2g0b s PRO 113 Cb -0.14 -2.59 0.01 0.00 0.02 0.00 0.00 34.50 31.80 2g0b s PRO 113 CO 0.27 -0.65 0.83 -1.54 -0.33 0.00 0.00 177.00 175.59 2g0b s SER 114 N -0.88 5.54 0.64 2.53 1.04 -1.26 -4.97 113.70 116.34 2g0b s SER 114 Ca 0.61 0.48 0.37 0.00 0.48 0.00 0.00 55.95 57.90 2g0b s SER 114 Cb -0.37 -1.50 2.08 0.00 0.10 0.00 0.00 66.02 66.34 2g0b s SER 114 CO 0.46 -1.03 2.24 -0.65 0.98 0.00 0.00 173.24 175.24 2g0b h PRO 115 N -0.03 0.00 -0.04 4.02 0.11 -2.02 -2.46 132.00 131.58 2g0b h PRO 115 Ca -0.45 0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.67 2g0b h PRO 115 Cb 1.27 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.37 2g0b h PRO 115 CO 0.59 0.00 0.03 0.74 -0.21 0.00 0.00 178.00 179.15 2g0b h PHE 116 N 0.00 0.00 -0.09 0.65 0.04 -1.99 -1.98 116.94 113.57 2g0b h PHE 116 Ca 0.01 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.78 2g0b h PHE 116 Cb 0.19 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.34 2g0b h PHE 116 CO 0.00 0.00 0.06 0.93 -0.60 0.00 0.00 178.31 178.70 2g0b h GLU 117 N 0.00 0.12 -0.78 1.51 4.39 -1.83 -1.50 114.58 116.49 2g0b h GLU 117 Ca 0.02 -0.01 -0.00 0.00 0.34 0.00 0.00 59.36 59.71 2g0b h GLU 117 Cb 0.08 -0.03 -0.04 0.00 -0.10 0.00 0.00 28.75 28.67 2g0b h GLU 117 CO -0.00 0.11 0.48 0.00 -1.16 0.00 0.00 179.01 178.44 2g0b h ALA 118 N 1.00 1.38 -0.38 3.43 0.00 -1.56 -2.87 119.26 120.26 2g0b h ALA 118 Ca 0.03 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 2g0b h ALA 118 Cb 0.02 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 2g0b h ALA 118 CO -0.01 0.54 0.09 0.00 0.00 0.00 0.00 179.25 179.88 2g0b h ALA 119 N 1.46 1.44 -0.17 0.00 0.00 -0.83 0.11 119.26 121.27 2g0b h ALA 119 Ca 0.28 -0.15 -0.17 0.00 0.00 0.00 0.00 54.91 54.87 2g0b h ALA 119 Cb -0.07 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.56 2g0b h ALA 119 CO -0.06 0.41 -0.59 0.66 0.00 0.00 0.00 179.25 179.67 2g0b h SER 120 N 0.55 0.64 -0.56 0.00 4.64 -1.07 0.27 113.55 118.02 2g0b h SER 120 Ca 0.13 -0.36 -0.10 0.00 -0.47 0.00 0.00 61.79 60.99 2g0b h SER 120 Cb 0.22 -0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 62.10 2g0b h SER 120 CO -0.00 1.09 -0.03 -0.07 -0.87 0.00 0.00 176.83 176.94 2g0b h LEU 121 N 0.43 1.01 -0.43 5.97 3.38 -1.35 -2.59 115.31 121.72 2g0b h LEU 121 Ca -0.00 -0.30 -0.07 0.00 0.09 0.00 0.00 57.88 57.60 2g0b h LEU 121 Cb 1.15 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.61 2g0b h LEU 121 CO 0.11 1.08 -0.01 -0.26 0.09 0.00 0.00 178.44 179.45 2g0b h PHE 122 N 0.93 0.84 -0.36 1.13 0.05 -0.59 -2.51 116.94 116.43 2g0b h PHE 122 Ca 0.16 -0.15 0.07 0.00 3.82 0.00 0.00 57.97 61.87 2g0b h PHE 122 Cb 0.58 -0.22 -0.07 0.00 2.00 0.00 0.00 35.95 38.25 2g0b h PHE 122 CO 0.04 0.83 -0.08 1.15 -0.18 0.00 0.00 178.31 180.07 2g0b h THR 123 N 0.61 0.65 -0.42 -1.55 2.02 -0.39 -1.92 112.91 111.91 2g0b h THR 123 Ca 0.12 -0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.25 2g0b h THR 123 Cb 0.50 0.64 -0.02 0.00 -1.74 0.00 0.00 68.15 67.53 2g0b h THR 123 CO 0.02 0.00 0.05 -0.03 0.37 0.00 0.00 175.52 175.93 2g0b h MET 124 N 0.01 0.65 -0.35 6.66 4.05 -1.33 -0.63 114.93 124.00 2g0b h MET 124 Ca 0.17 -0.14 -0.11 0.00 -0.28 0.00 0.00 59.70 59.34 2g0b h MET 124 Cb 0.26 -0.10 -0.01 0.00 -0.80 0.00 0.00 31.60 30.95 2g0b h MET 124 CO -0.36 0.64 -0.23 0.28 0.23 0.00 0.00 176.91 177.47 2g0b h VAL 125 N 0.63 1.27 -0.13 -5.77 2.07 -1.04 -1.99 116.25 111.29 2g0b h VAL 125 Ca 0.14 -1.31 -0.11 0.00 0.82 0.00 0.00 66.70 66.23 2g0b h VAL 125 Cb 0.32 1.25 0.00 0.00 -1.52 0.00 0.00 31.29 31.35 2g0b h VAL 125 CO 0.01 0.43 -0.36 0.25 0.02 0.00 0.00 177.57 177.92 2g0b h LEU 126 N 0.59 0.54 -1.30 2.57 5.85 -0.81 -1.24 115.31 121.52 2g0b h LEU 126 Ca 0.08 -0.59 -0.04 0.00 0.84 0.00 0.00 57.88 58.17 2g0b h LEU 126 Cb 0.71 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.57 2g0b h LEU 126 CO 0.05 1.04 0.05 0.74 -0.34 0.00 0.00 178.44 179.99 2g0b h THR 127 N 0.07 1.18 -0.13 1.05 2.02 -1.11 -1.08 112.91 114.91 2g0b h THR 127 Ca -0.01 -0.66 -0.03 0.00 0.77 0.00 0.00 66.41 66.48 2g0b h THR 127 Cb 0.98 0.85 -0.00 0.00 -1.74 0.00 0.00 68.15 68.24 2g0b h THR 127 CO 0.08 0.24 -0.01 0.22 0.37 0.00 0.00 175.52 176.41 2g0b h TYR 128 N 0.52 0.27 -0.24 3.16 3.20 -1.34 -3.01 116.97 119.52 2g0b h TYR 128 Ca 0.12 -0.05 -0.04 0.00 3.14 0.00 0.00 58.73 61.89 2g0b h TYR 128 Cb 0.25 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.44 2g0b h TYR 128 CO 0.01 0.51 -0.04 0.00 -1.64 0.00 0.00 178.16 176.99 2g0b h ALA 129 N 0.73 1.49 -0.11 1.82 0.00 -0.48 -0.57 119.26 122.14 2g0b h ALA 129 Ca 0.04 -0.18 -0.24 0.00 0.00 0.00 0.00 54.91 54.53 2g0b h ALA 129 Cb 0.41 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.10 2g0b h ALA 129 CO 0.01 0.37 -0.86 -0.07 0.00 0.00 0.00 179.25 178.70 2g0b h LEU 130 N 0.35 0.94 -0.17 0.00 3.38 -1.30 -0.91 115.31 117.60 2g0b h LEU 130 Ca 0.08 -0.66 -0.13 0.00 0.09 0.00 0.00 57.88 57.26 2g0b h LEU 130 Cb 0.31 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 2g0b h LEU 130 CO 0.01 1.46 -0.60 -0.33 0.09 0.00 0.00 178.44 179.07 2g0b h GLU 131 N 0.50 0.00 -0.01 1.13 5.08 -1.32 -2.94 114.58 117.02 2g0b h GLU 131 Ca -0.08 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 2g0b h GLU 131 Cb 1.49 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.74 2g0b h GLU 131 CO 0.17 0.60 -0.07 2.41 -1.00 0.00 0.00 179.01 181.13 2g0b n THR 132 N -3.32 0.00 -3.66 1.13 -1.04 -0.26 -4.95 114.28 102.18 2g0b n THR 132 Ca 0.01 -0.13 -0.23 0.00 -2.04 0.00 0.00 64.05 61.65 2g0b n THR 132 Cb 0.74 0.14 0.06 0.00 -1.82 0.00 0.00 70.33 69.45 2g0b n THR 132 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 2g0b n HIS 133 N -0.47 -2.38 -2.61 -1.42 8.25 -1.11 -4.97 115.22 110.50 2g0b n HIS 133 Ca 0.18 0.94 -0.42 0.00 -0.26 0.00 0.00 57.72 58.15 2g0b n HIS 133 Cb 0.29 -4.66 -0.03 0.00 1.12 0.00 0.00 29.99 26.71 2g0b n HIS 133 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2g0b s ILE 134 N -3.40 4.51 -0.04 1.59 1.01 -0.36 -4.81 121.20 119.70 2g0b s ILE 134 Ca 0.35 1.85 -0.03 0.00 0.00 0.00 0.00 60.65 62.82 2g0b s ILE 134 Cb -0.16 -4.18 -0.02 0.00 0.01 0.00 0.00 42.46 38.11 2g0b s ILE 134 CO 0.77 0.17 0.19 0.44 0.00 0.00 0.00 174.94 176.51 2g0b h ASP 135 N 6.56 -0.09 -3.32 3.58 3.32 -1.65 -3.41 116.42 121.42 2g0b h ASP 135 Ca -0.42 0.00 -0.65 0.00 0.02 0.00 0.00 57.03 55.98 2g0b h ASP 135 Cb 1.22 0.02 -0.26 0.00 0.22 0.00 0.00 39.33 40.53 2g0b h ASP 135 CO 0.76 0.16 -0.75 -0.31 -1.72 0.00 0.00 179.24 177.38 2g0b s TYR 136 N -1.75 2.85 -0.43 4.55 1.51 -1.13 -0.84 117.35 122.10 2g0b s TYR 136 Ca -0.01 -0.60 -0.15 0.00 -1.01 0.00 0.00 57.07 55.29 2g0b s TYR 136 Cb 0.00 -1.87 0.04 0.00 -0.11 0.00 0.00 41.96 40.02 2g0b s TYR 136 CO 0.04 -0.19 0.34 -1.17 -1.11 0.00 0.00 175.55 173.46 2g0b s LEU 137 N 0.37 5.28 0.34 -1.29 2.96 -0.34 -2.14 118.68 123.85 2g0b s LEU 137 Ca -0.10 -1.04 -0.03 0.00 -0.22 0.00 0.00 54.13 52.74 2g0b s LEU 137 Cb -0.16 -2.18 -0.04 0.00 0.50 0.00 0.00 46.19 44.31 2g0b s LEU 137 CO 0.05 -0.53 0.59 0.00 -1.32 0.00 0.00 176.35 175.14 2g0b s ILE 139 N -2.26 -0.03 -0.31 0.00 -1.09 0.18 -1.75 121.20 115.94 2g0b s ILE 139 Ca 0.43 0.12 0.01 0.00 -2.23 0.00 0.00 60.65 58.99 2g0b s ILE 139 Cb -0.10 -0.47 0.07 0.00 -1.58 0.00 0.00 42.46 40.38 2g0b s ILE 139 CO 0.34 0.05 0.01 -0.55 -1.23 0.00 0.00 174.94 173.56 2g0b s SER 140 N 1.28 4.77 0.19 3.58 0.15 -1.26 -0.56 113.70 121.85 2g0b s SER 140 Ca -0.09 -1.64 0.08 0.00 0.70 0.00 0.00 55.95 55.00 2g0b s SER 140 Cb -0.09 -1.66 -0.04 0.00 -1.71 0.00 0.00 66.02 62.52 2g0b s SER 140 CO -0.10 -0.31 -0.17 0.27 1.20 0.00 0.00 173.24 174.14 2g0b s ILE 141 N 1.10 1.82 0.24 6.45 -4.36 -0.82 -4.90 121.20 120.73 2g0b s ILE 141 Ca -0.01 -2.07 -0.30 0.00 -0.26 0.00 0.00 60.65 58.01 2g0b s ILE 141 Cb -0.20 -1.95 -0.09 0.00 1.25 0.00 0.00 42.46 41.46 2g0b s ILE 141 CO -0.04 -0.44 1.27 0.21 0.24 0.00 0.00 174.94 176.17 2g0b s ASN 142 N -3.00 6.93 0.61 4.36 3.84 -1.26 -1.07 114.94 125.34 2g0b s ASN 142 Ca 0.19 2.44 0.27 0.00 0.21 0.00 0.00 52.86 55.97 2g0b s ASN 142 Cb -0.04 -2.62 1.47 0.00 -0.55 0.00 0.00 41.25 39.51 2g0b s ASN 142 CO 0.07 -0.47 1.81 -0.65 -2.79 0.00 0.00 177.10 175.08 2g0b h PRO 143 N 4.69 0.00 0.00 0.43 0.11 -1.92 0.18 132.00 135.49 2g0b h PRO 143 Ca -0.46 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.64 2g0b h PRO 143 Cb 1.22 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.33 2g0b h PRO 143 CO 0.73 0.00 -0.05 1.57 -0.21 0.00 0.00 178.00 180.04 2g0b h LYS 144 N 0.00 0.00 -0.03 1.05 2.10 -1.95 -2.69 116.57 115.05 2g0b h LYS 144 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2g0b h LYS 144 Cb 0.65 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.98 2g0b h LYS 144 CO 0.00 0.05 -0.06 0.72 -2.00 0.00 0.00 179.45 178.16 2g0b n HIS 145 N -3.15 0.00 -0.34 0.07 8.25 0.60 -4.57 115.22 116.08 2g0b n HIS 145 Ca 0.01 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.46 2g0b n HIS 145 Cb 0.37 -0.00 0.14 0.00 1.12 0.00 0.00 29.99 31.63 2g0b n HIS 145 CO 0.00 0.00 0.00 0.22 0.64 0.00 0.00 176.34 177.20 2g0b h ASP 146 N 4.36 1.09 0.57 0.41 1.82 -1.31 -2.36 116.42 121.01 2g0b h ASP 146 Ca 0.00 -0.03 -0.08 0.00 -0.39 0.00 0.00 57.03 56.53 2g0b h ASP 146 Cb 0.95 -0.27 -0.01 0.00 0.68 0.00 0.00 39.33 40.68 2g0b h ASP 146 CO 0.00 0.79 -0.37 0.00 -1.61 0.00 0.00 179.24 178.05 2g0b h THR 147 N 1.29 1.05 -0.00 2.25 1.03 -1.81 -2.92 112.91 113.80 2g0b h THR 147 Ca 0.35 -1.37 -0.03 0.00 -0.01 0.00 0.00 66.41 65.35 2g0b h THR 147 Cb -0.15 1.79 0.00 0.00 -1.07 0.00 0.00 68.15 68.72 2g0b h THR 147 CO -0.08 0.36 -0.10 0.15 -0.01 0.00 0.00 175.52 175.85 2g0b h PHE 148 N 0.00 0.11 0.00 0.00 3.57 -1.75 -3.24 116.94 115.63 2g0b h PHE 148 Ca -0.00 -0.05 -0.03 0.00 3.53 0.00 0.00 57.97 61.42 2g0b h PHE 148 Cb 0.76 -0.01 -0.00 0.00 2.79 0.00 0.00 35.95 39.48 2g0b h PHE 148 CO 0.00 0.82 -0.13 1.88 -2.23 0.00 0.00 178.31 178.65 2g0b h TYR 149 N -0.64 0.00 -0.27 0.41 -1.99 -1.50 -1.65 116.97 111.33 2g0b h TYR 149 Ca -0.01 0.00 -0.17 0.00 2.00 0.00 0.00 58.73 60.55 2g0b h TYR 149 Cb 0.84 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.57 2g0b h TYR 149 CO 0.18 0.13 -0.52 0.66 -0.00 0.00 0.00 178.16 178.62 2g0b h SER 150 N 0.00 0.85 -0.10 3.88 4.64 -1.63 -0.88 113.55 120.31 2g0b h SER 150 Ca -0.00 -0.44 -0.07 0.00 -0.47 0.00 0.00 61.79 60.80 2g0b h SER 150 Cb 0.61 -0.24 -0.02 0.00 -0.31 0.00 0.00 62.40 62.44 2g0b h SER 150 CO 0.02 1.21 -0.14 -0.07 -0.87 0.00 0.00 176.83 176.98 2g0b h LEU 151 N 0.60 0.44 -2.12 5.97 3.38 -1.39 -1.59 115.31 120.61 2g0b h LEU 151 Ca 0.02 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 2g0b h LEU 151 Cb 1.10 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.73 2g0b h LEU 151 CO 0.11 0.61 -0.07 -0.07 0.09 0.00 0.00 178.44 179.12 2g0b h LEU 152 N 0.42 0.00 0.00 1.67 3.38 -1.23 -3.07 115.31 116.48 2g0b h LEU 152 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2g0b h LEU 152 Cb 0.50 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.25 2g0b h LEU 152 CO 0.03 0.07 0.00 0.61 0.09 0.00 0.00 178.44 179.24 2g0b n GLY 153 N -0.70 1.64 3.62 0.83 0.00 -0.60 -4.52 105.19 105.46 2g0b n GLY 153 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 2g0b n GLY 153 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2g0b s PHE 154 N -2.00 3.26 -0.05 1.61 0.40 -0.36 -4.76 117.98 116.08 2g0b s PHE 154 Ca 0.00 0.80 -0.26 0.00 -0.60 0.00 0.00 56.93 56.87 2g0b s PHE 154 Cb 0.00 -2.96 -0.03 0.00 0.51 0.00 0.00 43.02 40.54 2g0b s PHE 154 CO 0.00 -0.40 0.81 0.99 0.70 0.00 0.00 175.22 177.31 2g0b s THR 155 N 2.64 4.97 0.11 0.64 2.01 -0.28 -4.23 115.64 121.50 2g0b s THR 155 Ca 0.28 1.68 -0.31 0.00 0.31 0.00 0.00 61.69 63.65 2g0b s THR 155 Cb -0.15 -4.15 -0.09 0.00 0.01 0.00 0.00 72.50 68.12 2g0b s THR 155 CO 0.10 0.21 1.70 -1.58 -0.69 0.00 0.00 174.62 174.35 2g0b s GLN 156 N 0.96 4.18 -0.00 4.92 0.74 -1.26 -0.66 119.66 128.53 2g0b s GLN 156 Ca 0.43 2.44 0.02 0.00 0.05 0.00 0.00 55.36 58.30 2g0b s GLN 156 Cb -0.19 -3.49 -0.02 0.00 1.10 0.00 0.00 33.01 30.41 2g0b s GLN 156 CO 0.21 -0.75 0.08 0.44 -0.55 0.00 0.00 175.29 174.72 2g0b n ILE 157 N 4.56 0.00 -4.01 -2.34 -5.35 0.72 -4.91 119.36 108.02 2g0b n ILE 157 Ca 0.16 -0.38 -0.13 0.00 -0.27 0.00 0.00 62.75 62.14 2g0b n ILE 157 Cb 0.39 0.90 -0.13 0.00 -1.74 0.00 0.00 39.64 39.05 2g0b n ILE 157 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2g0b s GLY 158 N -1.39 0.21 0.86 3.28 0.00 -0.85 -4.88 107.32 104.55 2g0b s GLY 158 Ca 0.00 -0.30 -0.11 0.00 0.00 0.00 0.00 44.72 44.31 2g0b s GLY 158 CO 0.08 -0.31 1.09 0.00 0.00 0.00 0.00 173.10 173.96 2g0b s ALA 159 N -0.52 1.77 -0.22 3.20 0.00 -1.26 -3.06 121.76 121.66 2g0b s ALA 159 Ca -0.04 -0.01 -0.28 0.00 0.00 0.00 0.00 51.96 51.62 2g0b s ALA 159 Cb -0.04 -3.20 -0.04 0.00 0.00 0.00 0.00 23.12 19.84 2g0b s ALA 159 CO -0.00 -2.17 1.98 -1.17 0.00 0.00 0.00 175.76 174.40 2g0b s LEU 160 N -6.11 3.64 0.10 0.00 2.96 -1.26 -4.47 118.68 113.53 2g0b s LEU 160 Ca 0.63 1.76 0.05 0.00 -0.22 0.00 0.00 54.13 56.35 2g0b s LEU 160 Cb -0.17 -3.52 -0.04 0.00 0.50 0.00 0.00 46.19 42.96 2g0b s LEU 160 CO 0.56 -1.68 -0.12 -0.54 -1.32 0.00 0.00 176.35 173.25 2g0b s LYS 161 N 5.69 0.91 -0.64 1.98 1.02 -0.28 -4.96 119.74 123.47 2g0b s LYS 161 Ca 0.89 -1.15 -0.27 0.00 0.02 0.00 0.00 55.97 55.46 2g0b s LYS 161 Cb -0.30 -0.74 0.02 0.00 -0.52 0.00 0.00 37.83 36.29 2g0b s LYS 161 CO 0.35 0.14 1.40 -1.58 -0.92 0.00 0.00 175.35 174.73 2g0b s HIS 162 N -2.07 2.24 -0.43 3.18 5.65 -1.26 -0.77 115.29 121.82 2g0b s HIS 162 Ca 0.05 0.31 -0.29 0.00 0.25 0.00 0.00 55.06 55.39 2g0b s HIS 162 Cb -0.05 -4.46 0.01 0.00 -1.18 0.00 0.00 32.58 26.90 2g0b s HIS 162 CO 0.02 -2.02 1.46 -0.47 -0.65 0.00 0.00 174.74 173.08 2g0b s TYR 163 N 6.21 2.31 -0.66 3.88 5.04 -0.96 -4.87 117.35 128.31 2g0b s TYR 163 Ca 0.47 0.64 0.25 0.00 -2.44 0.00 0.00 57.07 55.99 2g0b s TYR 163 Cb -0.10 -4.30 0.52 0.00 0.35 0.00 0.00 41.96 38.43 2g0b s TYR 163 CO 0.21 -2.08 1.51 0.78 -1.34 0.00 0.00 175.55 174.63 2g0b h GLY 164 N 12.55 0.00 1.78 8.97 0.00 -1.93 -1.23 103.07 123.20 2g0b h GLY 164 Ca -0.28 0.00 0.03 0.00 0.00 0.00 0.00 47.33 47.08 2g0b h GLY 164 CO 1.10 0.00 0.09 -0.84 0.00 0.00 0.00 176.54 176.88 2g0b h THR 165 N 0.00 0.66 0.00 4.70 2.02 -1.94 -3.10 112.91 115.24 2g0b h THR 165 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 2g0b h THR 165 Cb 0.76 0.93 0.00 0.00 -1.74 0.00 0.00 68.15 68.10 2g0b h THR 165 CO 0.00 0.00 0.00 0.55 0.37 0.00 0.00 175.52 176.44 2g0b n VAL 166 N -4.07 0.00 -3.71 3.16 3.14 -1.20 -4.18 118.33 111.46 2g0b n VAL 166 Ca -0.01 -0.29 -0.26 0.00 -2.96 0.00 0.00 64.34 60.82 2g0b n VAL 166 Cb 0.19 1.20 0.06 0.00 -1.06 0.00 0.00 33.84 34.23 2g0b n VAL 166 CO 0.00 0.00 0.00 -3.20 -6.46 0.00 0.00 176.83 167.17 2g0b n ASN 167 N -0.31 -5.64 -3.76 6.55 5.15 -0.51 -0.55 115.26 116.19 2g0b n ASN 167 Ca 0.00 -0.63 -0.12 0.00 -0.60 0.00 0.00 54.58 53.23 2g0b n ASN 167 Cb 0.05 -4.61 -0.08 0.00 -0.53 0.00 0.00 39.78 34.62 2g0b n ASN 167 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2g0b s ALA 168 N -3.32 -0.68 0.32 5.20 0.00 -0.95 -4.79 121.76 117.54 2g0b s ALA 168 Ca 0.59 0.03 -0.28 0.00 0.00 0.00 0.00 51.96 52.30 2g0b s ALA 168 Cb -0.28 0.29 -0.13 0.00 0.00 0.00 0.00 23.12 23.00 2g0b s ALA 168 CO 0.77 -0.39 1.18 -2.30 0.00 0.00 0.00 175.76 175.02 2g0b n PRO 169 N 0.66 1.81 -4.10 0.00 -0.02 -1.26 -2.25 135.00 129.83 2g0b n PRO 169 Ca -0.19 0.63 -0.14 0.00 -2.02 0.00 0.00 63.50 61.78 2g0b n PRO 169 Cb 0.59 -2.13 -0.11 0.00 -0.02 0.00 0.00 33.50 31.82 2g0b n PRO 169 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2g0b s ALA 170 N -1.05 0.79 -0.03 3.55 0.00 0.05 -4.26 121.76 120.81 2g0b s ALA 170 Ca 0.57 -0.90 0.02 0.00 0.00 0.00 0.00 51.96 51.65 2g0b s ALA 170 Cb -0.63 0.02 0.01 0.00 0.00 0.00 0.00 23.12 22.52 2g0b s ALA 170 CO 0.61 0.01 -0.06 -1.50 0.00 0.00 0.00 175.76 174.81 2g0b s ILE 171 N -1.59 0.61 -0.18 0.00 2.07 -0.24 -1.12 121.20 120.75 2g0b s ILE 171 Ca -0.05 -0.24 -0.15 0.00 -1.41 0.00 0.00 60.65 58.80 2g0b s ILE 171 Cb -0.08 -0.57 -0.04 0.00 0.13 0.00 0.00 42.46 41.89 2g0b s ILE 171 CO 0.00 0.21 0.33 0.00 -1.91 0.00 0.00 174.94 173.57 2g0b s ALA 172 N 0.39 3.57 0.07 1.50 0.00 -1.17 -1.94 121.76 124.18 2g0b s ALA 172 Ca -0.05 -0.50 0.03 0.00 0.00 0.00 0.00 51.96 51.44 2g0b s ALA 172 Cb -0.09 -2.49 -0.03 0.00 0.00 0.00 0.00 23.12 20.51 2g0b s ALA 172 CO 0.00 -0.08 -0.09 1.03 0.00 0.00 0.00 175.76 176.62 2g0b s ARG 173 N 0.83 0.73 0.04 0.00 0.52 0.28 -0.20 118.95 121.15 2g0b s ARG 173 Ca 0.17 -1.02 -0.01 0.00 -0.52 0.00 0.00 55.73 54.36 2g0b s ARG 173 Cb -0.14 -0.43 -0.03 0.00 0.52 0.00 0.00 34.95 34.87 2g0b s ARG 173 CO 0.06 0.07 -0.03 0.00 0.02 0.00 0.00 175.30 175.41 2g0b s ALA 174 N -2.12 0.39 -0.09 2.13 0.00 0.17 0.50 121.76 122.75 2g0b s ALA 174 Ca 0.00 -1.01 -0.00 0.00 0.00 0.00 0.00 51.96 50.95 2g0b s ALA 174 Cb -0.05 0.23 0.02 0.00 0.00 0.00 0.00 23.12 23.32 2g0b s ALA 174 CO -0.00 -0.30 -0.05 -1.17 0.00 0.00 0.00 175.76 174.23 2g0b s LEU 175 N -2.45 1.08 -0.85 0.00 2.96 -0.25 -1.12 118.68 118.06 2g0b s LEU 175 Ca -0.00 -0.21 -0.25 0.00 -0.22 0.00 0.00 54.13 53.45 2g0b s LEU 175 Cb 0.02 -0.66 -0.01 0.00 0.50 0.00 0.00 46.19 46.04 2g0b s LEU 175 CO -0.07 -0.11 1.71 -0.47 -1.32 0.00 0.00 176.35 176.09 2g0b s TYR 176 N 1.55 2.02 0.20 5.38 5.04 -1.26 -1.20 117.35 129.08 2g0b s TYR 176 Ca 0.00 0.20 -0.13 0.00 -2.44 0.00 0.00 57.07 54.70 2g0b s TYR 176 Cb -0.13 -4.30 0.23 0.00 0.35 0.00 0.00 41.96 38.10 2g0b s TYR 176 CO -0.05 -1.96 1.68 0.28 -1.34 0.00 0.00 175.55 174.16 2g0b h VAL 177 N 6.90 0.57 -0.74 3.14 2.07 -1.22 -2.85 116.25 124.12 2g0b h VAL 177 Ca -0.00 -0.04 0.17 0.00 0.82 0.00 0.00 66.70 67.64 2g0b h VAL 177 Cb 1.05 0.44 -0.13 0.00 -1.52 0.00 0.00 31.29 31.13 2g0b h VAL 177 CO 1.28 0.02 0.02 -0.65 0.02 0.00 0.00 177.57 178.26 2g0b h PRO 178 N 0.12 0.11 -1.77 1.57 0.11 -1.79 -2.12 132.00 128.25 2g0b h PRO 178 Ca 0.28 -0.01 -0.67 0.00 0.11 0.00 0.00 66.00 65.71 2g0b h PRO 178 Cb 0.43 -0.03 -0.36 0.00 0.11 0.00 0.00 31.00 31.15 2g0b h PRO 178 CO -0.45 0.08 0.02 0.39 -0.21 0.00 0.00 178.00 177.82 2g0b n GLU 179 N -5.32 3.23 0.21 1.05 1.02 -1.10 -4.79 120.64 114.94 2g0b n GLU 179 Ca 0.13 -4.16 0.04 0.00 -0.02 0.00 0.00 57.16 53.16 2g0b n GLU 179 Cb 0.46 -2.26 0.45 0.00 -0.02 0.00 0.00 31.44 30.06 2g0b n GLU 179 CO 0.00 0.00 0.00 0.11 1.18 0.00 0.00 177.13 178.42 2g0b h TRP 180 N 2.82 0.00 -0.36 -0.32 5.08 -1.16 -3.05 115.95 118.96 2g0b h TRP 180 Ca 0.40 0.00 -0.11 0.00 1.08 0.00 0.00 58.89 60.26 2g0b h TRP 180 Cb 0.54 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.68 2g0b h TRP 180 CO 0.98 0.27 -0.24 0.07 -1.28 0.00 0.00 178.44 178.24 2g0b h ARG 181 N 0.00 0.71 0.00 0.12 0.11 -1.87 -2.99 114.38 110.47 2g0b h ARG 181 Ca -0.00 -0.29 0.00 0.00 0.10 0.00 0.00 59.98 59.79 2g0b h ARG 181 Cb 0.49 -0.03 0.00 0.00 1.11 0.00 0.00 29.97 31.53 2g0b h ARG 181 CO 0.04 0.88 0.00 0.66 0.10 0.00 0.00 179.97 181.65 2g0b h SER 182 N 0.62 0.00 1.30 0.08 4.64 -1.94 -3.24 113.55 115.01 2g0b h SER 182 Ca 0.08 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.39 2g0b h SER 182 Cb 0.73 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.82 2g0b h SER 182 CO 0.06 0.00 -0.71 1.56 -0.87 0.00 0.00 176.83 176.86 2g0b h GLN 183 N 0.00 0.00 -5.98 4.77 4.20 -1.59 -3.48 115.11 113.02 2g0b h GLN 183 Ca 0.00 0.00 -0.60 0.00 0.06 0.00 0.00 58.65 58.11 2g0b h GLN 183 Cb 0.61 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.36 2g0b h GLN 183 CO 0.00 0.05 -0.45 -0.08 -0.67 0.00 0.00 178.83 177.68 2g0b s THR 184 N -3.26 5.33 -2.96 -0.54 -1.32 -1.22 -4.40 115.64 107.26 2g0b s THR 184 Ca 0.02 -0.31 0.24 0.00 -1.21 0.00 0.00 61.69 60.43 2g0b s THR 184 Cb 0.08 -3.64 0.22 0.00 -1.51 0.00 0.00 72.50 67.65 2g0b s THR 184 CO 0.75 0.10 1.29 0.18 -2.21 0.00 0.00 174.62 174.73