#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 0.03 -2.43 -2.82 -0.02 -1.26 -5.03 135.00 123.47 2g0b n PRO 3 Ca 0.00 0.09 -0.24 0.00 -2.02 0.00 0.00 63.50 61.33 2g0b n PRO 3 Cb 0.00 -2.38 0.08 0.00 -0.02 0.00 0.00 33.50 31.18 2g0b n PRO 3 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 2g0b s ARG 4 N -4.15 2.00 -0.26 -0.52 3.03 -1.26 -4.86 118.95 112.93 2g0b s ARG 4 Ca 0.71 -0.69 0.02 0.00 2.03 0.00 0.00 55.73 57.79 2g0b s ARG 4 Cb -0.28 -2.29 0.06 0.00 -1.03 0.00 0.00 34.95 31.42 2g0b s ARG 4 CO 0.53 -1.25 -0.06 0.15 -1.13 0.00 0.00 175.30 173.54 2g0b s LYS 5 N -5.13 1.80 -0.13 3.89 1.02 -1.26 -2.57 119.74 117.38 2g0b s LYS 5 Ca 0.62 -1.20 -0.06 0.00 0.02 0.00 0.00 55.97 55.36 2g0b s LYS 5 Cb -0.08 -2.73 -0.04 0.00 -0.52 0.00 0.00 37.83 34.46 2g0b s LYS 5 CO 0.43 -0.63 0.08 0.08 -0.92 0.00 0.00 175.35 174.39 2g0b s VAL 6 N 1.25 4.98 -0.15 3.17 1.01 -0.97 -4.93 120.40 124.77 2g0b s VAL 6 Ca -0.05 0.01 -0.00 0.00 0.00 0.00 0.00 61.98 61.94 2g0b s VAL 6 Cb -0.19 -3.17 0.03 0.00 0.00 0.00 0.00 36.38 33.05 2g0b s VAL 6 CO -0.07 0.57 -0.09 0.00 0.00 0.00 0.00 175.10 175.52 2g0b s ALA 7 N -0.61 1.57 0.19 5.51 0.00 -1.26 -0.53 121.76 126.63 2g0b s ALA 7 Ca 0.11 -0.78 -0.10 0.00 0.00 0.00 0.00 51.96 51.19 2g0b s ALA 7 Cb -0.12 -1.05 -0.01 0.00 0.00 0.00 0.00 23.12 21.95 2g0b s ALA 7 CO 0.02 -0.56 0.33 -0.98 0.00 0.00 0.00 175.76 174.58 2g0b s ARG 8 N 1.60 1.28 0.01 0.00 1.70 -0.97 -4.98 118.95 117.59 2g0b s ARG 8 Ca 0.03 -1.23 -0.30 0.00 -0.47 0.00 0.00 55.73 53.76 2g0b s ARG 8 Cb -0.14 0.40 -0.05 0.00 -0.57 0.00 0.00 34.95 34.59 2g0b s ARG 8 CO -0.09 -0.49 1.34 0.42 -1.08 0.00 0.00 175.30 175.41 2g0b s ILE 9 N -4.00 3.78 -0.11 4.99 1.01 -1.26 -1.42 121.20 124.19 2g0b s ILE 9 Ca 0.21 1.20 -0.30 0.00 0.00 0.00 0.00 60.65 61.76 2g0b s ILE 9 Cb 0.02 -3.77 -0.02 0.00 0.01 0.00 0.00 42.46 38.71 2g0b s ILE 9 CO 0.04 0.02 1.13 -0.76 0.00 0.00 0.00 174.94 175.36 2g0b s LEU 10 N 2.04 4.23 -0.04 2.97 1.43 0.41 -4.90 118.68 124.82 2g0b s LEU 10 Ca 0.62 1.64 -0.03 0.00 -1.03 0.00 0.00 54.13 55.33 2g0b s LEU 10 Cb -0.31 -3.55 -0.02 0.00 0.03 0.00 0.00 46.19 42.34 2g0b s LEU 10 CO 0.27 -0.58 -0.08 0.52 0.23 0.00 0.00 176.35 176.71 2g0b n VAL 11 N 4.81 0.59 -1.92 -1.59 0.31 -1.26 -4.62 118.33 114.66 2g0b n VAL 11 Ca 0.11 0.03 -0.39 0.00 -0.01 0.00 0.00 64.34 64.08 2g0b n VAL 11 Cb 0.47 -1.63 0.02 0.00 -0.91 0.00 0.00 33.84 31.78 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 -2.14 3.06 0.61 3.52 0.00 -1.26 -4.91 121.76 120.64 2g0b s ALA 12 Ca -0.08 1.29 0.39 0.00 0.00 0.00 0.00 51.96 53.56 2g0b s ALA 12 Cb 0.03 -3.53 2.16 0.00 0.00 0.00 0.00 23.12 21.78 2g0b s ALA 12 CO 0.11 -1.09 2.31 -1.35 0.00 0.00 0.00 175.76 175.73 2g0b h PRO 13 N 2.07 0.00 -0.17 0.00 0.11 -2.00 -2.61 132.00 129.41 2g0b h PRO 13 Ca -0.50 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.57 2g0b h PRO 13 Cb 1.27 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.38 2g0b h PRO 13 CO 0.60 0.01 -0.04 -0.91 -0.21 0.00 0.00 178.00 177.45 2g0b h ASN 14 N 0.00 0.32 0.54 -2.05 2.35 -1.99 -3.12 115.58 111.63 2g0b h ASN 14 Ca -0.00 -0.36 -0.19 0.00 -0.55 0.00 0.00 56.30 55.19 2g0b h ASN 14 Cb 0.04 -0.09 -0.01 0.00 0.05 0.00 0.00 38.32 38.31 2g0b h ASN 14 CO 0.00 0.61 -0.85 -0.33 -1.65 0.00 0.00 177.43 175.22 2g0b h GLU 15 N 0.03 0.21 -0.11 0.81 5.08 -1.85 -2.32 114.58 116.43 2g0b h GLU 15 Ca 0.04 -0.22 -0.10 0.00 -1.00 0.00 0.00 59.36 58.08 2g0b h GLU 15 Cb 0.47 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 2g0b h GLU 15 CO 0.02 0.94 -0.39 0.00 -1.00 0.00 0.00 179.01 178.58 2g0b h ARG 16 N 0.12 0.23 0.00 2.33 3.08 -1.61 -0.10 114.38 118.43 2g0b h ARG 16 Ca -0.04 -0.10 -0.10 0.00 0.07 0.00 0.00 59.98 59.81 2g0b h ARG 16 Cb 1.46 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 31.49 2g0b h ARG 16 CO 0.13 0.58 -0.46 -0.44 -1.07 0.00 0.00 179.97 178.71 2g0b h ASP 17 N 0.19 0.00 0.62 7.04 3.32 -1.47 -1.67 116.42 124.46 2g0b h ASP 17 Ca 0.02 0.00 -0.21 0.00 0.02 0.00 0.00 57.03 56.86 2g0b h ASP 17 Cb 0.77 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.31 2g0b h ASP 17 CO 0.06 0.46 -0.93 0.00 -1.72 0.00 0.00 179.24 177.11 2g0b h ALA 18 N 1.54 0.45 -0.40 3.45 0.00 -1.08 -2.87 119.26 120.34 2g0b h ALA 18 Ca -0.00 -0.76 -0.16 0.00 0.00 0.00 0.00 54.91 53.99 2g0b h ALA 18 Cb 1.23 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 2g0b h ALA 18 CO 0.06 0.95 -0.36 0.00 0.00 0.00 0.00 179.25 179.90 2g0b h ALA 19 N 0.92 0.59 0.00 0.00 0.00 -0.88 -2.58 119.26 117.30 2g0b h ALA 19 Ca -0.05 -0.45 -0.07 0.00 0.00 0.00 0.00 54.91 54.34 2g0b h ALA 19 Cb 1.59 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 19.24 2g0b h ALA 19 CO 0.14 0.68 -0.33 -0.09 0.00 0.00 0.00 179.25 179.65 2g0b h ARG 20 N 0.78 0.00 -0.33 0.00 2.43 -1.38 -2.07 114.38 113.81 2g0b h ARG 20 Ca 0.07 0.00 -0.15 0.00 -0.81 0.00 0.00 59.98 59.09 2g0b h ARG 20 Cb 0.96 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.50 2g0b h ARG 20 CO 0.09 0.33 -0.40 0.00 -1.51 0.00 0.00 179.97 178.48 2g0b h ARG 21 N 0.00 0.80 -0.52 0.20 3.08 -1.40 -1.09 114.38 115.45 2g0b h ARG 21 Ca -0.00 -0.43 -0.11 0.00 0.07 0.00 0.00 59.98 59.51 2g0b h ARG 21 Cb 0.93 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.98 2g0b h ARG 21 CO 0.04 1.06 -0.09 0.82 -1.07 0.00 0.00 179.97 180.73 2g0b h ILE 22 N 0.66 1.27 -0.26 2.04 2.04 -1.19 0.51 117.51 122.57 2g0b h ILE 22 Ca 0.05 -1.23 -0.01 0.00 1.00 0.00 0.00 64.86 64.67 2g0b h ILE 22 Cb 0.97 0.99 -0.01 0.00 -0.74 0.00 0.00 36.82 38.03 2g0b h ILE 22 CO 0.09 0.43 0.13 0.58 0.00 0.00 0.00 178.15 179.39 2g0b h VAL 23 N 0.85 1.14 -0.72 1.67 2.07 -1.35 -2.02 116.25 117.88 2g0b h VAL 23 Ca 0.14 -0.38 -0.03 0.00 0.82 0.00 0.00 66.70 67.25 2g0b h VAL 23 Cb 0.65 0.91 -0.03 0.00 -1.52 0.00 0.00 31.29 31.29 2g0b h VAL 23 CO 0.04 0.14 0.35 -0.09 0.02 0.00 0.00 177.57 178.03 2g0b h ARG 24 N 0.30 1.04 0.00 1.57 2.43 -1.05 -1.19 114.38 117.48 2g0b h ARG 24 Ca 0.09 -0.15 -0.02 0.00 -0.81 0.00 0.00 59.98 59.09 2g0b h ARG 24 Cb 0.10 -0.19 -0.00 0.00 -0.42 0.00 0.00 29.97 29.46 2g0b h ARG 24 CO -0.01 0.81 -0.09 0.00 -1.51 0.00 0.00 179.97 179.17 2g0b h THR 25 N 1.01 0.19 0.14 0.20 1.03 -0.77 -1.99 112.91 112.72 2g0b h THR 25 Ca 0.25 -0.95 -0.32 0.00 -0.01 0.00 0.00 66.41 65.38 2g0b h THR 25 Cb 0.11 1.81 -0.00 0.00 -1.07 0.00 0.00 68.15 69.00 2g0b h THR 25 CO -0.03 0.09 -1.62 0.74 -0.01 0.00 0.00 175.52 174.69 2g0b h THR 26 N 0.00 0.94 -0.19 0.00 2.02 -1.14 -3.20 112.91 111.33 2g0b h THR 26 Ca -0.00 -2.43 -0.13 0.00 0.77 0.00 0.00 66.41 64.62 2g0b h THR 26 Cb 0.80 2.70 -0.01 0.00 -1.74 0.00 0.00 68.15 69.90 2g0b h THR 26 CO 0.01 0.78 -0.44 1.88 0.37 0.00 0.00 175.52 178.12 2g0b h TYR 27 N -0.11 0.54 0.00 3.16 -1.99 -1.19 -2.55 116.97 114.83 2g0b h TYR 27 Ca -0.34 -0.16 -0.12 0.00 2.00 0.00 0.00 58.73 60.11 2g0b h TYR 27 Cb 1.92 -0.11 -0.02 0.00 2.00 0.00 0.00 36.73 40.52 2g0b h TYR 27 CO 0.11 0.82 -0.56 0.93 -0.00 0.00 0.00 178.16 179.46 2g0b h GLU 28 N 0.37 0.00 0.00 4.88 5.08 -1.52 0.41 114.58 123.79 2g0b h GLU 28 Ca 0.03 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.33 2g0b h GLU 28 Cb 0.92 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.16 2g0b h GLU 28 CO 0.08 0.56 -0.27 0.00 -1.00 0.00 0.00 179.01 178.38 2g0b h ALA 29 N 1.44 0.95 -0.01 3.43 0.00 -1.46 -3.20 119.26 120.42 2g0b h ALA 29 Ca -0.01 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.66 2g0b h ALA 29 Cb 0.99 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.74 2g0b h ALA 29 CO 0.07 0.33 -0.41 1.04 0.00 0.00 0.00 179.25 180.28 2g0b n GLN 30 N -3.34 1.77 -0.71 0.00 6.02 -1.04 -4.98 117.38 115.09 2g0b n GLN 30 Ca 0.01 -0.63 0.00 0.00 -0.01 0.00 0.00 57.00 56.37 2g0b n GLN 30 Cb 0.49 -1.25 0.00 0.00 1.02 0.00 0.00 30.24 30.50 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 1.19 0.72 3.85 1.08 0.00 -0.82 -5.07 105.19 106.14 2g0b n GLY 31 Ca 0.06 -0.62 -0.32 0.00 0.00 0.00 0.00 46.02 45.14 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 -2.00 3.40 0.27 1.61 4.12 0.14 -4.95 117.35 119.94 2g0b s TYR 32 Ca 0.00 1.29 -0.19 0.00 0.02 0.00 0.00 57.07 58.19 2g0b s TYR 32 Cb 0.00 -2.62 -0.09 0.00 -1.52 0.00 0.00 41.96 37.74 2g0b s TYR 32 CO 0.00 -0.08 0.76 0.00 0.02 0.00 0.00 175.55 176.25 2g0b s ALA 33 N -2.24 3.34 -0.23 3.71 0.00 0.13 -4.35 121.76 122.13 2g0b s ALA 33 Ca 0.56 0.18 -0.05 0.00 0.00 0.00 0.00 51.96 52.64 2g0b s ALA 33 Cb -0.10 -2.86 -0.02 0.00 0.00 0.00 0.00 23.12 20.14 2g0b s ALA 33 CO 0.23 0.30 0.01 0.42 0.00 0.00 0.00 175.76 176.71 2g0b s ILE 34 N -1.70 3.82 0.03 0.00 1.01 -1.26 -4.47 121.20 118.61 2g0b s ILE 34 Ca 0.48 -0.34 0.06 0.00 0.00 0.00 0.00 60.65 60.84 2g0b s ILE 34 Cb -0.15 -2.75 -0.03 0.00 0.01 0.00 0.00 42.46 39.54 2g0b s ILE 34 CO 0.20 0.39 -0.15 -0.62 0.00 0.00 0.00 174.94 174.77 2g0b s ASP 35 N 1.43 4.04 0.57 3.58 -1.08 -1.26 -5.02 116.67 118.93 2g0b s ASP 35 Ca 0.05 -0.34 0.35 0.00 -0.52 0.00 0.00 52.55 52.10 2g0b s ASP 35 Cb -0.15 -0.75 1.54 0.00 -1.46 0.00 0.00 42.92 42.10 2g0b s ASP 35 CO 0.00 0.27 2.05 -0.33 0.52 0.00 0.00 175.17 177.68 2g0b h GLU 36 N 4.56 0.00 -0.39 4.34 5.08 -1.99 -3.20 114.58 122.99 2g0b h GLU 36 Ca -0.48 0.00 0.09 0.00 -1.00 0.00 0.00 59.36 57.97 2g0b h GLU 36 Cb 1.16 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.39 2g0b h GLU 36 CO 0.50 0.01 0.27 0.66 -1.00 0.00 0.00 179.01 179.44 2g0b h SER 37 N 0.00 0.13 -0.36 1.42 4.64 -1.99 -1.24 113.55 116.15 2g0b h SER 37 Ca -0.00 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.21 2g0b h SER 37 Cb 0.43 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.49 2g0b h SER 37 CO 0.00 0.08 -0.21 -0.26 -0.87 0.00 0.00 176.83 175.57 2g0b h PHE 38 N 0.14 0.89 -0.39 4.77 0.05 -2.00 -2.94 116.94 117.46 2g0b h PHE 38 Ca 0.18 -0.23 -0.05 0.00 3.82 0.00 0.00 57.97 61.68 2g0b h PHE 38 Cb 0.53 -0.20 -0.02 0.00 2.00 0.00 0.00 35.95 38.26 2g0b h PHE 38 CO -0.00 0.98 0.02 0.00 -0.18 0.00 0.00 178.31 179.12 2g0b h ALA 39 N 0.78 1.30 -0.20 2.45 0.00 -1.45 -2.78 119.26 119.37 2g0b h ALA 39 Ca 0.08 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.70 2g0b h ALA 39 Cb 0.76 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 2g0b h ALA 39 CO 0.06 0.48 -0.19 1.15 0.00 0.00 0.00 179.25 180.75 2g0b h THR 40 N 0.59 1.23 -0.15 0.00 2.02 -1.33 -2.58 112.91 112.68 2g0b h THR 40 Ca 0.12 -1.03 -0.22 0.00 0.77 0.00 0.00 66.41 66.06 2g0b h THR 40 Cb 0.35 1.28 0.01 0.00 -1.74 0.00 0.00 68.15 68.05 2g0b h THR 40 CO 0.01 0.32 -0.77 -0.26 0.37 0.00 0.00 175.52 175.20 2g0b h PHE 41 N 0.31 1.03 0.00 3.16 -1.00 -1.33 -3.22 116.94 115.89 2g0b h PHE 41 Ca 0.06 -0.45 0.00 0.00 2.81 0.00 0.00 57.97 60.38 2g0b h PHE 41 Cb 0.51 -0.16 0.00 0.00 3.61 0.00 0.00 35.95 39.91 2g0b h PHE 41 CO 0.01 1.28 0.00 1.28 -1.61 0.00 0.00 178.31 179.27 2g0b n LEU 42 N -3.93 0.43 0.07 1.54 4.77 -1.04 -1.66 117.00 117.18 2g0b n LEU 42 Ca -0.07 0.58 0.11 0.00 -0.03 0.00 0.00 56.01 56.61 2g0b n LEU 42 Cb 0.74 -0.50 0.02 0.00 -2.33 0.00 0.00 43.42 41.35 2g0b n LEU 42 CO 0.52 -0.33 0.01 -0.62 -1.33 0.00 0.00 177.39 175.64 2g0b n GLU 43 N -1.95 0.48 -1.26 3.23 1.02 -1.00 -4.83 120.64 116.34 2g0b n GLU 43 Ca 0.04 0.06 -0.29 0.00 -0.02 0.00 0.00 57.16 56.95 2g0b n GLU 43 Cb 0.27 -1.72 0.17 0.00 -0.02 0.00 0.00 31.44 30.14 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 -4.08 1.56 0.31 0.62 0.00 -0.66 -4.97 107.32 100.10 2g0b s GLY 44 Ca 0.01 -0.43 0.12 0.00 0.00 0.00 0.00 44.72 44.42 2g0b s GLY 44 CO 0.79 0.18 1.68 -2.55 0.00 0.00 0.00 173.10 173.20 2g0b h PRO 45 N -1.84 0.00 -0.35 2.90 0.11 -1.94 -3.19 132.00 127.69 2g0b h PRO 45 Ca -0.54 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.57 2g0b h PRO 45 Cb 1.33 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.44 2g0b h PRO 45 CO 0.59 0.53 0.00 -1.13 -0.21 0.00 0.00 178.00 177.78 2g0b n SER 46 N -3.85 1.99 -4.75 -2.05 3.41 -1.26 -4.91 113.62 102.20 2g0b n SER 46 Ca -0.01 -1.96 -0.22 0.00 -0.26 0.00 0.00 58.87 56.42 2g0b n SER 46 Cb 0.55 -0.23 -0.06 0.00 -0.26 0.00 0.00 64.21 64.21 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 -1.53 3.46 -0.18 7.33 0.00 -1.21 -0.57 121.76 129.06 2g0b s ALA 47 Ca 0.26 -1.59 -0.10 0.00 0.00 0.00 0.00 51.96 50.53 2g0b s ALA 47 Cb 0.14 -1.02 0.06 0.00 0.00 0.00 0.00 23.12 22.31 2g0b s ALA 47 CO 0.19 0.19 0.44 0.99 0.00 0.00 0.00 175.76 177.57 2g0b s THR 48 N -2.27 -0.05 -0.13 0.00 2.01 -0.77 -4.98 115.64 109.45 2g0b s THR 48 Ca 0.34 0.09 0.01 0.00 0.31 0.00 0.00 61.69 62.44 2g0b s THR 48 Cb -0.06 -0.66 -0.00 0.00 0.01 0.00 0.00 72.50 71.79 2g0b s THR 48 CO 0.23 0.04 -0.17 -0.89 -0.69 0.00 0.00 174.62 173.13 2g0b s THR 49 N 1.49 2.57 0.25 -0.82 2.01 -1.26 -0.97 115.64 118.91 2g0b s THR 49 Ca -0.09 -0.82 0.06 0.00 0.31 0.00 0.00 61.69 61.15 2g0b s THR 49 Cb -0.08 -2.05 -0.03 0.00 0.01 0.00 0.00 72.50 70.34 2g0b s THR 49 CO -0.14 0.53 0.24 -0.36 -0.69 0.00 0.00 174.62 174.21 2g0b s PHE 50 N 0.56 3.21 -0.06 4.92 0.08 0.11 -0.45 117.98 126.35 2g0b s PHE 50 Ca -0.11 -0.08 -0.13 0.00 0.12 0.00 0.00 56.93 56.73 2g0b s PHE 50 Cb -0.16 -1.45 0.03 0.00 -0.57 0.00 0.00 43.02 40.86 2g0b s PHE 50 CO 0.04 0.50 0.31 0.20 -0.10 0.00 0.00 175.22 176.16 2g0b s GLY 51 N -3.88 -0.18 -0.16 4.36 0.00 -0.51 -2.07 107.32 104.88 2g0b s GLY 51 Ca 0.33 0.56 0.01 0.00 0.00 0.00 0.00 44.72 45.62 2g0b s GLY 51 CO 0.26 0.39 -0.17 -2.27 0.00 0.00 0.00 173.10 171.32 2g0b s LEU 52 N -0.66 2.36 0.12 0.66 2.96 0.52 -2.29 118.68 122.35 2g0b s LEU 52 Ca -0.08 -0.52 0.07 0.00 -0.22 0.00 0.00 54.13 53.38 2g0b s LEU 52 Cb -0.04 -1.53 -0.04 0.00 0.50 0.00 0.00 46.19 45.08 2g0b s LEU 52 CO 0.02 0.07 -0.08 -0.36 -1.32 0.00 0.00 176.35 174.68 2g0b s PHE 53 N 0.92 2.75 -0.70 5.38 0.40 0.31 -1.71 117.98 125.32 2g0b s PHE 53 Ca -0.04 -0.16 0.05 0.00 -0.60 0.00 0.00 56.93 56.19 2g0b s PHE 53 Cb -0.15 -1.41 0.18 0.00 0.51 0.00 0.00 43.02 42.15 2g0b s PHE 53 CO -0.02 0.45 0.54 -1.71 0.70 0.00 0.00 175.22 175.18 2g0b n ASN 54 N 0.51 3.19 -1.12 1.36 2.85 -0.62 -2.30 115.26 119.12 2g0b n ASN 54 Ca -0.12 -3.25 -0.01 0.00 -0.11 0.00 0.00 54.58 51.08 2g0b n ASN 54 Cb 0.53 -0.75 0.01 0.00 1.24 0.00 0.00 39.78 40.80 2g0b n ASN 54 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2g0b n GLY 55 N 1.78 0.41 2.54 8.20 0.00 -1.06 -4.04 105.19 113.02 2g0b n GLY 55 Ca 0.22 -0.45 -0.19 0.00 0.00 0.00 0.00 46.02 45.59 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 -1.16 -1.38 -4.43 1.61 -0.58 -1.26 -5.00 120.64 108.44 2g0b n GLU 56 Ca -0.02 1.15 -0.33 0.00 -0.42 0.00 0.00 57.16 57.54 2g0b n GLU 56 Cb 0.51 -5.51 -0.16 0.00 -0.57 0.00 0.00 31.44 25.71 2g0b n GLU 56 CO 0.00 0.00 0.00 0.14 -0.48 0.00 0.00 177.13 176.79 2g0b s VAL 57 N -2.76 2.24 0.03 2.62 -7.23 -1.26 -5.09 120.40 108.96 2g0b s VAL 57 Ca 0.00 -0.90 -0.30 0.00 -1.81 0.00 0.00 61.98 58.96 2g0b s VAL 57 Cb 0.00 -1.93 -0.06 0.00 0.56 0.00 0.00 36.38 34.96 2g0b s VAL 57 CO 0.00 0.53 1.30 -0.22 -0.31 0.00 0.00 175.10 176.40 2g0b s LEU 58 N 1.00 4.34 0.00 1.32 2.96 -1.26 -1.59 118.68 125.45 2g0b s LEU 58 Ca -0.02 2.08 0.00 0.00 -0.22 0.00 0.00 54.13 55.96 2g0b s LEU 58 Cb -0.15 -3.57 0.00 0.00 0.50 0.00 0.00 46.19 42.97 2g0b s LEU 58 CO -0.05 -0.60 0.06 0.00 -1.32 0.00 0.00 176.35 174.43 2g0b n TYR 59 N 4.60 0.00 -3.86 5.38 0.18 -0.70 -4.97 117.16 117.79 2g0b n TYR 59 Ca 0.11 0.00 -0.11 0.00 1.88 0.00 0.00 57.90 59.78 2g0b n TYR 59 Cb 0.45 0.00 -0.09 0.00 -0.38 0.00 0.00 39.34 39.31 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 -0.27 0.04 0.07 -7.48 0.00 -0.99 0.28 107.32 98.97 2g0b s GLY 60 Ca 0.00 -0.21 -0.18 0.00 0.00 0.00 0.00 44.72 44.33 2g0b s GLY 60 CO 0.00 -0.37 0.42 -1.08 0.00 0.00 0.00 173.10 172.07 2g0b s THR 61 N -1.95 0.06 -0.19 0.90 -1.32 -0.13 -0.36 115.64 112.65 2g0b s THR 61 Ca -0.10 -0.47 -0.21 0.00 -1.21 0.00 0.00 61.69 59.70 2g0b s THR 61 Cb -0.04 -1.03 0.05 0.00 -1.51 0.00 0.00 72.50 69.97 2g0b s THR 61 CO -0.01 -0.26 0.57 -0.51 -2.21 0.00 0.00 174.62 172.20 2g0b s ILE 62 N -2.94 0.00 0.21 5.08 2.07 -0.88 -1.47 121.20 123.28 2g0b s ILE 62 Ca -0.02 -0.03 0.08 0.00 -1.41 0.00 0.00 60.65 59.26 2g0b s ILE 62 Cb 0.00 -0.80 -0.05 0.00 0.13 0.00 0.00 42.46 41.74 2g0b s ILE 62 CO -0.06 -0.02 -0.13 -0.44 -1.91 0.00 0.00 174.94 172.38 2g0b s SER 63 N 0.07 2.60 -0.03 4.50 0.01 -0.22 0.08 113.70 120.71 2g0b s SER 63 Ca -0.02 -1.04 0.01 0.00 1.31 0.00 0.00 55.95 56.21 2g0b s SER 63 Cb -0.04 -0.14 0.02 0.00 0.21 0.00 0.00 66.02 66.08 2g0b s SER 63 CO 0.02 -0.19 -0.01 -0.51 0.41 0.00 0.00 173.24 172.96 2g0b s ILE 64 N -2.97 0.21 -0.20 1.44 2.07 -0.14 -0.94 121.20 120.66 2g0b s ILE 64 Ca 0.23 0.05 -0.02 0.00 -1.41 0.00 0.00 60.65 59.51 2g0b s ILE 64 Cb -0.00 -0.29 0.00 0.00 0.13 0.00 0.00 42.46 42.30 2g0b s ILE 64 CO 0.07 0.14 -0.11 -0.63 -1.91 0.00 0.00 174.94 172.51 2g0b s ILE 65 N 0.92 2.85 0.67 2.00 1.01 -0.07 -1.85 121.20 126.72 2g0b s ILE 65 Ca -0.09 -0.67 -0.12 0.00 0.00 0.00 0.00 60.65 59.76 2g0b s ILE 65 Cb -0.13 -2.27 -0.01 0.00 0.01 0.00 0.00 42.46 40.07 2g0b s ILE 65 CO -0.01 0.47 1.06 0.20 0.00 0.00 0.00 174.94 176.65 2g0b s ASN 66 N 1.38 5.54 -1.29 3.58 0.01 0.27 -1.47 114.94 122.96 2g0b s ASN 66 Ca 0.05 1.65 -0.18 0.00 -0.71 0.00 0.00 52.86 53.67 2g0b s ASN 66 Cb -0.14 -2.50 0.05 0.00 0.41 0.00 0.00 41.25 39.07 2g0b s ASN 66 CO -0.07 -1.34 1.77 -0.67 -1.51 0.00 0.00 177.10 175.28 2g0b n ASP 67 N -2.84 4.74 -1.47 -1.22 -0.08 -0.69 -4.85 116.55 110.13 2g0b n ASP 67 Ca 0.08 -2.90 0.00 0.00 -1.51 0.00 0.00 54.79 50.46 2g0b n ASP 67 Cb 0.53 -1.75 0.00 0.00 2.34 0.00 0.00 41.12 42.25 2g0b n ASP 67 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2g0b n GLY 68 N 5.42 1.12 0.21 0.27 0.00 -1.26 -4.93 105.19 106.02 2g0b n GLY 68 Ca 0.49 -1.75 0.11 0.00 0.00 0.00 0.00 46.02 44.86 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 -1.49 0.94 -0.01 4.61 0.00 -2.04 -3.17 119.26 118.10 2g0b h ALA 69 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2g0b h ALA 69 Cb 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2g0b h ALA 69 CO 0.00 0.17 -0.05 1.04 0.00 0.00 0.00 179.25 180.40 2g0b n GLN 70 N -3.16 1.20 0.00 0.00 1.13 -1.26 -5.04 117.38 110.24 2g0b n GLN 70 Ca 0.02 -0.52 0.00 0.00 -1.94 0.00 0.00 57.00 54.56 2g0b n GLN 70 Cb 0.52 -1.49 0.00 0.00 0.11 0.00 0.00 30.24 29.38 2g0b n GLN 70 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2g0b n GLY 71 N 1.18 -0.44 3.38 1.08 0.00 -1.20 -4.88 105.19 104.31 2g0b n GLY 71 Ca 0.18 -1.08 -0.27 0.00 0.00 0.00 0.00 46.02 44.85 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 2.36 0.55 0.99 1.43 -1.26 -4.41 118.68 118.34 2g0b s LEU 72 Ca 0.00 -0.78 0.30 0.00 -1.03 0.00 0.00 54.13 52.62 2g0b s LEU 72 Cb 0.00 -1.14 1.46 0.00 0.03 0.00 0.00 46.19 46.54 2g0b s LEU 72 CO 0.00 0.14 1.90 -0.65 0.23 0.00 0.00 176.35 177.97 2g0b h PRO 73 N 3.68 0.00 -0.49 1.29 0.11 -1.97 -1.57 132.00 133.05 2g0b h PRO 73 Ca -0.49 0.00 0.06 0.00 0.11 0.00 0.00 66.00 65.68 2g0b h PRO 73 Cb 1.18 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.27 2g0b h PRO 73 CO 0.42 0.00 0.33 0.52 -0.21 0.00 0.00 178.00 179.06 2g0b h MET 74 N 0.00 0.41 -0.95 1.05 2.86 -1.97 -3.17 114.93 113.17 2g0b h MET 74 Ca 0.34 -0.02 0.26 0.00 -2.06 0.00 0.00 59.70 58.22 2g0b h MET 74 Cb 1.47 -0.09 -0.05 0.00 0.06 0.00 0.00 31.60 32.99 2g0b h MET 74 CO -0.00 0.27 0.67 -0.44 1.06 0.00 0.00 176.91 178.46 2g0b h ASP 75 N 0.42 0.10 0.32 1.22 3.32 -1.58 0.40 116.42 120.63 2g0b h ASP 75 Ca 0.21 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.28 2g0b h ASP 75 Cb 0.30 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.85 2g0b h ASP 75 CO -0.05 0.03 0.00 0.77 -1.72 0.00 0.00 179.24 178.27 2g0b h SER 76 N 0.10 0.00 0.00 6.45 4.64 -1.77 -3.22 113.55 119.75 2g0b h SER 76 Ca 0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.79 2g0b h SER 76 Cb 1.68 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.77 2g0b h SER 76 CO -0.06 0.00 -0.37 -0.38 -0.87 0.00 0.00 176.83 175.15 2g0b n ILE 77 N -2.63 0.40 -1.46 0.95 2.08 0.76 -4.92 119.36 114.54 2g0b n ILE 77 Ca -0.01 0.13 -0.27 0.00 0.56 0.00 0.00 62.75 63.16 2g0b n ILE 77 Cb 0.13 -1.22 0.10 0.00 -0.75 0.00 0.00 39.64 37.90 2g0b n ILE 77 CO 0.00 0.00 0.00 -1.22 0.56 0.00 0.00 176.55 175.89 2g0b n TYR 78 N -3.15 2.84 -0.18 1.39 4.02 0.11 -4.65 117.16 117.54 2g0b n TYR 78 Ca 0.00 -2.49 -0.08 0.00 -0.01 0.00 0.00 57.90 55.32 2g0b n TYR 78 Cb 0.18 -1.03 0.01 0.00 -0.02 0.00 0.00 39.34 38.48 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 1.72 0.66 -0.18 -0.72 0.00 -1.69 -2.86 119.26 116.19 2g0b h ALA 79 Ca 0.52 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 55.22 2g0b h ALA 79 Cb 1.43 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 2g0b h ALA 79 CO 1.20 0.26 -0.14 0.28 0.00 0.00 0.00 179.25 180.85 2g0b h VAL 80 N 0.68 1.20 0.00 0.00 2.07 -1.89 -1.64 116.25 116.68 2g0b h VAL 80 Ca 0.17 -0.88 0.00 0.00 0.82 0.00 0.00 66.70 66.81 2g0b h VAL 80 Cb 0.18 1.22 0.00 0.00 -1.52 0.00 0.00 31.29 31.18 2g0b h VAL 80 CO -0.02 0.28 0.00 -0.33 0.02 0.00 0.00 177.57 177.52 2g0b h GLU 81 N 0.28 0.00 -0.00 1.57 3.07 -1.87 -3.06 114.58 114.57 2g0b h GLU 81 Ca 0.05 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.91 2g0b h GLU 81 Cb 0.43 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.34 2g0b h GLU 81 CO 0.03 0.00 -0.93 1.28 -1.40 0.00 0.00 179.01 177.99 2g0b n LEU 82 N -2.99 1.10 -0.23 1.33 4.77 -1.00 -4.53 117.00 115.46 2g0b n LEU 82 Ca 0.04 -0.53 -0.05 0.00 -0.03 0.00 0.00 56.01 55.44 2g0b n LEU 82 Cb 0.50 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.65 2g0b n LEU 82 CO 0.33 0.26 1.14 0.00 -1.33 0.00 0.00 177.39 177.79 2g0b h ALA 83 N 3.05 0.85 -0.51 -1.18 0.00 -1.20 -2.83 119.26 117.44 2g0b h ALA 83 Ca 0.00 -0.04 0.05 0.00 0.00 0.00 0.00 54.91 54.92 2g0b h ALA 83 Cb 0.52 -0.24 -0.05 0.00 0.00 0.00 0.00 17.79 18.02 2g0b h ALA 83 CO 0.00 0.23 0.24 0.00 0.00 0.00 0.00 179.25 179.72 2g0b h ALA 84 N 1.26 0.65 -0.32 0.00 0.00 -1.80 -2.08 119.26 116.97 2g0b h ALA 84 Ca 0.25 0.03 -0.13 0.00 0.00 0.00 0.00 54.91 55.06 2g0b h ALA 84 Cb -0.05 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 2g0b h ALA 84 CO -0.07 -0.12 -0.33 -1.49 0.00 0.00 0.00 179.25 177.24 2g0b h TRP 85 N 0.47 0.83 -0.01 0.00 6.55 -1.83 -2.41 115.95 119.55 2g0b h TRP 85 Ca 0.23 -0.22 -0.09 0.00 0.95 0.00 0.00 58.89 59.76 2g0b h TRP 85 Cb 0.16 -0.19 -0.01 0.00 -0.86 0.00 0.00 29.16 28.26 2g0b h TRP 85 CO -0.11 0.95 -0.41 0.00 -1.05 0.00 0.00 178.44 177.81 2g0b h ARG 86 N 0.60 0.01 0.00 0.49 3.08 -1.26 -1.77 114.38 115.53 2g0b h ARG 86 Ca 0.06 -0.01 -0.11 0.00 0.07 0.00 0.00 59.98 60.00 2g0b h ARG 86 Cb 0.85 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.88 2g0b h ARG 86 CO 0.07 0.43 -0.53 0.78 -1.07 0.00 0.00 179.97 179.65 2g0b h GLY 87 N 1.25 0.00 2.00 0.04 0.00 -1.20 -3.00 103.07 102.16 2g0b h GLY 87 Ca -0.00 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.23 2g0b h GLY 87 CO 0.05 0.00 -0.46 0.83 0.00 0.00 0.00 176.54 176.97 2g0b h GLU 88 N 0.00 0.00 -1.07 4.80 5.08 -0.90 -3.48 114.58 119.01 2g0b h GLU 88 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2g0b h GLU 88 Cb 1.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.39 2g0b h GLU 88 CO 0.07 0.46 0.00 0.41 -1.00 0.00 0.00 179.01 178.95 2g0b n GLY 89 N 0.48 0.63 3.61 -3.84 0.00 -0.72 -5.10 105.19 100.24 2g0b n GLY 89 Ca 0.00 -0.34 -0.33 0.00 0.00 0.00 0.00 46.02 45.35 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 -1.69 2.71 -0.28 1.61 -0.14 -0.85 -5.04 119.74 116.06 2g0b s LYS 90 Ca 0.00 -0.60 -0.29 0.00 -1.36 0.00 0.00 55.97 53.72 2g0b s LYS 90 Cb 0.00 -2.59 0.01 0.00 -1.68 0.00 0.00 37.83 33.57 2g0b s LYS 90 CO 0.00 0.64 1.04 0.21 -0.76 0.00 0.00 175.35 176.48 2g0b s LYS 91 N -1.12 4.15 0.13 1.68 2.20 -1.26 -4.71 119.74 120.80 2g0b s LYS 91 Ca 0.15 1.17 0.07 0.00 -0.36 0.00 0.00 55.97 57.00 2g0b s LYS 91 Cb -0.11 -3.69 -0.04 0.00 -1.51 0.00 0.00 37.83 32.48 2g0b s LYS 91 CO 0.05 -0.77 -0.09 -0.51 -0.36 0.00 0.00 175.35 173.67 2g0b s LEU 92 N 3.41 3.06 -0.14 5.43 1.43 -1.26 -1.18 118.68 129.42 2g0b s LEU 92 Ca 0.44 -0.42 -0.12 0.00 -1.03 0.00 0.00 54.13 53.00 2g0b s LEU 92 Cb -0.14 -1.82 0.04 0.00 0.03 0.00 0.00 46.19 44.31 2g0b s LEU 92 CO 0.11 0.15 0.37 0.00 0.23 0.00 0.00 176.35 177.21 2g0b s ALA 93 N -1.37 -0.91 -0.21 4.21 0.00 -0.98 -1.71 121.76 120.80 2g0b s ALA 93 Ca 0.23 1.10 -0.08 0.00 0.00 0.00 0.00 51.96 53.21 2g0b s ALA 93 Cb -0.10 -0.65 -0.04 0.00 0.00 0.00 0.00 23.12 22.33 2g0b s ALA 93 CO 0.15 -0.19 0.08 -2.00 0.00 0.00 0.00 175.76 173.80 2g0b s GLU 94 N 0.42 3.91 0.14 0.00 2.12 -0.54 0.10 118.70 124.85 2g0b s GLU 94 Ca -0.02 -0.37 -0.24 0.00 0.36 0.00 0.00 54.97 54.70 2g0b s GLU 94 Cb -0.04 -3.28 -0.08 0.00 0.26 0.00 0.00 34.13 30.99 2g0b s GLU 94 CO -0.02 0.13 0.73 0.08 -0.54 0.00 0.00 175.26 175.65 2g0b s VAL 95 N 0.76 4.47 0.08 3.70 1.01 -0.67 -0.89 120.40 128.86 2g0b s VAL 95 Ca 0.04 1.60 -0.26 0.00 0.00 0.00 0.00 61.98 63.36 2g0b s VAL 95 Cb -0.13 -4.09 0.07 0.00 0.00 0.00 0.00 36.38 32.23 2g0b s VAL 95 CO 0.02 0.52 0.65 0.54 0.00 0.00 0.00 175.10 176.83 2g0b s VAL 96 N -1.06 0.00 -1.44 2.92 0.11 -0.12 -4.60 120.40 116.22 2g0b s VAL 96 Ca 0.34 0.00 -0.02 0.00 -2.93 0.00 0.00 61.98 59.38 2g0b s VAL 96 Cb -0.22 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.63 2g0b s VAL 96 CO 0.24 0.00 0.25 0.00 -3.33 0.00 0.00 175.10 172.27 2g0b n GLN 97 N 0.05 -2.79 -2.37 1.54 1.13 -1.26 -1.05 117.38 112.63 2g0b n GLN 97 Ca -0.17 0.83 -0.42 0.00 -1.94 0.00 0.00 57.00 55.29 2g0b n GLN 97 Cb 0.62 -5.37 -0.03 0.00 0.11 0.00 0.00 30.24 25.57 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 -2.99 2.95 -0.21 1.08 5.36 -1.26 -4.23 117.98 118.68 2g0b s PHE 98 Ca 0.13 1.01 -0.17 0.00 -0.96 0.00 0.00 56.93 56.94 2g0b s PHE 98 Cb -0.06 -3.52 0.06 0.00 -0.34 0.00 0.00 43.02 39.16 2g0b s PHE 98 CO 0.16 -1.81 0.54 0.00 -1.46 0.00 0.00 175.22 172.65 2g0b s ALA 99 N 2.73 -1.37 0.01 11.12 0.00 -0.54 -5.01 121.76 128.69 2g0b s ALA 99 Ca 0.58 1.64 0.06 0.00 0.00 0.00 0.00 51.96 54.24 2g0b s ALA 99 Cb -0.26 -0.96 -0.02 0.00 0.00 0.00 0.00 23.12 21.88 2g0b s ALA 99 CO 0.21 -0.27 -0.18 -1.64 0.00 0.00 0.00 175.76 173.88 2g0b s MET 100 N 0.60 1.35 -0.27 0.00 -1.94 -1.26 -0.95 119.30 116.82 2g0b s MET 100 Ca -0.02 -0.73 -0.07 0.00 -1.71 0.00 0.00 55.69 53.16 2g0b s MET 100 Cb -0.05 -1.36 -0.00 0.00 2.01 0.00 0.00 34.83 35.43 2g0b s MET 100 CO -0.03 0.36 0.06 0.34 -0.01 0.00 0.00 175.02 175.74 2g0b s ASP 101 N -0.71 5.04 0.44 3.03 2.15 0.14 -4.91 116.67 121.86 2g0b s ASP 101 Ca 0.06 -0.54 0.25 0.00 0.43 0.00 0.00 52.55 52.75 2g0b s ASP 101 Cb -0.07 -1.88 0.87 0.00 -0.30 0.00 0.00 42.92 41.54 2g0b s ASP 101 CO 0.00 -0.13 1.80 1.12 -0.17 0.00 0.00 175.17 177.79 2g0b h HIS 102 N 8.22 0.00 0.00 -5.34 2.07 -2.00 -3.25 115.15 114.85 2g0b h HIS 102 Ca -0.34 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.18 2g0b h HIS 102 Cb 1.14 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.12 2g0b h HIS 102 CO 0.62 0.20 0.00 1.79 -3.07 0.00 0.00 177.93 177.48 2g0b h THR 103 N 0.00 0.00 0.00 6.12 1.35 -1.96 -3.55 112.91 114.87 2g0b h THR 103 Ca -0.00 -0.34 0.00 0.00 -0.55 0.00 0.00 66.41 65.52 2g0b h THR 103 Cb 0.79 1.18 0.00 0.00 -1.73 0.00 0.00 68.15 68.38 2g0b h THR 103 CO 0.03 0.00 0.00 0.18 -0.25 0.00 0.00 175.52 175.48 2g0b n LEU 104 N -2.34 0.57 -1.49 3.87 4.77 -1.23 -5.23 117.00 115.92 2g0b n LEU 104 Ca 0.03 -0.76 0.00 0.00 -0.03 0.00 0.00 56.01 55.24 2g0b n LEU 104 Cb 0.30 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.39 2g0b n LEU 104 CO 0.24 0.14 0.00 -1.54 -1.33 0.00 0.00 177.39 174.90 2g0b n SER 114 N -0.39 0.00 0.00 -1.43 3.41 -1.26 -4.93 113.62 109.03 2g0b n SER 114 Ca 0.00 0.99 0.05 0.00 -0.26 0.00 0.00 58.87 59.65 2g0b n SER 114 Cb 0.01 -1.49 0.23 0.00 -0.26 0.00 0.00 64.21 62.69 2g0b n SER 114 CO 0.00 0.00 0.00 -2.65 -0.16 0.00 0.00 175.04 172.23 2g0b n PRO 115 N 1.35 0.08 0.04 4.33 -0.02 -1.26 -1.62 135.00 137.90 2g0b n PRO 115 Ca 0.00 0.25 0.11 0.00 -2.02 0.00 0.00 63.50 61.84 2g0b n PRO 115 Cb 0.00 -1.50 0.44 0.00 -0.02 0.00 0.00 33.50 32.42 2g0b n PRO 115 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 2g0b n PHE 116 N -1.37 0.25 0.95 6.00 3.01 -1.26 -2.41 117.46 122.63 2g0b n PHE 116 Ca 0.04 0.09 0.10 0.00 1.01 0.00 0.00 57.45 58.69 2g0b n PHE 116 Cb 0.09 -0.64 0.51 0.00 -0.01 0.00 0.00 39.48 39.43 2g0b n PHE 116 CO 0.00 0.00 0.00 -1.91 1.01 0.00 0.00 176.76 175.86 2g0b n GLU 117 N -1.72 0.25 -0.61 -1.08 2.13 -0.64 -2.54 120.64 116.42 2g0b n GLU 117 Ca 0.05 0.10 0.07 0.00 0.66 0.00 0.00 57.16 58.04 2g0b n GLU 117 Cb 0.26 -1.50 0.31 0.00 0.27 0.00 0.00 31.44 30.78 2g0b n GLU 117 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2g0b n ALA 118 N -1.32 3.35 -0.09 4.31 0.00 -1.01 -4.71 120.51 121.03 2g0b n ALA 118 Ca 0.09 -2.22 -0.06 0.00 0.00 0.00 0.00 53.44 51.25 2g0b n ALA 118 Cb 0.18 -0.86 0.00 0.00 0.00 0.00 0.00 19.45 18.78 2g0b n ALA 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2g0b h ALA 119 N 2.48 0.30 -0.67 0.00 0.00 -1.67 -1.80 119.26 117.89 2g0b h ALA 119 Ca 0.01 0.08 0.14 0.00 0.00 0.00 0.00 54.91 55.15 2g0b h ALA 119 Cb 1.65 0.13 -0.12 0.00 0.00 0.00 0.00 17.79 19.44 2g0b h ALA 119 CO 0.33 -0.39 -0.04 0.77 0.00 0.00 0.00 179.25 179.92 2g0b h SER 120 N 0.12 -0.39 -0.72 0.00 0.02 -1.87 -1.27 113.55 109.45 2g0b h SER 120 Ca 0.15 0.18 -0.03 0.00 -0.84 0.00 0.00 61.79 61.25 2g0b h SER 120 Cb 0.19 0.33 -0.03 0.00 0.14 0.00 0.00 62.40 63.03 2g0b h SER 120 CO -0.23 -0.17 0.31 -0.07 -1.14 0.00 0.00 176.83 175.53 2g0b h LEU 121 N 0.08 0.96 -0.86 5.07 3.38 -1.71 -2.13 115.31 120.11 2g0b h LEU 121 Ca 0.35 -0.15 -0.07 0.00 0.09 0.00 0.00 57.88 58.10 2g0b h LEU 121 Cb 0.58 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 2g0b h LEU 121 CO -0.62 0.85 0.09 -0.26 0.09 0.00 0.00 178.44 178.59 2g0b h PHE 122 N 1.01 0.98 -0.68 1.13 0.05 -0.75 -2.63 116.94 116.05 2g0b h PHE 122 Ca 0.24 -0.12 -0.04 0.00 3.82 0.00 0.00 57.97 61.87 2g0b h PHE 122 Cb 0.17 -0.28 -0.03 0.00 2.00 0.00 0.00 35.95 37.81 2g0b h PHE 122 CO 0.01 0.85 0.28 1.15 -0.18 0.00 0.00 178.31 180.41 2g0b h THR 123 N 0.88 1.24 -0.28 -1.55 2.02 -0.88 0.50 112.91 114.85 2g0b h THR 123 Ca 0.18 -0.75 0.06 0.00 0.77 0.00 0.00 66.41 66.67 2g0b h THR 123 Cb 0.40 0.46 -0.05 0.00 -1.74 0.00 0.00 68.15 67.21 2g0b h THR 123 CO 0.01 0.30 -0.07 0.24 0.37 0.00 0.00 175.52 176.37 2g0b h MET 124 N 0.97 -0.00 -0.65 6.66 2.86 -1.16 -0.32 114.93 123.28 2g0b h MET 124 Ca 0.23 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.81 2g0b h MET 124 Cb 0.20 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.83 2g0b h MET 124 CO -0.02 -0.00 0.17 0.28 1.06 0.00 0.00 176.91 178.40 2g0b h VAL 125 N -0.00 1.25 -0.24 -2.22 2.07 -1.12 -1.76 116.25 114.23 2g0b h VAL 125 Ca 0.14 -0.89 -0.13 0.00 0.82 0.00 0.00 66.70 66.63 2g0b h VAL 125 Cb 0.21 0.57 -0.00 0.00 -1.52 0.00 0.00 31.29 30.54 2g0b h VAL 125 CO -0.29 0.34 -0.37 0.25 0.02 0.00 0.00 177.57 177.52 2g0b h LEU 126 N 0.97 0.73 -0.86 2.57 5.85 -0.50 -1.97 115.31 122.11 2g0b h LEU 126 Ca 0.21 -0.52 -0.07 0.00 0.84 0.00 0.00 57.88 58.34 2g0b h LEU 126 Cb 0.32 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.12 2g0b h LEU 126 CO -0.00 1.11 0.06 0.71 -0.34 0.00 0.00 178.44 179.98 2g0b h THR 127 N 0.38 1.25 -0.50 1.05 1.35 -1.00 -1.95 112.91 113.48 2g0b h THR 127 Ca 0.02 -0.99 0.01 0.00 -0.55 0.00 0.00 66.41 64.90 2g0b h THR 127 Cb 0.96 0.76 -0.03 0.00 -1.73 0.00 0.00 68.15 68.11 2g0b h THR 127 CO 0.08 0.36 0.33 0.22 -0.25 0.00 0.00 175.52 176.26 2g0b h TYR 128 N 0.85 0.62 0.00 4.73 3.20 -1.26 -1.12 116.97 123.99 2g0b h TYR 128 Ca 0.17 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 62.00 2g0b h TYR 128 Cb 0.42 -0.21 -0.01 0.00 1.54 0.00 0.00 36.73 38.48 2g0b h TYR 128 CO 0.03 0.39 -0.24 0.00 -1.64 0.00 0.00 178.16 176.69 2g0b h ALA 129 N 1.19 1.12 0.06 1.82 0.00 -1.01 -0.57 119.26 121.86 2g0b h ALA 129 Ca 0.19 -0.22 -0.27 0.00 0.00 0.00 0.00 54.91 54.61 2g0b h ALA 129 Cb -0.07 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 2g0b h ALA 129 CO -0.05 0.31 -1.34 -0.07 0.00 0.00 0.00 179.25 178.09 2g0b h LEU 130 N 0.00 0.19 0.13 0.00 3.38 -1.02 -1.58 115.31 116.40 2g0b h LEU 130 Ca -0.00 -0.25 -0.29 0.00 0.09 0.00 0.00 57.88 57.43 2g0b h LEU 130 Cb 0.66 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.35 2g0b h LEU 130 CO 0.03 1.20 -1.37 -0.33 0.09 0.00 0.00 178.44 178.07 2g0b h GLU 131 N 0.03 0.27 -0.03 1.13 5.08 -1.01 -3.23 114.58 116.83 2g0b h GLU 131 Ca -0.16 -0.46 0.00 0.00 -1.00 0.00 0.00 59.36 57.74 2g0b h GLU 131 Cb 1.93 0.17 0.00 0.00 0.50 0.00 0.00 28.75 31.35 2g0b h GLU 131 CO 0.14 1.18 0.00 2.41 -1.00 0.00 0.00 179.01 181.74 2g0b n THR 132 N -3.50 0.03 -2.55 1.13 -1.04 -0.24 -4.92 114.28 103.19 2g0b n THR 132 Ca -0.12 -0.09 -0.20 0.00 -2.04 0.00 0.00 64.05 61.60 2g0b n THR 132 Cb 1.03 -0.15 -0.00 0.00 -1.82 0.00 0.00 70.33 69.40 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 -0.55 -1.27 -1.94 -1.42 8.25 -1.18 -4.94 115.22 112.16 2g0b n HIS 133 Ca 0.19 0.11 -0.41 0.00 -0.26 0.00 0.00 57.72 57.34 2g0b n HIS 133 Cb 0.17 -3.83 -0.02 0.00 1.12 0.00 0.00 29.99 27.43 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 -2.99 2.48 -0.09 1.59 1.01 -0.60 -4.84 121.20 117.76 2g0b s ILE 134 Ca 0.07 0.40 -0.09 0.00 0.00 0.00 0.00 60.65 61.03 2g0b s ILE 134 Cb -0.03 -3.26 -0.07 0.00 0.01 0.00 0.00 42.46 39.11 2g0b s ILE 134 CO 0.08 0.06 0.32 0.44 0.00 0.00 0.00 174.94 175.84 2g0b h ASP 135 N 5.00 -0.10 -3.16 3.58 3.32 -1.46 -3.41 116.42 120.19 2g0b h ASP 135 Ca -0.46 -0.18 -0.63 0.00 0.02 0.00 0.00 57.03 55.78 2g0b h ASP 135 Cb 1.22 0.03 -0.36 0.00 0.22 0.00 0.00 39.33 40.44 2g0b h ASP 135 CO 0.78 0.46 -0.84 -0.31 -1.72 0.00 0.00 179.24 177.62 2g0b s TYR 136 N -2.16 2.45 -0.39 4.55 1.51 -0.94 -0.94 117.35 121.42 2g0b s TYR 136 Ca -0.05 -1.45 -0.26 0.00 -1.01 0.00 0.00 57.07 54.30 2g0b s TYR 136 Cb -0.00 -1.73 0.02 0.00 -0.11 0.00 0.00 41.96 40.14 2g0b s TYR 136 CO 0.19 -0.73 0.93 -1.17 -1.11 0.00 0.00 175.55 173.65 2g0b s LEU 137 N 1.39 3.99 0.22 -1.29 2.96 -0.36 -2.32 118.68 123.28 2g0b s LEU 137 Ca 0.04 0.46 -0.01 0.00 -0.22 0.00 0.00 54.13 54.41 2g0b s LEU 137 Cb -0.13 -3.24 -0.04 0.00 0.50 0.00 0.00 46.19 43.27 2g0b s LEU 137 CO -0.11 -0.91 0.41 0.00 -1.32 0.00 0.00 176.35 174.42 2g0b s ILE 139 N -1.91 -0.02 -0.18 0.00 1.01 0.69 -1.67 121.20 119.12 2g0b s ILE 139 Ca 0.39 0.08 0.01 0.00 0.00 0.00 0.00 60.65 61.12 2g0b s ILE 139 Cb -0.11 -0.61 0.03 0.00 0.01 0.00 0.00 42.46 41.77 2g0b s ILE 139 CO 0.29 0.03 -0.16 -0.94 0.00 0.00 0.00 174.94 174.16 2g0b s SER 140 N 1.20 3.10 0.16 3.58 1.04 -1.26 -0.40 113.70 121.13 2g0b s SER 140 Ca -0.08 -0.67 0.04 0.00 0.48 0.00 0.00 55.95 55.72 2g0b s SER 140 Cb -0.07 -1.36 -0.05 0.00 0.10 0.00 0.00 66.02 64.65 2g0b s SER 140 CO -0.11 -0.05 -0.09 0.27 0.98 0.00 0.00 173.24 174.24 2g0b s ILE 141 N 1.35 1.16 0.27 -1.02 -4.36 -0.32 -4.88 121.20 113.42 2g0b s ILE 141 Ca 0.03 -2.06 -0.29 0.00 -0.26 0.00 0.00 60.65 58.07 2g0b s ILE 141 Cb -0.14 -1.91 -0.10 0.00 1.25 0.00 0.00 42.46 41.57 2g0b s ILE 141 CO -0.11 -0.70 1.27 0.21 0.24 0.00 0.00 174.94 175.85 2g0b s ASN 142 N -3.19 6.91 0.65 4.36 3.84 -1.26 -0.47 114.94 125.79 2g0b s ASN 142 Ca 0.18 2.51 0.23 0.00 0.21 0.00 0.00 52.86 55.99 2g0b s ASN 142 Cb 0.03 -2.63 1.22 0.00 -0.55 0.00 0.00 41.25 39.31 2g0b s ASN 142 CO 0.02 -0.46 1.68 -0.65 -2.79 0.00 0.00 177.10 174.90 2g0b h PRO 143 N 4.18 0.00 0.00 0.43 0.11 -1.92 -1.78 132.00 133.02 2g0b h PRO 143 Ca -0.47 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.55 2g0b h PRO 143 Cb 1.22 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 2g0b h PRO 143 CO 0.70 0.00 -0.41 1.57 -0.21 0.00 0.00 178.00 179.65 2g0b h LYS 144 N 0.00 0.00 -0.55 1.05 2.10 -1.96 -2.78 116.57 114.42 2g0b h LYS 144 Ca 0.04 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.69 2g0b h LYS 144 Cb 1.11 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.44 2g0b h LYS 144 CO -0.00 0.41 0.00 0.72 -2.00 0.00 0.00 179.45 178.58 2g0b n HIS 145 N -3.79 0.73 -0.21 0.07 8.25 -0.67 -4.59 115.22 115.01 2g0b n HIS 145 Ca -0.01 -0.36 -0.07 0.00 -0.26 0.00 0.00 57.72 57.01 2g0b n HIS 145 Cb 0.47 0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.62 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 4.30 0.79 0.20 0.41 1.82 -1.52 -2.61 116.42 119.80 2g0b h ASP 146 Ca 0.00 -0.13 -0.07 0.00 -0.39 0.00 0.00 57.03 56.44 2g0b h ASP 146 Cb 0.96 -0.20 -0.01 0.00 0.68 0.00 0.00 39.33 40.76 2g0b h ASP 146 CO 0.00 0.70 -0.28 0.71 -1.61 0.00 0.00 179.24 178.75 2g0b h THR 147 N 0.82 1.24 -0.30 2.25 1.35 -1.81 -2.47 112.91 113.99 2g0b h THR 147 Ca 0.21 -1.12 -0.04 0.00 -0.55 0.00 0.00 66.41 64.90 2g0b h THR 147 Cb 0.12 1.49 -0.01 0.00 -1.73 0.00 0.00 68.15 68.02 2g0b h THR 147 CO -0.03 0.33 0.02 0.15 -0.25 0.00 0.00 175.52 175.75 2g0b h PHE 148 N 0.13 0.56 0.00 4.73 3.57 -1.79 -3.02 116.94 121.12 2g0b h PHE 148 Ca 0.02 -0.09 0.00 0.00 3.53 0.00 0.00 57.97 61.43 2g0b h PHE 148 Cb 0.58 -0.15 0.00 0.00 2.79 0.00 0.00 35.95 39.17 2g0b h PHE 148 CO 0.01 0.63 0.00 1.88 -2.23 0.00 0.00 178.31 178.60 2g0b h TYR 149 N 0.33 0.00 -0.43 0.41 -1.99 -1.32 -2.81 116.97 111.16 2g0b h TYR 149 Ca 0.09 0.00 -0.12 0.00 2.00 0.00 0.00 58.73 60.70 2g0b h TYR 149 Cb 0.39 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.11 2g0b h TYR 149 CO 0.03 0.00 -0.19 0.77 -0.00 0.00 0.00 178.16 178.77 2g0b h SER 150 N 0.00 0.91 0.20 3.88 0.02 -1.35 -1.21 113.55 116.01 2g0b h SER 150 Ca 0.00 -0.40 -0.10 0.00 -0.84 0.00 0.00 61.79 60.45 2g0b h SER 150 Cb 0.69 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.97 2g0b h SER 150 CO 0.00 1.11 -0.37 -0.07 -1.14 0.00 0.00 176.83 176.35 2g0b h LEU 151 N 0.72 0.25 -0.92 5.07 3.38 -1.40 -2.61 115.31 119.80 2g0b h LEU 151 Ca 0.10 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2g0b h LEU 151 Cb 0.76 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.44 2g0b h LEU 151 CO 0.06 0.61 0.00 -0.07 0.09 0.00 0.00 178.44 179.13 2g0b h LEU 152 N 0.21 0.00 0.00 1.67 3.38 -1.40 -3.25 115.31 115.91 2g0b h LEU 152 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2g0b h LEU 152 Cb 0.76 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.51 2g0b h LEU 152 CO 0.06 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.20 2g0b n GLY 153 N 0.23 1.40 3.60 0.83 0.00 -0.98 -4.59 105.19 105.69 2g0b n GLY 153 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 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 3.17 0.27 1.61 0.40 -0.49 -4.66 117.98 116.28 2g0b s PHE 154 Ca 0.00 0.69 -0.25 0.00 -0.60 0.00 0.00 56.93 56.77 2g0b s PHE 154 Cb 0.00 -3.26 -0.09 0.00 0.51 0.00 0.00 43.02 40.18 2g0b s PHE 154 CO 0.00 -0.62 0.87 0.99 0.70 0.00 0.00 175.22 177.16 2g0b s THR 155 N 2.97 4.30 0.02 0.64 2.01 -0.51 -4.41 115.64 120.66 2g0b s THR 155 Ca 0.31 1.70 -0.30 0.00 0.31 0.00 0.00 61.69 63.71 2g0b s THR 155 Cb -0.14 -4.02 -0.05 0.00 0.01 0.00 0.00 72.50 68.30 2g0b s THR 155 CO 0.14 0.24 1.24 -1.58 -0.69 0.00 0.00 174.62 173.97 2g0b s GLN 156 N -1.84 4.38 0.00 4.92 0.74 -1.26 -0.81 119.66 125.79 2g0b s GLN 156 Ca 0.46 1.79 0.00 0.00 0.05 0.00 0.00 55.36 57.65 2g0b s GLN 156 Cb -0.19 -3.44 0.00 0.00 1.10 0.00 0.00 33.01 30.48 2g0b s GLN 156 CO 0.24 -0.37 0.00 0.44 -0.55 0.00 0.00 175.29 175.05 2g0b n ILE 157 N 4.24 0.00 -3.99 -2.34 -5.35 -0.24 -4.93 119.36 106.75 2g0b n ILE 157 Ca 0.10 -0.20 -0.12 0.00 -0.27 0.00 0.00 62.75 62.27 2g0b n ILE 157 Cb 0.46 0.70 -0.13 0.00 -1.74 0.00 0.00 39.64 38.93 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 -1.60 0.21 1.01 3.28 0.00 -1.08 -4.90 107.32 104.23 2g0b s GLY 158 Ca 0.00 -0.35 -0.13 0.00 0.00 0.00 0.00 44.72 44.25 2g0b s GLY 158 CO 0.00 -0.37 1.10 0.00 0.00 0.00 0.00 173.10 173.84 2g0b s ALA 159 N -0.68 1.04 -0.23 3.20 0.00 -1.26 -2.82 121.76 121.02 2g0b s ALA 159 Ca -0.06 -0.46 -0.29 0.00 0.00 0.00 0.00 51.96 51.15 2g0b s ALA 159 Cb -0.05 -3.08 -0.03 0.00 0.00 0.00 0.00 23.12 19.96 2g0b s ALA 159 CO -0.00 -2.83 1.77 -1.17 0.00 0.00 0.00 175.76 173.53 2g0b s LEU 160 N -6.43 3.78 0.37 0.00 2.96 -1.26 -4.36 118.68 113.74 2g0b s LEU 160 Ca 0.66 1.65 0.04 0.00 -0.22 0.00 0.00 54.13 56.26 2g0b s LEU 160 Cb -0.17 -3.53 -0.05 0.00 0.50 0.00 0.00 46.19 42.94 2g0b s LEU 160 CO 0.57 -1.45 0.07 -0.54 -1.32 0.00 0.00 176.35 173.68 2g0b s LYS 161 N 5.13 1.80 -0.35 1.98 1.02 -0.49 -4.96 119.74 123.87 2g0b s LYS 161 Ca 0.79 -2.05 -0.16 0.00 0.02 0.00 0.00 55.97 54.57 2g0b s LYS 161 Cb -0.27 -0.88 -0.01 0.00 -0.52 0.00 0.00 37.83 36.16 2g0b s LYS 161 CO 0.32 -0.29 0.40 -1.58 -0.92 0.00 0.00 175.35 173.28 2g0b s HIS 162 N -3.21 3.20 -0.62 3.18 5.65 -1.26 -0.43 115.29 121.80 2g0b s HIS 162 Ca 0.30 0.01 -0.28 0.00 0.25 0.00 0.00 55.06 55.35 2g0b s HIS 162 Cb 0.06 -2.74 0.03 0.00 -1.18 0.00 0.00 32.58 28.76 2g0b s HIS 162 CO 0.14 -0.47 1.20 -0.47 -0.65 0.00 0.00 174.74 174.49 2g0b s TYR 163 N 2.11 2.54 0.39 3.88 5.04 -0.51 -4.90 117.35 125.91 2g0b s TYR 163 Ca 0.13 0.27 0.15 0.00 -2.44 0.00 0.00 57.07 55.18 2g0b s TYR 163 Cb -0.16 -4.52 0.88 0.00 0.35 0.00 0.00 41.96 38.51 2g0b s TYR 163 CO 0.12 -1.69 1.90 0.78 -1.34 0.00 0.00 175.55 175.32 2g0b h GLY 164 N 12.13 0.00 1.28 8.97 0.00 -1.96 0.89 103.07 124.39 2g0b h GLY 164 Ca -0.26 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.03 2g0b h GLY 164 CO 1.20 0.00 0.19 -0.84 0.00 0.00 0.00 176.54 177.10 2g0b h THR 165 N 0.00 1.23 -0.00 4.70 2.02 -1.95 -3.22 112.91 115.69 2g0b h THR 165 Ca -0.00 -0.78 0.00 0.00 0.77 0.00 0.00 66.41 66.40 2g0b h THR 165 Cb 0.53 0.56 0.00 0.00 -1.74 0.00 0.00 68.15 67.49 2g0b h THR 165 CO 0.04 0.30 -0.40 0.52 0.37 0.00 0.00 175.52 176.35 2g0b n VAL 166 N -4.29 0.00 -3.77 3.16 0.31 -1.07 -4.29 118.33 108.38 2g0b n VAL 166 Ca 0.05 -0.30 -0.26 0.00 -0.01 0.00 0.00 64.34 63.82 2g0b n VAL 166 Cb 0.20 1.07 0.02 0.00 -0.91 0.00 0.00 33.84 34.22 2g0b n VAL 166 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 2g0b n ASN 167 N -0.73 -2.31 -3.45 4.52 2.85 0.28 0.19 115.26 116.61 2g0b n ASN 167 Ca 0.04 -0.94 -0.11 0.00 -0.11 0.00 0.00 54.58 53.45 2g0b n ASN 167 Cb 0.22 -3.55 -0.02 0.00 1.24 0.00 0.00 39.78 37.67 2g0b n ASN 167 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2g0b s ALA 168 N -3.70 -1.67 0.51 5.20 0.00 -1.14 -4.68 121.76 116.28 2g0b s ALA 168 Ca 0.16 0.66 -0.22 0.00 0.00 0.00 0.00 51.96 52.56 2g0b s ALA 168 Cb -0.05 0.73 -0.06 0.00 0.00 0.00 0.00 23.12 23.74 2g0b s ALA 168 CO 0.85 -0.74 1.29 -2.14 0.00 0.00 0.00 175.76 175.03 2g0b s PRO 169 N -3.50 3.37 0.04 0.00 0.02 -1.26 -1.42 135.00 132.25 2g0b s PRO 169 Ca 0.02 2.08 0.03 0.00 0.02 0.00 0.00 61.00 63.14 2g0b s PRO 169 Cb -0.01 -2.32 -0.02 0.00 0.02 0.00 0.00 34.50 32.17 2g0b s PRO 169 CO -0.11 -0.95 -0.09 0.00 -0.33 0.00 0.00 177.00 175.51 2g0b s ALA 170 N -1.39 0.71 -0.02 -1.55 0.00 0.43 -4.29 121.76 115.65 2g0b s ALA 170 Ca 0.68 -0.77 0.04 0.00 0.00 0.00 0.00 51.96 51.91 2g0b s ALA 170 Cb -0.36 -0.01 -0.01 0.00 0.00 0.00 0.00 23.12 22.74 2g0b s ALA 170 CO 0.43 0.04 -0.14 0.42 0.00 0.00 0.00 175.76 176.51 2g0b s ILE 171 N -1.24 1.13 -0.18 0.00 1.01 0.38 -1.39 121.20 120.91 2g0b s ILE 171 Ca -0.07 -0.60 -0.13 0.00 0.00 0.00 0.00 60.65 59.86 2g0b s ILE 171 Cb -0.09 -0.96 -0.05 0.00 0.01 0.00 0.00 42.46 41.37 2g0b s ILE 171 CO 0.01 0.33 0.24 0.00 0.00 0.00 0.00 174.94 175.51 2g0b s ALA 172 N -0.22 3.62 0.04 9.38 0.00 -1.13 -1.17 121.76 132.28 2g0b s ALA 172 Ca 0.03 -0.57 0.02 0.00 0.00 0.00 0.00 51.96 51.44 2g0b s ALA 172 Cb -0.07 -2.34 -0.02 0.00 0.00 0.00 0.00 23.12 20.69 2g0b s ALA 172 CO -0.00 0.06 -0.07 1.03 0.00 0.00 0.00 175.76 176.77 2g0b s ARG 173 N 0.56 0.51 -0.01 0.00 0.52 0.47 -1.08 118.95 119.91 2g0b s ARG 173 Ca 0.13 -0.73 -0.04 0.00 -0.52 0.00 0.00 55.73 54.57 2g0b s ARG 173 Cb -0.13 -0.27 0.00 0.00 0.52 0.00 0.00 34.95 35.08 2g0b s ARG 173 CO 0.02 0.04 0.09 0.00 0.02 0.00 0.00 175.30 175.47 2g0b s ALA 174 N -1.35 -0.20 -0.11 2.13 0.00 0.01 -0.22 121.76 122.03 2g0b s ALA 174 Ca -0.10 -0.03 0.03 0.00 0.00 0.00 0.00 51.96 51.87 2g0b s ALA 174 Cb -0.10 -0.01 -0.00 0.00 0.00 0.00 0.00 23.12 23.01 2g0b s ALA 174 CO 0.00 -0.12 -0.22 -1.17 0.00 0.00 0.00 175.76 174.25 2g0b s LEU 175 N -0.70 2.19 -0.81 0.00 2.96 -0.60 -1.42 118.68 120.29 2g0b s LEU 175 Ca -0.08 -0.53 -0.26 0.00 -0.22 0.00 0.00 54.13 53.05 2g0b s LEU 175 Cb -0.05 -1.44 0.03 0.00 0.50 0.00 0.00 46.19 45.23 2g0b s LEU 175 CO 0.00 0.16 1.35 -0.47 -1.32 0.00 0.00 176.35 176.07 2g0b s TYR 176 N 0.37 2.32 0.20 5.38 5.04 -1.26 -1.22 117.35 128.18 2g0b s TYR 176 Ca -0.17 -0.21 -0.11 0.00 -2.44 0.00 0.00 57.07 54.14 2g0b s TYR 176 Cb -0.18 -4.62 0.26 0.00 0.35 0.00 0.00 41.96 37.77 2g0b s TYR 176 CO 0.08 -2.05 1.72 0.28 -1.34 0.00 0.00 175.55 174.24 2g0b h VAL 177 N 6.26 0.69 -1.14 3.14 2.07 -1.28 -2.86 116.25 123.12 2g0b h VAL 177 Ca -0.16 -0.10 0.32 0.00 0.82 0.00 0.00 66.70 67.59 2g0b h VAL 177 Cb 1.04 0.38 -0.08 0.00 -1.52 0.00 0.00 31.29 31.12 2g0b h VAL 177 CO 1.31 0.05 0.77 -0.65 0.02 0.00 0.00 177.57 179.08 2g0b h PRO 178 N 0.28 0.19 -2.14 1.57 0.11 -1.80 -1.96 132.00 128.26 2g0b h PRO 178 Ca 0.29 -0.01 -0.54 0.00 0.11 0.00 0.00 66.00 65.85 2g0b h PRO 178 Cb 0.41 -0.04 -0.41 0.00 0.11 0.00 0.00 31.00 31.07 2g0b h PRO 178 CO -0.36 0.13 -0.89 0.39 -0.21 0.00 0.00 178.00 177.06 2g0b n GLU 179 N -4.44 2.26 0.20 1.05 1.02 -1.08 -4.90 120.64 114.74 2g0b n GLU 179 Ca 0.27 -4.21 0.05 0.00 -0.02 0.00 0.00 57.16 53.25 2g0b n GLU 179 Cb 1.10 -2.00 0.43 0.00 -0.02 0.00 0.00 31.44 30.95 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 2.98 0.00 0.00 -0.32 5.08 -1.33 -3.08 115.95 119.28 2g0b h TRP 180 Ca 0.12 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.09 2g0b h TRP 180 Cb 0.72 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.88 2g0b h TRP 180 CO 0.67 0.32 0.00 0.00 -1.28 0.00 0.00 178.44 178.16 2g0b h ARG 181 N 0.00 0.00 -0.00 0.12 3.08 -1.90 -2.47 114.38 113.20 2g0b h ARG 181 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2g0b h ARG 181 Cb 0.64 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.69 2g0b h ARG 181 CO 0.04 0.00 -0.33 -1.13 -1.07 0.00 0.00 179.97 177.48 2g0b n SER 182 N -2.95 0.67 -0.00 7.04 3.41 -1.16 -4.23 113.62 116.40 2g0b n SER 182 Ca 0.03 -0.49 0.07 0.00 -0.26 0.00 0.00 58.87 58.22 2g0b n SER 182 Cb 0.42 0.13 -0.08 0.00 -0.26 0.00 0.00 64.21 64.41 2g0b n SER 182 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2g0b n GLN 183 N -1.11 2.11 -4.86 4.33 6.02 -0.94 -4.96 117.38 117.97 2g0b n GLN 183 Ca 0.09 -0.01 -0.31 0.00 -0.01 0.00 0.00 57.00 56.76 2g0b n GLN 183 Cb 0.33 -1.19 -0.13 0.00 1.02 0.00 0.00 30.24 30.27 2g0b n GLN 183 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.06 175.97 2g0b s THR 184 N -2.41 2.72 0.24 5.09 -1.32 -1.15 -4.20 115.64 114.62 2g0b s THR 184 Ca 0.05 -1.03 0.28 0.00 -1.21 0.00 0.00 61.69 59.77 2g0b s THR 184 Cb 0.11 -2.08 0.29 0.00 -1.51 0.00 0.00 72.50 69.31 2g0b s THR 184 CO 0.59 0.46 1.96 -0.07 -2.21 0.00 0.00 174.62 175.36 2g0b h LEU 185 N 4.97 0.00 -0.37 9.08 3.38 -1.90 -3.03 115.31 127.45 2g0b h LEU 185 Ca -0.46 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.51 2g0b h LEU 185 Cb 1.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.90 2g0b h LEU 185 CO 0.48 0.14 0.00 0.18 0.09 0.00 0.00 178.44 179.33 2g0b n LEU 186 N -3.40 0.60 0.06 1.67 4.77 -1.26 -2.72 117.00 116.73 2g0b n LEU 186 Ca -0.01 0.61 0.13 0.00 -0.03 0.00 0.00 56.01 56.71 2g0b n LEU 186 Cb 0.33 -0.49 0.49 0.00 -2.33 0.00 0.00 43.42 41.42 2g0b n LEU 186 CO 0.30 -0.38 0.90 0.00 -1.33 0.00 0.00 177.39 176.89 2g0b n ALA 187 N -1.73 2.22 0.30 -1.18 0.00 -1.15 -3.22 120.51 115.75 2g0b n ALA 187 Ca 0.04 -0.05 0.18 0.00 0.00 0.00 0.00 53.44 53.61 2g0b n ALA 187 Cb 0.29 -1.45 0.78 0.00 0.00 0.00 0.00 19.45 19.07 2g0b n ALA 187 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 2g0b h GLN 188 N 0.00 0.00 0.00 0.00 1.08 -1.72 -2.65 115.11 111.82 2g0b h GLN 188 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2g0b h GLN 188 Cb 0.59 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.02 2g0b h GLN 188 CO 0.00 0.00 -1.07 1.19 -0.95 0.00 0.00 178.83 178.00 2g0b n PHE 189 N -3.01 0.14 -0.16 2.96 3.01 -1.20 -4.64 117.46 114.56 2g0b n PHE 189 Ca -0.00 0.04 -0.09 0.00 1.01 0.00 0.00 57.45 58.41 2g0b n PHE 189 Cb 0.25 -0.31 0.00 0.00 -0.01 0.00 0.00 39.48 39.41 2g0b n PHE 189 CO 0.00 0.00 0.00 0.52 1.01 0.00 0.00 176.76 178.29 2g0b h MET 190 N 0.00 0.74 0.00 -1.08 2.86 -1.61 -3.54 114.93 112.30 2g0b h MET 190 Ca 0.00 -0.17 0.00 0.00 -2.06 0.00 0.00 59.70 57.47 2g0b h MET 190 Cb 0.68 -0.10 0.00 0.00 0.06 0.00 0.00 31.60 32.24 2g0b h MET 190 CO 0.00 0.71 0.00 -0.25 1.06 0.00 0.00 176.91 178.43